A0A3Q0KTR8_SCHMA Loading...

Meso-ectoderm gene expression control protein

AlphaFold DB , UniProt , Accession A0A3Q0KTR8, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 951 aa.

						>A0A3Q0KTR8_SCHMA|A0A3Q0KTR8
MQTEYMTPQHYSSNKCDQFNDSTENCPIPDKTLNYTDSINFTKSFNFYPMDSINMYPLNEHNHYAFGSRSDLIKPSENLVINIHNFNHTTETSQYFHTNYSPRVVNTTNITTSISTAVPTDTTVNVTTTTTNSHSNNVSLNHDGILPVYSNQFNNKYLANVDDQTITNYHTNQINREHCENEFLMSLQFHHTHPVSQYYSHISTLPTVPGPQQHQQQQQKQQQVLHSQLHPAQQSQNTNNYTHTAATTSPRMKEKSKNAARTRREKENTEFYELARLLPLPSAITSQLDKASIIRLTTSYLKIRTIFPNGFGDNWNYSHALSNHVIERELAPNIFKSMDGFIFIVSLEGRILYISETASVLLGLSQVEMTGNEMTEYLHPLDHDELKQILTVHPSEIAANSGQSEFTLERSFFLRVKCVLAKRNAGLTTAGFKVIHCNGHLRVRVIHLDGYQYYQNLGLISFAYAIPSPNTNNTEIRLSMDMFMFRASLDLKLIFLEGRISQITGFQPQELVDKTLYQLVHTADVASLRHSHEILLNKGQVTTPYYRLLNKSGGWVWIQSYATIIHNSRSSRPNCVVSVNYLLSEIECREYCLLNDPLVYEDIVNQHQQTKTNHLLTTTPPPPPSSQLSNKTTANYVNDSKHKMSEYFLNEYAMRIPYREHGDHAHKRIRRCNTDSNHHQEVMSIGVVTNDSNIHDTNQNSLLKSDIVSTHSTNSIERYFDSQNQQGLKSTLSTDASQPSYDLWATELHKQQEYSDQKHGTVYPEKISKLLNCTSSNYSMYSECSKENDNHQSLLQWSHMNFDPDNRSHYQNRHDRQNESHLLFNNFAITPGDRPEVGIVPLPTHSEMTTKLEDDVNFPREKLTMTQQNNHDKKTESMTNYSETSETVFRNDKVLMVNDLGQSDHQKDSVVVAEEEDDVDGEEEEEDEEDEEYNDDDDDDDENEGEQEEND
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	34.1	Very low	32.9	Very low	218 Å²	218	162.1 Å²	162.1	100%	1.074	79%	0.789	S	S	*	*				0	129.3	0	-76.7	51.9	164.3	0	0	106.4
2	Q	30.2	Very low	32.6	Very low	175 Å²	175	157.2 Å²	157.2	82%	0.818	78%	0.783	S	S	*	*				59.1	131.2	95	-63.2	-179.4	-28.3	0	0	113.7
3	T	32.2	Very low	32.8	Very low	101 Å²	101	154.2 Å²	154.2	62%	0.62	79%	0.787	S	S	*	*			cis	-159	130.1	-5.8	16.3	0	0	0	0	106.4	Y5	T3-Y5 HydrophobicContact CG2-CE2 3.98Å
4	E	31.7	Very low	32.7	Very low	151 Å²	151	154.5 Å²	154.5	71%	0.706	79%	0.791	S	S	*	*				64.9	154.3	77.1	-84.4	-153.4	128	0	0	117.4
5	Y	34.8	Very low	32.7	Very low	165 Å²	165	158 Å²	158	65%	0.647	80%	0.798	S	S	*	*			trans	84.4	137.3	169.5	-46.5	-57.4	0	0	0	117.4	T3	T3-Y5 HydrophobicContact CG2-CE2 3.98Å
6	M	34.7	Very low	32.4	Very low	167 Å²	167	154.6 Å²	154.6	82%	0.823	79%	0.792	S	S	*	*			cis	-152.4	140.3	0.8	-137	169.4	-168.8	0	0	113.6
7	T	28.6	Very low	32.6	Very low	122 Å²	122	155.4 Å²	155.4	75%	0.748	80%	0.798	S	S	*	*			trans	-105.6	154.8	160.2	52.5	0	0	0	0	110.3
8	P	42.6	Very low	32.5	Very low	130 Å²	130	155.9 Å²	155.9	84%	0.844	80%	0.797	S	S	*	*			trans	-110.6	119.4	156.3	1.7	19.4	0	0	0	110.5
9	Q	31	Very low	32.6	Very low	161 Å²	161	158.6 Å²	158.6	75%	0.752	80%	0.803	S	S	*	*			trans	-86	158.9	170.7	-88.4	-168	-7	0	0	112.6
10	H	30.2	Very low	32.6	Very low	152 Å²	152	157.1 Å²	157.1	70%	0.704	80%	0.797	S	S	*	*			trans	31.9	126.3	151.9	-66.1	-64	0	0	0	120.5
11	Y	32.2	Very low	32.8	Very low	241 Å²	241	156.1 Å²	156.1	95%	0.945	79%	0.794	S	S	*	*				-142.9	142.2	116.4	-112.3	-76.4	0	0	0	111
12	S	29.1	Very low	32.8	Very low	103 Å²	103	149.8 Å²	149.8	72%	0.72	77%	0.771	S	S	*	*			trans	-121.1	137.6	177.3	55.5	0	0	0	0	110.9
13	S	35.2	Very low	32.8	Very low	118 Å²	118	147.2 Å²	147.2	83%	0.825	77%	0.767	S	S	*	*			trans	-160	124.5	158.6	62.8	0	0	0	0	111.2
14	N	30.8	Very low	32.8	Very low	159 Å²	159	149.8 Å²	149.8	85%	0.85	77%	0.772	S	S	*	*			trans	-59.6	150	178.2	-52	-46.5	0	0	0	112.7
15	K	33.6	Very low	32.9	Very low	207 Å²	207	149 Å²	149	90%	0.9	77%	0.773	S	S	*	*				-157	138	119.7	-113.8	177.6	-176.9	-172.4	0	112.1
16	C	27.9	Very low	32.5	Very low	104 Å²	104	146 Å²	146	70%	0.703	78%	0.775	S	S	*	*			trans	-72.2	159.4	162.1	-51.1	0	0	0	0	109.4
17	D	35.3	Very low	32.7	Very low	167 Å²	167	144.2 Å²	144.2	89%	0.893	78%	0.776	S	S	*	*				-148.3	146.6	109.1	-91	-36.8	0	0	0	109.4
18	Q	31.7	Very low	32.9	Very low	165 Å²	165	145.4 Å²	145.4	77%	0.771	78%	0.776	S	S	*	*			trans	-92.4	157.9	175.7	-64.3	170.1	-32.4	0	0	109.4
19	F	34.1	Very low	32.8	Very low	208 Å²	208	144 Å²	144	91%	0.912	77%	0.767	S	S	*	*				-164.3	158.8	118.3	-110.1	-73.2	0	0	0	110.9
20	N	32.6	Very low	33	Very low	127 Å²	127	143.7 Å²	143.7	68%	0.679	77%	0.771	S	S	*	*			trans	-97.4	-175.3	-167.2	-68.7	-15.6	0	0	0	113.4
21	D	35.8	Very low	33	Very low	138 Å²	138	144.6 Å²	144.6	74%	0.738	77%	0.772	S	S	*	*			trans	84	141.5	143.9	-73.4	-56.7	0	0	0	119.6
22	S	33.9	Very low	33.1	Very low	85 Å²	85	140.2 Å²	140.2	59%	0.594	77%	0.771	S	S	*	*			cis	-165.9	159	-37.3	29.1	0	0	0	0	110.4
23	T	30.7	Very low	33	Very low	120 Å²	120	141.5 Å²	141.5	74%	0.736	77%	0.769	S	S	*	*			trans	40.3	134.4	152.8	50.3	0	0	0	0	123
24	E	32	Very low	32.9	Very low	156 Å²	156	144 Å²	144	73%	0.729	77%	0.773	S	S	*	*				106.3	136.7	129.4	-97.4	-178.5	-128.4	0	0	123
25	N	34.2	Very low	32.7	Very low	133 Å²	133	144.9 Å²	144.9	71%	0.711	77%	0.766	S	S	*	*			trans	70	112.5	152.3	-57.7	-32.6	0	0	0	121.7
26	C	26.7	Very low	32.7	Very low	103 Å²	103	141.3 Å²	141.3	70%	0.696	76%	0.762	S	S	*	*			trans	-83.4	157.1	159.5	-170.2	0	0	0	0	110.3
27	P	38	Very low	32.8	Very low	130 Å²	130	142.4 Å²	142.4	84%	0.844	76%	0.761	S	S	*	*				-138.8	171.9	115.6	36.7	-24.5	0	0	0	115.7
28	I	33.8	Very low	32.6	Very low	146 Å²	146	139 Å²	139	75%	0.749	75%	0.75	S	S	*	*			trans	-120.8	168.6	-168.4	-53.4	160	0	0	0	107.6
29	P	39.5	Very low	32.5	Very low	101 Å²	101	137.9 Å²	137.9	66%	0.656	75%	0.747	S	S	*	*			cis	-118	-168.7	-33.8	35.7	-19.7	0	0	0	111.8
30	D	34.7	Very low	32.3	Very low	155 Å²	155	134.1 Å²	134.1	83%	0.829	74%	0.737	S	S	*	*				-150.3	170.7	110.3	-142.4	-21.4	0	0	0	112.5
31	K	31	Very low	32.1	Very low	170 Å²	170	137.1 Å²	137.1	74%	0.739	74%	0.744	S	S	*	*			trans	-105.2	148.2	-163.7	-58.4	169.1	-177.1	170.2	0	114.1
32	T	33.5	Very low	31.7	Very low	149 Å²	149	136.4 Å²	136.4	91%	0.914	75%	0.745	S	S	*	*			trans	-158.3	147.9	134.7	-6.2	0	0	0	0	110.9
33	L	28.5	Very low	31.4	Very low	131 Å²	131	141.3 Å²	141.3	69%	0.686	76%	0.756	S	S	*	*			trans	-87.6	155.4	-176.8	-72.8	77	0	0	0	111.9	Y35	L33-Y35 HydrophobicContact CD2-CD2 4.49Å; L33-Y35 HydrophobicContact CD2-CE2 4.33Å
34	N	32	Very low	31.2	Very low	170 Å²	170	140 Å²	140	91%	0.909	75%	0.751	S	S	*	*				-150.3	144.3	129	-103.3	-36.7	0	0	0	110.9
35	Y	28.2	Very low	31.1	Very low	178 Å²	178	142.6 Å²	142.6	70%	0.698	76%	0.761	S	S	*	*			trans	-85.9	133.4	-175.9	-102.9	-103.9	0	0	0	112	L33	L33-Y35 HydrophobicContact CD2-CD2 4.49Å; L33-Y35 HydrophobicContact CD2-CE2 4.33Å
36	T	33.6	Very low	30.6	Very low	132 Å²	132	143.4 Å²	143.4	81%	0.81	77%	0.765	S	S	*	*			trans	-150.6	118.1	143.7	47.4	0	0	0	0	107.9
37	D	29	Very low	30.8	Very low	127 Å²	127	147.3 Å²	147.3	68%	0.679	77%	0.77	S	S	*	*			trans	-70.2	131.2	-166.9	-60.1	-81.2	0	0	0	114.1
38	S	31.8	Very low	30.3	Very low	95 Å²	95	150.9 Å²	150.9	66%	0.664	77%	0.768	S	S	*	*			trans	-137.5	96.6	164.5	49.6	0	0	0	0	108.3	N40	S38-N40 PolarHBondContact O-N 3.14Å
39	I	30	Very low	30	Very low	141 Å²	141	148.4 Å²	148.4	72%	0.723	76%	0.762	S	S	*	*			trans	-74.4	89	-173.8	-57.8	177.8	0	0	0	109.3	F41	I39-F41 HydrophobicContact CG2-CD2 3.66Å; I39-F41 HydrophobicContact CG2-CE2 3.97Å
40	N	28.8	Very low	29.5	Very low	130 Å²	130	152.2 Å²	152.2	70%	0.695	77%	0.773	S	S	*	*			trans	-89	108.4	159.6	-69.1	-74.5	0	0	0	107.9	S38 T42	S38-N40 PolarHBondContact O-N 3.14Å; N40-T42 PolarHBondContact O-N 3.21Å
41	F	28.4	Very low	29.2	Very low	190 Å²	190	150.8 Å²	150.8	83%	0.833	77%	0.766	S	S	*	*			trans	-78.4	104.8	167.4	-105.9	-86.7	0	0	0	109.1	I39	I39-F41 HydrophobicContact CG2-CD2 3.66Å; I39-F41 HydrophobicContact CG2-CE2 3.97Å
42	T	26.9	Very low	28.9	Very low	122 Å²	122	147.9 Å²	147.9	75%	0.748	77%	0.766	S	S	*	*			trans	-142.8	86.7	172.5	-16.6	0	0	0	0	109.3	N40	N40-T42 PolarHBondContact O-N 3.21Å
43	K	28.6	Very low	28.8	Very low	189 Å²	189	147.3 Å²	147.3	82%	0.822	76%	0.756	S	S	*	*			trans	172.9	144.7	168.8	-100.3	158.3	-176.8	-175.7	0	108.1
44	S	26.6	Very low	28.6	Very low	92 Å²	92	145.9 Å²	145.9	64%	0.643	75%	0.75	S	S	*	*			cis	-169.7	118.4	-18.7	39.4	0	0	0	0	108.2
45	F	28.6	Very low	28.4	Very low	211 Å²	211	146 Å²	146	93%	0.925	75%	0.747	S	S	*	*			trans	-122.4	102.1	167	-88.5	-80.8	0	0	0	108.8
46	N	25.2	Very low	28.4	Very low	149 Å²	149	145 Å²	145	80%	0.797	74%	0.743	S	S	*	*			trans	-87	123.6	161.8	-72.9	-16	0	0	0	107.4
47	F	30.9	Very low	28.1	Very low	186 Å²	186	144.1 Å²	144.1	82%	0.816	74%	0.739	S	S	*	*			trans	-145.9	149.9	139.1	-104.7	-76.8	0	0	0	108.6
48	Y	27	Very low	28.1	Very low	204 Å²	204	146.4 Å²	146.4	80%	0.8	75%	0.751	S	S	*	*			trans	-68.6	148.3	-146.1	-71.1	-99.9	0	0	0	116.3
49	P	27	Very low	27.8	Very low	95 Å²	95	148.7 Å²	148.7	62%	0.617	76%	0.756	S	S	*	*			trans	-71.2	150.7	157.1	34	-33.8	0	0	0	110.3
50	M	28.8	Very low	27.9	Very low	180 Å²	180	151 Å²	151	89%	0.887	76%	0.763	S	S	*	*			trans	-117	78.5	164.9	-92.1	-71.2	-178	0	0	108.5
51	D	28.4	Very low	27.9	Very low	126 Å²	126	152.6 Å²	152.6	67%	0.674	77%	0.766	S	S	*	*			trans	-72.5	155.1	169.1	-67.5	-59.2	0	0	0	111	I53	D51-I53 PolarHBondContact O-N 2.97Å
52	S	25.3	Very low	28.1	Very low	108 Å²	108	151.6 Å²	151.6	76%	0.755	77%	0.769	S	S	*	*			trans	-29.6	122.5	177.8	55.2	0	0	0	0	116.7
53	I	30.3	Very low	28.1	Very low	137 Å²	137	153.4 Å²	153.4	70%	0.703	77%	0.769	S	S	*	*			trans	-118.4	98.9	158.6	-60.2	-178.9	0	0	0	108.7	D51 M55	D51-I53 PolarHBondContact O-N 2.97Å; I53-M55 HydrophobicContact CG2-CG 4.2Å; I53-M55 PolarHBondContact O-N 3.03Å
54	N	24.5	Very low	28.1	Very low	102 Å²	102	156 Å²	156	55%	0.545	78%	0.776	S	S	.	*			trans	-69.7	124.1	165.6	-73.7	-6.5	0	0	0	109.1
55	M	29.2	Very low	28	Very low	171 Å²	171	155.3 Å²	155.3	84%	0.842	78%	0.776	S	S	*	*			trans	-132.5	125.2	169.6	-96.1	-72	162.9	0	0	109.7	I53	I53-M55 HydrophobicContact CG2-CG 4.2Å; I53-M55 PolarHBondContact O-N 3.03Å
56	Y	27.2	Very low	28.1	Very low	157 Å²	157	155.9 Å²	155.9	62%	0.616	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-73.9	153.1	-171	-79.3	-90.3	0	0	0	113	Y881	Y56-Y881 VanDerWaalsContact OH-CE1 3.24Å; Y56-Y881 WeakPolarHBondContact OH-CE1 3.14Å; Y56-Y881 PolarHBondContact OH-OH 3.02Å
57	P	26.9	Very low	28.3	Very low	114 Å²	114	151.8 Å²	151.8	74%	0.74	77%	0.771	S	S	*	*	P	Polyproline II helix	trans	-71.2	133.8	178.1	29.7	-35	0	0	0	111.9
58	L	30.6	Very low	28.1	Very low	176 Å²	176	148.6 Å²	148.6	92%	0.921	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-101.2	118.7	168.5	-86.7	166.9	0	0	0	110.4
59	N	25.5	Very low	28.2	Very low	143 Å²	143	150.8 Å²	150.8	77%	0.765	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-83.7	116.8	172.7	-76.7	-54.5	0	0	0	110.7
60	E	32	Very low	28.2	Very low	190 Å²	190	151 Å²	151	89%	0.888	78%	0.782	S	S	*	*			trans	-142	91.4	155.2	-100	174.2	-158.4	0	0	107.7
61	H	27.9	Very low	28.2	Very low	163 Å²	163	149.9 Å²	149.9	76%	0.755	78%	0.78	S	S	*	*				46	87.6	86.8	-83.9	48.5	0	0	0	114.2
62	N	32	Very low	28.2	Very low	168 Å²	168	151.7 Å²	151.7	90%	0.898	79%	0.789	S	S	*	*			trans	-147.3	125.8	136.7	-103.1	-54.5	0	0	0	110.8
63	H	27.5	Very low	28.5	Very low	161 Å²	161	154.6 Å²	154.6	75%	0.745	79%	0.794	S	S	*	*			trans	-77.5	143	173.2	-70.6	-73.3	0	0	0	110.6
64	Y	29.1	Very low	28.4	Very low	243 Å²	243	156.8 Å²	156.8	95%	0.953	80%	0.798	S	S	*	*				-143.7	133.9	124.4	-98.2	-72.3	0	0	0	109.1
65	A	25.2	Very low	28.6	Very low	78 Å²	78	158.6 Å²	158.6	65%	0.645	82%	0.816	S	S	*	*			trans	-128.7	118.1	-169.4	0	0	0	0	0	112.1
66	F	30.2	Very low	28.5	Very low	223 Å²	223	154.8 Å²	154.8	98%	0.978	81%	0.806	S	S	*	*			trans	-155.3	140.6	157.4	-85.8	-78.4	0	0	0	106.6
67	G	28.4	Very low	28.6	Very low	63 Å²	63	155.5 Å²	155.5	65%	0.649	82%	0.815	S	S	*	*			cis	172.7	77.8	-2.7	0	0	0	0	0	112
68	S	26.6	Very low	28.7	Very low	119 Å²	119	156.1 Å²	156.1	83%	0.832	81%	0.812	S	S	*	*			trans	31.8	110.9	161.3	61.9	0	0	0	0	119.6
69	R	28.9	Very low	28.4	Very low	249 Å²	249	155.3 Å²	155.3	94%	0.94	81%	0.808	S	S	*	*				-157.8	148.8	110.4	-129.7	171	171.8	146.5	-4.5	112.5
70	S	26.9	Very low	28.5	Very low	100 Å²	100	153.4 Å²	153.4	70%	0.699	80%	0.801	S	S	*	*			trans	-96.2	143.2	177	51.8	0	0	0	0	111
71	D	30.5	Very low	28.3	Very low	156 Å²	156	150.5 Å²	150.5	83%	0.834	79%	0.791	S	S	*	*			trans	-150.1	159.6	152.3	-91.7	-48.4	0	0	0	110.1
72	L	27.4	Very low	28.1	Very low	165 Å²	165	149.2 Å²	149.2	86%	0.864	79%	0.789	S	S	*	*			trans	-87.7	138.2	-162.6	-69.8	69.5	0	0	0	113.3
73	I	31.3	Very low	28.1	Very low	169 Å²	169	148.7 Å²	148.7	87%	0.867	79%	0.785	S	S	*	*			trans	-134.7	136.7	158.1	-60.7	-176.7	0	0	0	109.1
74	K	28.4	Very low	28.1	Very low	182 Å²	182	148.2 Å²	148.2	79%	0.791	78%	0.783	S	S	*	*			trans	-84.3	151	177.7	-61.8	175.2	-178.4	176	0	110.6	S76	K74-S76 PolarHBondContact O-N 3.06Å; K74-S76 VanDerWaalsContact O-N 3.17Å
75	P	29	Very low	28	Very low	140 Å²	140	141.9 Å²	141.9	91%	0.909	77%	0.765	S	S	*	*			trans	-74.5	106.1	173	30.2	-32.9	0	0	0	110.9
76	S	28	Very low	28.2	Very low	92 Å²	92	148.4 Å²	148.4	64%	0.643	78%	0.779	S	S	*	*			trans	-138.9	125	167.2	55.4	0	0	0	0	109.9	K74	K74-S76 PolarHBondContact O-N 3.06Å; K74-S76 VanDerWaalsContact O-N 3.17Å
77	E	28.7	Very low	28	Very low	171 Å²	171	144 Å²	144	80%	0.799	77%	0.766	S	S	*	*	S	Bend	trans	72.1	145.8	160.1	-59.7	176.3	-166.2	0	0	119.9
78	N	28.2	Very low	28.3	Very low	127 Å²	127	149.5 Å²	149.5	68%	0.679	77%	0.774	S	S	*	*			trans	55.8	80.3	147.3	-62.6	-30.8	0	0	0	119.3	V80	N78-V80 HydrophobicContact CB-CG2 4.37Å; N78-V80 PolarHBondContact O-N 3.02Å
79	L	25	Very low	28.3	Very low	159 Å²	159	149.1 Å²	149.1	83%	0.832	77%	0.768	S	S	*	*			trans	-73.7	70.8	159.8	-167.1	79.6	0	0	0	111.5	I81	L79-I81 HydrophobicContact CD2-CD1 4.11Å; L79-I81 HydrophobicContact CD2-CG1 4.15Å; L79-I81 HydrophobicContact CG-CG1 4.08Å; L79-I81 PolarHBondContact O-N 3.41Å
80	V	26.6	Very low	28.5	Very low	103 Å²	103	144.5 Å²	144.5	62%	0.624	77%	0.767	S	S	*	*			trans	-76.4	100.4	169.8	177.5	0	0	0	0	109.1	N78 N82	N78-V80 HydrophobicContact CB-CG2 4.37Å; N78-V80 PolarHBondContact O-N 3.02Å; V80-N82 PolarHBondContact O-N 2.84Å
81	I	27.7	Very low	28.5	Very low	130 Å²	130	148.3 Å²	148.3	67%	0.667	77%	0.774	S	S	*	*			trans	-75.5	87.9	175.8	-54.7	-178.4	0	0	0	109.6	L79 I83	L79-I81 HydrophobicContact CD2-CD1 4.11Å; L79-I81 HydrophobicContact CD2-CG1 4.15Å; L79-I81 HydrophobicContact CG-CG1 4.08Å; L79-I81 PolarHBondContact O-N 3.41Å; I81-I83 HydrophobicContact CG2-CD1 4.46Å; I81-I83 HydrophobicContact CG2-CG1 4.06Å; I81-I83 PolarHBondContact O-N 2.88Å
82	N	24.7	Very low	28.5	Very low	135 Å²	135	147.2 Å²	147.2	72%	0.722	77%	0.773	S	S	*	*			trans	-74.7	105.6	167.4	-85.8	-46.4	0	0	0	110.3	V80	V80-N82 PolarHBondContact O-N 2.84Å
83	I	31.4	Very low	28.6	Very low	158 Å²	158	144.1 Å²	144.1	81%	0.81	77%	0.765	S	S	*	*			trans	-95.2	104.7	163	-59.9	-179.8	0	0	0	108	I81	I81-I83 HydrophobicContact CG2-CD1 4.46Å; I81-I83 HydrophobicContact CG2-CG1 4.06Å; I81-I83 PolarHBondContact O-N 2.88Å
84	H	27.8	Very low	28.3	Very low	150 Å²	150	143.6 Å²	143.6	69%	0.694	76%	0.759	S	S	*	*			trans	-97.3	127.2	179	-123.6	-27.1	0	0	0	111.1
85	N	26.9	Very low	28.3	Very low	110 Å²	110	143.5 Å²	143.5	59%	0.588	76%	0.755	S	S	*	*			trans	51.1	114.5	150.6	-54	-8.6	0	0	0	119.1
86	F	30.7	Very low	28.3	Very low	215 Å²	215	145.1 Å²	145.1	94%	0.943	75%	0.748	S	S	*	*			trans	-129.9	122.7	131.9	-108.9	-86.1	0	0	0	109.8
87	N	26.2	Very low	28.2	Very low	132 Å²	132	147.7 Å²	147.7	71%	0.706	75%	0.75	S	S	*	*			trans	-93	142.2	178.6	-74.7	-43.5	0	0	0	110.3
88	H	33.8	Very low	28.3	Very low	177 Å²	177	146 Å²	146	82%	0.819	75%	0.751	S	S	*	*			trans	-153.5	89.4	145.6	-111.3	-59.3	0	0	0	113.8
89	T	27.3	Very low	28.2	Very low	112 Å²	112	145.8 Å²	145.8	69%	0.687	75%	0.75	S	S	*	*			trans	24.9	113.8	134.6	58.1	0	0	0	0	120.1
90	T	32.3	Very low	28.4	Very low	151 Å²	151	149.6 Å²	149.6	93%	0.926	76%	0.755	S	S	*	*				-152.4	157.1	118.9	12.6	0	0	0	0	110.6
91	E	27.1	Very low	28.4	Very low	181 Å²	181	149.7 Å²	149.7	85%	0.846	76%	0.76	S	S	*	*			trans	-106.7	151.4	-166.5	-54.5	167.5	113.8	0	0	112.3
92	T	30.1	Very low	28.5	Very low	133 Å²	133	148.9 Å²	148.9	82%	0.816	76%	0.763	S	S	*	*				-175.4	128.5	116	19.6	0	0	0	0	113.9
93	S	29.1	Very low	28.6	Very low	100 Å²	100	154.1 Å²	154.1	70%	0.699	77%	0.773	S	S	*	*			trans	30.5	140.6	143.1	60	0	0	0	0	123.1
94	Q	26.2	Very low	28.6	Very low	157 Å²	157	152.1 Å²	152.1	73%	0.734	77%	0.768	S	S	*	*			cis	-174.6	167.9	-7.2	-117.6	175.4	-4.6	0	0	110.4
95	Y	28	Very low	28.6	Very low	181 Å²	181	151.6 Å²	151.6	71%	0.71	78%	0.775	S	S	*	*			trans	94.3	89.2	165.4	-68.3	-82.9	0	0	0	121.2
96	F	28.5	Very low	28.6	Very low	174 Å²	174	153.2 Å²	153.2	76%	0.763	78%	0.783	S	S	*	*			trans	44.5	122.6	145.5	-60.9	-96	0	0	0	121
97	H	26.7	Very low	28.7	Very low	146 Å²	146	149.1 Å²	149.1	68%	0.676	78%	0.776	S	S	*	*				67	137.2	66	-80.1	11.1	0	0	0	114.1
98	T	30.8	Very low	28.9	Very low	134 Å²	134	148 Å²	148	82%	0.822	78%	0.775	S	S	*	*			cis	-128.8	160	41.1	45.9	0	0	0	0	117.1
99	N	25.3	Very low	28.6	Very low	123 Å²	123	146.5 Å²	146.5	66%	0.658	77%	0.773	S	S	*	*			trans	-90.2	158.1	173.1	-59.7	-60.1	0	0	0	111.9
100	Y	29.7	Very low	28.6	Very low	239 Å²	239	148.4 Å²	148.4	94%	0.937	78%	0.777	S	S	*	*			trans	-147.7	134.4	141.2	-105.1	-73.8	0	0	0	111.4
101	S	25.5	Very low	28.3	Very low	106 Å²	106	146.9 Å²	146.9	74%	0.741	77%	0.768	S	S	*	*			trans	-161.1	132.9	172.7	175.8	0	0	0	0	108.9
102	P	31.6	Very low	28.4	Very low	112 Å²	112	144.5 Å²	144.5	73%	0.727	77%	0.766	S	S	*	*			trans	-120	112.3	167.3	33.8	-19.7	0	0	0	111.7
103	R	25.6	Very low	28.2	Very low	245 Å²	245	143 Å²	143	93%	0.925	76%	0.76	S	S	*	*			trans	-76.1	135	146.9	-89.1	-178.9	167.1	167.7	-4.5	107.4
104	V	31	Very low	28.2	Very low	117 Å²	117	146.3 Å²	146.3	71%	0.709	77%	0.769	S	S	*	*			trans	-120.4	117.8	168.6	-179.4	0	0	0	0	109
105	V	29.2	Very low	28.2	Very low	138 Å²	138	143.8 Å²	143.8	84%	0.836	77%	0.768	S	S	*	*			trans	-114.4	134.5	156.7	175.8	0	0	0	0	105.7	T107	V105-T107 PolarHBondContact O-N 3.09Å
106	N	27.1	Very low	28.3	Very low	144 Å²	144	141.8 Å²	141.8	77%	0.77	78%	0.775	S	S	*	*			trans	-65.8	129.9	-170.3	-80.3	-40.1	0	0	0	113.4
107	T	31.3	Very low	28.2	Very low	129 Å²	129	137.2 Å²	137.2	79%	0.791	77%	0.769	S	S	*	*			trans	-158.3	94.3	144.8	-3.3	0	0	0	0	112.5	V105	V105-T107 PolarHBondContact O-N 3.09Å
108	T	30.3	Very low	28.4	Very low	110 Å²	110	137 Å²	137	68%	0.675	78%	0.778	S	S	*	*			trans	35.3	115.4	145	53.2	0	0	0	0	121.7
109	N	27.5	Very low	28.6	Very low	145 Å²	145	135.3 Å²	135.3	78%	0.775	77%	0.769	S	S	*	*				96.4	136	124.4	-66.8	-9	0	0	0	122.6
110	I	29	Very low	28.9	Very low	151 Å²	151	134.8 Å²	134.8	77%	0.774	77%	0.771	S	S	*	*			trans	82.3	88.8	159.2	-59.5	152.2	0	0	0	117.6
111	T	25.5	Very low	28.9	Very low	120 Å²	120	129.9 Å²	129.9	74%	0.736	76%	0.761	S	S	*	*				33.1	125.3	115.3	-34.3	0	0	0	0	117
112	T	28.9	Very low	29.2	Very low	131 Å²	131	131.8 Å²	131.8	80%	0.804	77%	0.768	S	S	*	*				-161.8	156.8	74.6	-55.7	0	0	0	0	112.7
113	S	25.8	Very low	29	Very low	100 Å²	100	133 Å²	133	70%	0.699	77%	0.774	S	S	*	*			trans	-86.8	163.8	-173.8	53.4	0	0	0	0	115.6
114	I	29.6	Very low	29.3	Very low	171 Å²	171	127.9 Å²	127.9	88%	0.877	77%	0.769	S	S	*	*				-167.4	155.5	125.5	-96.9	155.2	0	0	0	109.2
115	S	25.5	Very low	29.2	Very low	104 Å²	104	129.9 Å²	129.9	73%	0.727	78%	0.776	S	S	*	*			trans	-133.7	149.9	-172.3	174.3	0	0	0	0	111.8
116	T	30.2	Very low	29.2	Very low	139 Å²	139	130.1 Å²	130.1	85%	0.853	78%	0.777	S	S	*	*			trans	170.4	167.9	150.4	25.7	0	0	0	0	111.5
117	A	26.8	Very low	29.3	Very low	78 Å²	78	128.7 Å²	128.7	65%	0.645	77%	0.774	S	S	*	*				-171.1	112.3	-72	0	0	0	0	0	113.4
118	V	30.1	Very low	29.3	Very low	142 Å²	142	128.3 Å²	128.3	86%	0.861	77%	0.772	S	S	*	*			trans	55.9	-176.1	155.7	-112.3	0	0	0	0	117.5
119	P	34.6	Very low	29.2	Very low	97 Å²	97	130 Å²	130	63%	0.63	78%	0.782	S	S	*	*			cis	-134.5	173.7	-25.7	35	-15.1	0	0	0	116.8
120	T	31.8	Very low	29.4	Very low	113 Å²	113	129.3 Å²	129.3	69%	0.693	78%	0.783	S	S	*	*			trans	43.6	155.1	141.6	57.4	0	0	0	0	122.5
121	D	30	Very low	29.5	Very low	136 Å²	136	129.1 Å²	129.1	73%	0.727	79%	0.789	S	S	*	*			cis	-171.3	160.8	-6.8	-98	-17.4	0	0	0	108.8
122	T	31.4	Very low	29.7	Very low	145 Å²	145	130.7 Å²	130.7	89%	0.89	79%	0.793	S	S	*	*			trans	162.4	158.3	134.8	35.7	0	0	0	0	114.9
123	T	28.5	Very low	29.9	Very low	138 Å²	138	129.4 Å²	129.4	85%	0.847	79%	0.789	S	S	*	*			trans	-142.7	150.9	-175.8	49.6	0	0	0	0	112.7
124	V	31	Very low	30.4	Very low	137 Å²	137	133.3 Å²	133.3	83%	0.83	80%	0.796	S	S	*	*			trans	-151.7	143.6	168.2	-175.1	0	0	0	0	111.1
125	N	29.4	Very low	30.5	Very low	160 Å²	160	129.1 Å²	129.1	86%	0.856	78%	0.782	S	S	*	*			trans	-127.3	152	174.5	-70.3	-32.3	0	0	0	111.6
126	V	30	Very low	30.8	Very low	142 Å²	142	130.8 Å²	130.8	86%	0.861	78%	0.783	S	S	*	*			trans	-148.9	161.8	162.9	-172.9	0	0	0	0	110.9
127	T	28.2	Very low	30.8	Very low	115 Å²	115	130.9 Å²	130.9	71%	0.706	78%	0.778	S	S	*	*			trans	-119	-171	-154	-14	0	0	0	0	117.4
128	T	30.7	Very low	31	Very low	121 Å²	121	133.7 Å²	133.7	74%	0.742	79%	0.787	S	S	*	*			trans	-87.5	166.6	-164.4	52.5	0	0	0	0	118.7
129	T	29.6	Very low	30.8	Very low	146 Å²	146	131.5 Å²	131.5	90%	0.896	78%	0.778	S	S	*	*			trans	-167.4	172.8	140.1	8.6	0	0	0	0	115.2
130	T	30.8	Very low	30.7	Very low	129 Å²	129	135 Å²	135	79%	0.791	79%	0.791	S	S	*	*			trans	-137.7	167.9	-166.1	53.9	0	0	0	0	114.9
131	T	32	Very low	30.5	Very low	147 Å²	147	135.9 Å²	135.9	90%	0.902	79%	0.791	S	S	*	*			trans	-169.6	171.3	156.5	5.7	0	0	0	0	114.8
132	N	29.9	Very low	30.7	Very low	154 Å²	154	138.1 Å²	138.1	82%	0.824	80%	0.797	S	S	*	*			trans	-107	167.6	-162.5	-56	-41.2	0	0	0	116.1
133	S	32.4	Very low	30.6	Very low	103 Å²	103	138 Å²	138	72%	0.72	79%	0.791	S	S	*	*				155.3	137.7	105.7	67.2	0	0	0	0	118.7
134	H	35.4	Very low	30.5	Very low	182 Å²	182	134.7 Å²	134.7	84%	0.843	78%	0.783	S	S	*	*			trans	66.7	155.8	145	-72.7	35.6	0	0	0	120.1
135	S	31.7	Very low	30.4	Very low	83 Å²	83	136.4 Å²	136.4	58%	0.58	79%	0.786	S	S	*	*			cis	-174.7	158.3	-20.3	57.6	0	0	0	0	111.6
136	N	33	Very low	30.2	Very low	140 Å²	140	136.3 Å²	136.3	75%	0.749	79%	0.785	S	S	*	*			trans	70.4	159.9	159.6	-65.7	-42.1	0	0	0	119.7
137	N	29.7	Very low	30.3	Very low	141 Å²	141	134.5 Å²	134.5	75%	0.754	78%	0.776	S	S	*	*			cis	-175.8	177.4	-41.5	-132.6	-37.2	0	0	0	109.7
138	V	30.1	Very low	30.1	Very low	137 Å²	137	134.4 Å²	134.4	83%	0.83	78%	0.775	S	S	*	*			trans	90.9	123.4	167	-172.4	0	0	0	0	117.8
139	S	27.5	Very low	29.7	Very low	96 Å²	96	138.3 Å²	138.3	67%	0.671	78%	0.778	S	S	*	*			trans	-108.7	171.3	170.4	55.5	0	0	0	0	111.5
140	L	31.8	Very low	29.4	Very low	171 Å²	171	135.8 Å²	135.8	90%	0.895	77%	0.766	S	S	*	*			trans	-160	146.7	148.6	-112.2	170.4	0	0	0	111.2
141	N	28.3	Very low	29.1	Very low	131 Å²	131	136.5 Å²	136.5	70%	0.701	77%	0.765	S	S	*	*			trans	-95.5	164.5	-176	-56	-17.2	0	0	0	111.5
142	H	34.5	Very low	28.7	Very low	183 Å²	183	136.9 Å²	136.9	85%	0.847	76%	0.757	S	S	*	*			trans	-154.5	141	133	-127.2	-67.4	0	0	0	113.3
143	D	28.3	Very low	28.4	Very low	143 Å²	143	137.6 Å²	137.6	77%	0.765	75%	0.753	S	S	*	*			trans	-83.2	163.9	-175.5	-41.9	-100.1	0	0	0	113.9
144	G	26.9	Very low	28	Very low	67 Å²	67	138.6 Å²	138.6	69%	0.691	75%	0.75	S	S	*	*			trans	153.8	128.7	138.9	0	0	0	0	0	120
145	I	29.2	Very low	27.6	Very low	174 Å²	174	134.9 Å²	134.9	89%	0.892	74%	0.736	S	S	*	*			trans	75.6	95	140.9	-49	177.3	0	0	0	118.4
146	L	23.7	Very low	27.3	Very low	157 Å²	157	138.5 Å²	138.5	82%	0.822	74%	0.742	S	S	*	*			trans	-82.8	176.1	146.6	-82.4	170	0	0	0	110.3
147	P	32.7	Very low	26.9	Very low	105 Å²	105	141.1 Å²	141.1	68%	0.682	74%	0.743	S	S	*	*			cis	-140.5	-169.3	-14.2	25.5	0.5	0	0	0	115
148	V	23.9	Very low	26.8	Very low	113 Å²	113	141.2 Å²	141.2	69%	0.685	74%	0.742	S	S	*	*			trans	75.9	154.3	155.6	-145.1	0	0	0	0	119.6
149	Y	23	Very low	26.7	Very low	202 Å²	202	138.2 Å²	138.2	79%	0.792	73%	0.732	S	S	*	*			trans	89.8	75.8	162.5	-67.3	-70.1	0	0	0	120.4
150	S	23.1	Very low	26.6	Very low	93 Å²	93	140.3 Å²	140.3	65%	0.65	74%	0.735	S	S	*	*				62.9	132.2	110.6	74	0	0	0	0	122
151	N	23.3	Very low	26.6	Very low	145 Å²	145	137.8 Å²	137.8	78%	0.775	73%	0.727	S	S	*	*			trans	83.2	140	133.8	-108.3	-21	0	0	0	121.1
152	Q	24.8	Very low	26.8	Very low	154 Å²	154	138.3 Å²	138.3	72%	0.72	73%	0.73	S	S	*	*			trans	78.9	116.9	149.7	-68.8	-171.9	0.7	0	0	122.1
153	F	23.9	Very low	26.7	Very low	169 Å²	169	135.4 Å²	135.4	74%	0.741	72%	0.721	S	S	*	*				73.7	109.4	127	-84.1	-119.8	0	0	0	121.1
154	N	24.1	Very low	26.8	Very low	124 Å²	124	135.7 Å²	135.7	66%	0.663	72%	0.717	S	S	*	*				87.4	143.1	120.3	-93.4	-3.7	0	0	0	122.7
155	N	25.5	Very low	27.1	Very low	104 Å²	104	137.4 Å²	137.4	56%	0.556	72%	0.715	S	S	*	*			trans	83.2	99.5	140.8	-76.4	-39	0	0	0	121.3
156	K	25.5	Very low	27.2	Very low	159 Å²	159	136.3 Å²	136.3	69%	0.691	71%	0.709	S	S	*	*				83	165.7	115.3	-74.3	175.2	-179.8	179.7	0	119.5
157	Y	26.1	Very low	27.6	Very low	196 Å²	196	133.5 Å²	133.5	77%	0.769	70%	0.698	S	S	*	*			trans	80.8	130.9	167.3	-51.9	-76.6	0	0	0	114.9
158	L	25.8	Very low	27.4	Very low	142 Å²	142	134.6 Å²	134.6	74%	0.743	70%	0.699	S	S	*	*			cis	-167.8	159	-16.6	-130.4	-178.7	0	0	0	109.2
159	A	28	Very low	27.8	Very low	75 Å²	75	139.3 Å²	139.3	62%	0.62	71%	0.705	S	S	*	*			trans	66.9	154.8	151.7	0	0	0	0	0	118.9
160	N	26	Very low	28.3	Very low	139 Å²	139	136.6 Å²	136.6	74%	0.743	70%	0.7	S	S	*	*			cis	-167	-176.8	-18.8	-101.9	-1.7	0	0	0	107.5
161	V	32.3	Very low	28.5	Very low	119 Å²	119	136.8 Å²	136.8	72%	0.721	70%	0.697	S	S	*	*			trans	82.6	93.7	163.8	-166	0	0	0	0	113.1
162	D	32.9	Very low	29	Very low	142 Å²	142	137.3 Å²	137.3	76%	0.759	70%	0.7	S	S	*	*				82.3	136	67	-61.7	-15.1	0	0	0	111.1
163	D	31.7	Very low	29.2	Very low	122 Å²	122	138 Å²	138	65%	0.652	70%	0.703	S	S	*	*			cis	-162.9	171.2	-4.4	-152.1	-10.2	0	0	0	111.7
164	Q	31.1	Very low	29.6	Very low	149 Å²	149	136.4 Å²	136.4	70%	0.696	70%	0.701	S	S	*	*			trans	64.3	150.1	150.5	-79.4	167.3	63.4	0	0	119.4
165	T	32.2	Very low	30	Very low	103 Å²	103	137.5 Å²	137.5	63%	0.632	71%	0.707	S	S	*	*			cis	-159	141.9	10.2	-2	0	0	0	0	112.3
166	I	32.1	Very low	30.2	Very low	151 Å²	151	142.4 Å²	142.4	77%	0.774	72%	0.718	S	S	*	*			trans	56	137.1	132.2	-71.9	175.8	0	0	0	120.6
167	T	32.2	Very low	30.3	Very low	98 Å²	98	141.4 Å²	141.4	60%	0.601	72%	0.716	S	S	*	*			cis	-166.9	145.4	-6.9	-94.8	0	0	0	0	113
168	N	29	Very low	30.5	Very low	128 Å²	128	140.5 Å²	140.5	68%	0.684	72%	0.718	S	S	*	*			trans	-0.2	152.9	155.5	-42.8	-24.5	0	0	0	122.2
169	Y	30.6	Very low	30.5	Very low	211 Å²	211	139.4 Å²	139.4	83%	0.827	72%	0.721	S	S	*	*				-152.9	151.2	103.2	-118.9	-86.5	0	0	0	113.6
170	H	33.6	Very low	30.5	Very low	145 Å²	145	144.4 Å²	144.4	67%	0.671	73%	0.731	S	S	*	*			trans	-43.9	151	-165.1	-73.7	-115	0	0	0	119.3
171	T	28.9	Very low	30.6	Very low	98 Å²	98	145.3 Å²	145.3	60%	0.601	74%	0.736	S	S	*	*			cis	100.1	115.7	21	-62.9	0	0	0	0	116.2
172	N	32.5	Very low	30.4	Very low	156 Å²	156	149.3 Å²	149.3	83%	0.834	75%	0.747	S	S	*	*			trans	-177.6	100.3	146.5	-86.3	-27.4	0	0	0	105.9
173	Q	29.6	Very low	30.1	Very low	167 Å²	167	151.3 Å²	151.3	78%	0.78	75%	0.749	S	S	*	*				41.3	136.4	68.6	-60.3	-156.1	19.4	0	0	113.3
174	I	32	Very low	29.8	Very low	137 Å²	137	152.5 Å²	152.5	70%	0.703	76%	0.755	S	S	*	*			cis	-147.4	161.4	45.4	-76	171.8	0	0	0	111.7
175	N	32.8	Very low	29.7	Very low	147 Å²	147	153.8 Å²	153.8	79%	0.786	76%	0.763	S	S	*	*			trans	72	122.8	178.1	-59.2	-27.8	0	0	0	116.7
176	R	28.8	Very low	29.3	Very low	207 Å²	207	152.9 Å²	152.9	78%	0.781	76%	0.761	S	S	*	*			cis	145.9	139.1	-22.3	-95.2	-174.2	164.1	-116	2.5	108.9
177	E	28.3	Very low	29	Very low	138 Å²	138	152.6 Å²	152.6	65%	0.645	76%	0.76	S	S	*	*			trans	71.9	81	149.3	-69.8	160.7	-142.6	0	0	120.5
178	H	30.2	Very low	28.6	Very low	176 Å²	176	155.6 Å²	155.6	82%	0.815	77%	0.767	S	S	*	*				-176.1	107.3	111.3	-96.1	62.8	0	0	0	107.3
179	C	26.4	Very low	28.7	Very low	119 Å²	119	159.3 Å²	159.3	80%	0.804	78%	0.778	S	S	*	*				71.5	75.9	83.6	-74.2	0	0	0	0	114.6
180	E	27.3	Very low	28.5	Very low	180 Å²	180	157.3 Å²	157.3	84%	0.841	78%	0.775	S	S	*	*			trans	-102	125	154.1	-69.8	-173.4	145.1	0	0	109.1
181	N	27.9	Very low	28.4	Very low	159 Å²	159	159.1 Å²	159.1	85%	0.85	78%	0.784	S	S	*	*			trans	-164.3	100.3	174.4	-99.7	-41.6	0	0	0	107.7
182	E	29.2	Very low	28.5	Very low	202 Å²	202	159.4 Å²	159.4	94%	0.944	79%	0.786	S	S	*	*			trans	-166.4	134.1	137.4	-115.2	171.8	-168.7	0	0	111.6
183	F	25.3	Very low	28.4	Very low	185 Å²	185	161.1 Å²	161.1	81%	0.811	79%	0.788	S	S	*	*			trans	-143	134.9	173.6	-175.4	-103.9	0	0	0	105.8
184	L	26.8	Very low	28.5	Very low	147 Å²	147	158.4 Å²	158.4	77%	0.77	79%	0.785	S	S	*	*			trans	77.5	110.5	-173.5	-47.7	172.7	0	0	0	117.1
185	M	27.7	Very low	28.5	Very low	175 Å²	175	159.1 Å²	159.1	86%	0.862	80%	0.796	S	S	*	*			trans	161.4	110.6	145.4	-87.9	-80.7	160.7	0	0	105.9
186	S	24.3	Very low	28.4	Very low	84 Å²	84	156 Å²	156	59%	0.587	79%	0.785	S	S	*	*			cis	78.1	117.3	39	90	0	0	0	0	115.4
187	L	24.9	Very low	28.4	Very low	145 Å²	145	153.1 Å²	153.1	76%	0.759	78%	0.781	S	S	*	*			trans	76.7	123.3	162.3	-67.4	155.6	0	0	0	120.1
188	Q	24.8	Very low	28.5	Very low	162 Å²	162	155.2 Å²	155.2	76%	0.757	78%	0.784	S	S	*	*			trans	53	119.3	140.4	-63.5	170.1	-50.5	0	0	120.3
189	F	30.1	Very low	28.5	Very low	206 Å²	206	156.4 Å²	156.4	90%	0.904	78%	0.783	S	S	*	*				-155.7	125.2	119.2	-108.2	-69.5	0	0	0	112.2
190	H	26.8	Very low	28.5	Very low	168 Å²	168	154.9 Å²	154.9	78%	0.778	77%	0.773	S	S	*	*			trans	-78.4	137.3	159.9	-93.8	-78.2	0	0	0	109.2
191	H	32.3	Very low	28.8	Very low	183 Å²	183	154 Å²	154	85%	0.847	77%	0.769	S	S	*	*			trans	-148.1	148.7	140.9	-117	58.3	0	0	0	111.7
192	T	29.9	Very low	29	Very low	104 Å²	104	153.8 Å²	153.8	64%	0.638	77%	0.766	S	S	*	*			trans	-115	149.4	-171.2	49.1	0	0	0	0	111.3
193	H	32	Very low	29	Very low	192 Å²	192	148.8 Å²	148.8	89%	0.889	75%	0.753	S	S	*	*			trans	-147.1	112.7	157.1	-95.5	-60.3	0	0	0	110.4
194	P	31.1	Very low	29.2	Very low	111 Å²	111	146 Å²	146	72%	0.721	75%	0.751	S	S	*	*			trans	-93.4	150.4	174.1	35.5	-32.4	0	0	0	112.1
195	V	32.8	Very low	29.6	Very low	152 Å²	152	146.6 Å²	146.6	92%	0.921	76%	0.755	S	S	*	*			trans	-128.5	136.4	159.4	-178.9	0	0	0	0	107.3
196	S	28.7	Very low	29.8	Very low	80 Å²	80	143.2 Å²	143.2	56%	0.559	75%	0.746	S	S	*	*			trans	-124.7	160.9	-160.2	69.3	0	0	0	0	114.2
197	Q	28.8	Very low	30	Very low	148 Å²	148	146.1 Å²	146.1	69%	0.692	76%	0.76	S	S	*	*			trans	75.9	145.9	171.1	-47.1	154	39	0	0	112.1
198	Y	30.5	Very low	30.7	Very low	182 Å²	182	144.8 Å²	144.8	71%	0.714	76%	0.758	S	S	*	*			cis	-137.4	134	32.6	-100.4	-110.4	0	0	0	114.8
199	Y	31.2	Very low	31.3	Very low	200 Å²	200	142.9 Å²	142.9	78%	0.784	76%	0.76	S	S	*	*			trans	66.9	139.7	143	-79.7	-114.9	0	0	0	122.9
200	S	25.6	Very low	31.6	Very low	87 Å²	87	136.7 Å²	136.7	61%	0.608	75%	0.754	S	S	*	*			trans	-102.4	164.3	171.6	52.3	0	0	0	0	111.9
201	H	33.7	Very low	32.4	Very low	163 Å²	163	134.5 Å²	134.5	76%	0.755	76%	0.755	S	S	*	*				171.9	152.5	125	-91.9	-61.9	0	0	0	112.4
202	I	32.3	Very low	32.6	Very low	153 Å²	153	135.1 Å²	135.1	79%	0.785	76%	0.758	S	S	*	*			trans	67.9	118	170.5	-56.2	145.7	0	0	0	113.3
203	S	30.3	Very low	32.8	Very low	97 Å²	97	136.9 Å²	136.9	68%	0.678	76%	0.759	S	S	*	*			cis	97.6	111	29.2	-62	0	0	0	0	115.4
204	T	29.3	Very low	32.9	Very low	126 Å²	126	133.8 Å²	133.8	77%	0.773	74%	0.744	S	S	*	*			trans	72.2	136.1	143.5	54.2	0	0	0	0	122.2
205	L	33.5	Very low	33.1	Very low	161 Å²	161	138.1 Å²	138.1	84%	0.843	76%	0.755	S	S	*	*			trans	75.8	150.7	159.3	-60.7	152.7	0	0	0	117.6
206	P	32.2	Very low	33.3	Very low	103 Å²	103	140.3 Å²	140.3	67%	0.669	76%	0.755	S	S	*	*			cis	-132.3	169	-47.9	37.5	-23.3	0	0	0	112.9
207	T	30	Very low	33.6	Very low	146 Å²	146	142.5 Å²	142.5	90%	0.896	76%	0.757	S	S	*	*			trans	-68.5	132.6	174.4	-46	0	0	0	0	111.8
208	V	38.3	Very low	34.1	Very low	117 Å²	117	144.5 Å²	144.5	71%	0.709	77%	0.766	S	S	*	*			trans	-134.7	143.8	172.7	178.4	0	0	0	0	108.5
209	P	37.7	Very low	34.7	Very low	122 Å²	122	145.1 Å²	145.1	79%	0.792	78%	0.775	S	S	*	*			trans	-70.6	155.5	-168.1	-20.2	34.2	0	0	0	115.3
210	G	36.1	Very low	35	Very low	75 Å²	75	145.2 Å²	145.2	77%	0.773	78%	0.78	S	S	*	*			trans	-88.1	133.5	177.4	0	0	0	0	0	113.4
211	P	45	Very low	35.6	Very low	123 Å²	123	149.7 Å²	149.7	80%	0.799	79%	0.791	S	S	*	*			trans	-88.7	107.8	178.5	32.6	-32.4	0	0	0	112.8	Q213	P211-Q213 PolarHBondContact O-N 3.28Å
212	Q	36.5	Very low	35.8	Very low	195 Å²	195	150.8 Å²	150.8	91%	0.911	80%	0.797	S	S	*	*			trans	-91	73.9	161	-79.4	-161.4	7.1	0	0	111.2
213	Q	33.7	Very low	36	Very low	141 Å²	141	152.2 Å²	152.2	66%	0.659	80%	0.8	S	S	*	*			trans	-169.4	101.7	161.6	-107.9	178.1	48.1	0	0	107.8	P211 Y754	P211-Q213 PolarHBondContact O-N 3.28Å; Q213-Y754 PolarHBondContact NE2-OH 3.03Å
214	H	33.6	Very low	36.5	Very low	128 Å²	128	154.3 Å²	154.3	59%	0.593	81%	0.808	S	S	*	*			trans	171.7	56.9	153	-100.8	64.3	0	0	0	112.6	Q217	H214-Q217 PolarHBondContact NE2-NE2 3.22Å; H214-Q217 PolarHBondContact NE2-OE1 2.9Å
215	Q	35.1	Very low	36.8	Very low	201 Å²	201	156.5 Å²	156.5	94%	0.939	82%	0.815	S	S	*	*	S	Bend	trans	-100.4	37.4	169.5	-154.7	171.8	13.2	0	0	112.7
216	Q	36.6	Very low	37	Very low	199 Å²	199	157.9 Å²	157.9	93%	0.93	82%	0.816	S	S	*	*	S	Bend	trans	-143.1	4.8	178.3	-126	175.2	10.7	0	0	115.5
217	Q	35.5	Very low	37.3	Very low	126 Å²	126	158.2 Å²	158.2	59%	0.589	82%	0.821	S	S	*	*			trans	-120	-6	-172.6	-134.1	-176.1	60.9	0	0	115.8	H214 Q219	H214-Q217 PolarHBondContact NE2-NE2 3.22Å; H214-Q217 PolarHBondContact NE2-OE1 2.9Å; Q217-Q219 PolarHBondContact O-N 2.91Å
218	Q	39.2	Very low	37.8	Very low	189 Å²	189	159.6 Å²	159.6	88%	0.883	82%	0.817	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.6	14.8	-175.3	-69.6	-167.7	-0.7	0	0	115.8
219	Q	42.8	Very low	37.9	Very low	196 Å²	196	162.3 Å²	162.3	92%	0.916	83%	0.827	S	S	*	*	T	Hydrogen-bonded Turn	trans	-112.8	1.8	177.7	-71.3	-171.6	-7.6	0	0	115.1	Q217	Q217-Q219 PolarHBondContact O-N 2.91Å
220	K	39.3	Very low	38.2	Very low	202 Å²	202	165 Å²	165	88%	0.878	83%	0.828	S	S	*	*	S	Bend	trans	-115.3	13.5	-177.9	-93.2	-173.5	174.3	-178.4	0	116.9
221	Q	36.4	Very low	38.4	Very low	181 Å²	181	167.2 Å²	167.2	85%	0.846	83%	0.829	S	S	*	*			trans	-116.4	26	177.9	-79.6	-171.1	-1.4	0	0	115.5
222	Q	39.3	Very low	38.2	Very low	186 Å²	186	166.4 Å²	166.4	87%	0.869	83%	0.833	S	S	*	*	S	Bend	trans	-115.7	54.5	168.4	-69.6	-166.4	14.6	0	0	112.5
223	Q	36.8	Very low	38.4	Very low	182 Å²	182	165.9 Å²	165.9	85%	0.85	83%	0.831	S	S	*	*	S	Bend	trans	-160.2	169.3	161	-107.8	147.6	85.2	0	0	108.8
224	V	40	Very low	38.8	Very low	142 Å²	142	168 Å²	168	86%	0.861	84%	0.84	S	S	*	*			trans	64.3	63.4	-177	-161.1	0	0	0	0	114.9
225	L	36.5	Very low	39.1	Very low	172 Å²	172	166.3 Å²	166.3	90%	0.901	84%	0.843	S	S	*	*			trans	-156.7	72.8	147.7	-117.7	165.6	0	0	0	111.1
226	H	37.6	Very low	39.3	Very low	189 Å²	189	165.7 Å²	165.7	88%	0.875	84%	0.84	S	S	*	*			trans	-152.4	108.4	174.8	-127.5	68.8	0	0	0	110.4
227	S	37.3	Very low	39.5	Very low	110 Å²	110	164.1 Å²	164.1	77%	0.769	84%	0.838	S	S	*	*			trans	154.1	159.8	152.8	-74.4	0	0	0	0	111.7
228	Q	40.8	Very low	39.8	Very low	176 Å²	176	163.4 Å²	163.4	82%	0.822	84%	0.843	S	S	*	*			trans	65	97.9	166.1	-47.5	-166.8	27.7	0	0	118.4
229	L	39.6	Very low	40	Very low	173 Å²	173	162.2 Å²	162.2	91%	0.906	84%	0.842	S	S	*	*				-169	153.9	103.8	-97.8	163.7	0	0	0	110.8
230	H	44.7	Very low	39.9	Very low	179 Å²	179	159.3 Å²	159.3	83%	0.829	83%	0.833	S	S	*	*			trans	-101	156.6	-163.7	-78.9	-93.2	0	0	0	114.9
231	P	40.2	Very low	40.1	Very low	122 Å²	122	160.2 Å²	160.2	79%	0.792	83%	0.833	S	S	*	*			trans	-93.8	154.3	-176.8	36.8	-35.6	0	0	0	114.5
232	A	41.3	Very low	40.4	Very low	106 Å²	106	157.2 Å²	157.2	88%	0.876	83%	0.827	S	S	*	*			trans	-138.5	163.3	165.5	0	0	0	0	0	111
233	Q	41.2	Very low	40.9	Very low	184 Å²	184	157.1 Å²	157.1	86%	0.86	83%	0.826	S	S	*	*			trans	-108.9	148	-163.4	-55.3	165.6	2.6	0	0	112.6
234	Q	40.5	Very low	41.3	Very low	184 Å²	184	154.5 Å²	154.5	86%	0.86	82%	0.823	S	S	*	*				-169.1	122.8	122.2	-105.4	164.3	46.8	0	0	115.9
235	S	39.9	Very low	41.8	Very low	94 Å²	94	152.2 Å²	152.2	66%	0.657	82%	0.818	S	S	*	*			trans	20.2	109.9	145.6	51.5	0	0	0	0	122
236	Q	39.8	Very low	42.6	Very low	187 Å²	187	148 Å²	148	87%	0.874	81%	0.808	S	S	*	*				45.1	115.1	121.8	-60.8	179.6	7.3	0	0	120
237	N	41.9	Very low	43.4	Very low	166 Å²	166	145.8 Å²	145.8	89%	0.888	81%	0.808	S	S	*	*				-146.1	141.4	127.7	-143.9	-20.4	0	0	0	110.2
238	T	40.9	Very low	44.4	Very low	112 Å²	112	144 Å²	144	69%	0.687	79%	0.793	S	S	*	*			trans	-102	130.4	-165.7	52.8	0	0	0	0	113.5
239	N	44.2	Very low	45.5	Very low	163 Å²	163	138.2 Å²	138.2	87%	0.872	77%	0.772	S	S	*	*			trans	-151.8	140.2	150.7	-98	-45.2	0	0	0	110.7
240	N	39.7	Very low	47	Very low	136 Å²	136	135.1 Å²	135.1	73%	0.727	76%	0.762	S	S	*	*			trans	-94	113.1	-164	-71.3	-36.6	0	0	0	113.5
241	Y	44.6	Very low	48.3	Very low	221 Å²	221	136.3 Å²	136.3	87%	0.867	76%	0.759	S	S	*	*			trans	-135.4	73.9	156.2	-76.7	-73.8	0	0	0	110.3	H243	Y241-H243 PolarHBondContact O-N 3.28Å; Y241-H243 VanDerWaalsContact O-N 3.14Å
242	T	41.4	Very low	49.8	Very low	117 Å²	117	135.7 Å²	135.7	72%	0.718	75%	0.747	S	S	*	*			trans	-73.6	99.2	177	48.8	0	0	0	0	111.1	T244	T242-T244 PolarHBondContact O-N 2.99Å
243	H	49.4	Very low	51.6	Low	185 Å²	185	136.9 Å²	136.9	86%	0.856	73%	0.732	S	S	*	*			trans	-63	116.9	163.6	-86.6	-91.2	0	0	0	109.7	Y241 A245	Y241-H243 PolarHBondContact O-N 3.28Å; Y241-H243 VanDerWaalsContact O-N 3.14Å; H243-A245 PolarHBondContact O-N 3.34Å
244	T	45.2	Very low	53.6	Low	127 Å²	127	132 Å²	132	78%	0.779	71%	0.71	S	S	*	*			trans	-75.9	92.6	-174.8	49.3	0	0	0	0	111.7	T242 A246	T242-T244 PolarHBondContact O-N 2.99Å; T244-A246 PolarHBondContact O-N 3.46Å
245	A	50.3	Low	55.8	Low	93 Å²	93	130.6 Å²	130.6	77%	0.769	70%	0.701	S	S	*	*			trans	-65.6	95	163.7	0	0	0	0	0	109.5	H243 T247	H243-A245 PolarHBondContact O-N 3.34Å; A245-T247 PolarHBondContact O-N 3.24Å
246	A	54.3	Low	58.1	Low	84 Å²	84	130 Å²	130	69%	0.694	70%	0.696	S	S	*	*			trans	-65.1	108.5	-172.9	0	0	0	0	0	111.8	T244 T248	T244-A246 PolarHBondContact O-N 3.46Å; A246-T248 VanDerWaalsContact C-N 3.32Å; A246-T248 PolarHBondContact O-N 2.83Å
247	T	54.7	Low	60.6	Low	142 Å²	142	127 Å²	127	87%	0.871	68%	0.681	S	S	*	*			trans	-68.6	85.1	176.9	32.2	0	0	0	0	111.1	A245 S249	A245-T247 PolarHBondContact O-N 3.24Å; T247-S249 PolarHBondContact O-N 2.96Å
248	T	57.4	Low	63	Low	74 Å²	74	122.4 Å²	122.4	45%	0.454	66%	0.656	S	S	.	*			trans	-54.8	111	172.9	41.6	0	0	0	0	110.2	A246 M252 K253	A246-T248 VanDerWaalsContact C-N 3.32Å; A246-T248 PolarHBondContact O-N 2.83Å; T248-M252 HydrophobicContact CG2-CE 4.18Å; T248-K253 WeakPolarHBondContact O-CE 3.43Å; T248-K253 WeakPolarHBondContact OG1-CE 3.06Å
249	S	64.4	Low	65.6	Low	53 Å²	53	120.2 Å²	120.2	37%	0.371	65%	0.649	S	S	.	*			trans	-58.9	147.5	-172	81.7	0	0	0	0	111.5	T247 R251 M252 K253	T247-S249 PolarHBondContact O-N 2.96Å; S249-R251 PolarHBondContact O-N 2.86Å; S249-R251 VanDerWaalsContact O-N 3.09Å; S249-M252 WeakPolarHBondContact O-CB 3.48Å; S249-M252 PolarHBondContact O-N 3.47Å; S249-K253 PolarHBondContact O-N 2.82Å
250	P	71.4	Confident	68	Low	109 Å²	109	113.6 Å²	113.6	71%	0.708	62%	0.617	S	S	*	*	H	α-helix	trans	-57.4	-31.4	-175.8	20.5	-32.4	0	0	0	112.4	M252 K253 E254	P250-M252 VanDerWaalsContact C-N 3.32Å; P250-M252 PolarHBondContact O-N 2.97Å; P250-K253 PolarHBondContact O-N 3.04Å; P250-E254 WeakPolarHBondContact O-CB 3.5Å; P250-E254 PolarHBondContact O-N 3.07Å
251	R	71.1	Confident	70.6	Confident	204 Å²	204	114.2 Å²	114.2	77%	0.77	61%	0.609	S	S	*	*	H	α-helix	trans	-67.2	-27.2	175.9	-160.7	176.5	-172.7	-169.6	3.2	113.5	S249 K255	S249-R251 PolarHBondContact O-N 2.86Å; S249-R251 VanDerWaalsContact O-N 3.09Å; R251-K255 WeakPolarHBondContact O-CG 3.38Å; R251-K255 PolarHBondContact O-N 3.35Å
252	M	73.2	Confident	73.1	Confident	108 Å²	108	107.1 Å²	107.1	53%	0.532	59%	0.589	S	S	.	*	H	α-helix	trans	-77.7	-40.8	171.8	-65.1	-164.6	-58.6	0	0	111.6	T248 S249 P250 E254 K255 S256	T248-M252 HydrophobicContact CG2-CE 4.18Å; S249-M252 WeakPolarHBondContact O-CB 3.48Å; S249-M252 PolarHBondContact O-N 3.47Å; P250-M252 VanDerWaalsContact C-N 3.32Å; P250-M252 PolarHBondContact O-N 2.97Å; M252-E254 VanDerWaalsContact C-N 3.33Å; M252-E254 PolarHBondContact O-N 3.45Å; M252-K255 PolarHBondContact O-N 2.91Å; M252-S256 PolarHBondContact O-N 3.04Å
253	K	78.3	Confident	75.8	Confident	131 Å²	131	109.4 Å²	109.4	57%	0.57	58%	0.584	S	S	*	*	H	α-helix	trans	-59.4	-44.5	174.2	-63.7	-172.8	178.9	-175.6	0	111.3	T248 S249 P250 S256 K257	T248-K253 WeakPolarHBondContact O-CE 3.43Å; T248-K253 WeakPolarHBondContact OG1-CE 3.06Å; S249-K253 PolarHBondContact O-N 2.82Å; P250-K253 PolarHBondContact O-N 3.04Å; K253-S256 PolarHBondContact O-N 3.43Å; K253-K257 WeakPolarHBondContact O-CB 3.36Å; K253-K257 PolarHBondContact O-N 3.22Å
254	E	83.2	Confident	78	Confident	81 Å²	81	108 Å²	108	38%	0.379	57%	0.572	S	S	.	*	H	α-helix	trans	-68.5	-36.6	178.8	-166.6	57.8	-145.7	0	0	112.7	P250 M252 K257 N258	P250-E254 WeakPolarHBondContact O-CB 3.5Å; P250-E254 PolarHBondContact O-N 3.07Å; M252-E254 VanDerWaalsContact C-N 3.33Å; M252-E254 PolarHBondContact O-N 3.45Å; E254-K257 IonicContact OE1-NZ 2.96Å; E254-K257 PolarHBondContact OE1-NZ 2.97Å; E254-K257 VanDerWaalsContact OE1-NZ 3.07Å; E254-K257 WeakPolarHBondContact OE2-CD 3.4Å; E254-K257 IonicContact OE2-NZ 3.24Å; E254-K257 PolarHBondContact OE2-NZ 3.22Å; E254-N258 PolarHBondContact O-N 2.9Å; E254-N258 PolarHBondContact O-ND2 2.89Å; E254-N258 PolarHBondContact OE1-ND2 3.34Å
255	K	86.5	Confident	80.4	Confident	155 Å²	155	105.8 Å²	105.8	67%	0.674	55%	0.553	S	S	*	*	H	α-helix	trans	-60.6	-46	170.1	-82.5	-173.3	173.9	-166.5	0	112	R251 M252 N258 A259	R251-K255 WeakPolarHBondContact O-CG 3.38Å; R251-K255 PolarHBondContact O-N 3.35Å; M252-K255 PolarHBondContact O-N 2.91Å; K255-N258 PolarHBondContact O-N 3.46Å; K255-A259 WeakPolarHBondContact O-CB 3.46Å; K255-A259 PolarHBondContact O-N 3.43Å
256	S	88.9	Confident	82.6	Confident	81 Å²	81	108 Å²	108	57%	0.566	55%	0.545	S	S	*	.	H	α-helix	trans	-62.8	-45.6	178.8	-175.4	0	0	0	0	111.9	M252 K253 N258 A259 A260	M252-S256 PolarHBondContact O-N 3.04Å; K253-S256 PolarHBondContact O-N 3.43Å; S256-N258 PolarHBondContact O-N 3.09Å; S256-A259 PolarHBondContact O-N 3.02Å; S256-A260 WeakPolarHBondContact O-CB 3.37Å; S256-A260 PolarHBondContact O-N 2.9Å
257	K	91.6	Very high	84.7	Confident	125 Å²	125	107.6 Å²	107.6	54%	0.543	53%	0.529	S	S	.	.	H	α-helix	trans	-58	-46.5	176.1	178.4	-172.8	163.4	-147.4	0	112.4	K253 E254 A260 R261	K253-K257 WeakPolarHBondContact O-CB 3.36Å; K253-K257 PolarHBondContact O-N 3.22Å; E254-K257 IonicContact OE1-NZ 2.96Å; E254-K257 PolarHBondContact OE1-NZ 2.97Å; E254-K257 VanDerWaalsContact OE1-NZ 3.07Å; E254-K257 WeakPolarHBondContact OE2-CD 3.4Å; E254-K257 IonicContact OE2-NZ 3.24Å; E254-K257 PolarHBondContact OE2-NZ 3.22Å; K257-A260 PolarHBondContact O-N 3.24Å; K257-R261 WeakPolarHBondContact O-CB 3.33Å; K257-R261 PolarHBondContact O-N 3.14Å
258	N	93.1	Very high	86.6	Confident	70 Å²	70	103.8 Å²	103.8	37%	0.374	50%	0.503	S	S	.	.	H	α-helix	trans	-71.2	-38.2	178.9	-70.8	-57.9	0	0	0	112.4	E254 K255 S256 A260 R261 T262	E254-N258 PolarHBondContact O-N 2.9Å; E254-N258 PolarHBondContact O-ND2 2.89Å; E254-N258 PolarHBondContact OE1-ND2 3.34Å; K255-N258 PolarHBondContact O-N 3.46Å; S256-N258 PolarHBondContact O-N 3.09Å; N258-A260 VanDerWaalsContact C-N 3.35Å; N258-A260 PolarHBondContact O-N 3.4Å; N258-R261 WeakPolarHBondContact O-CB 3.42Å; N258-R261 PolarHBondContact O-N 2.71Å; N258-T262 PolarHBondContact O-N 2.92Å; N258-T262 PolarHBondContact O-OG1 3.14Å
259	A	93.9	Very high	88.5	Confident	65 Å²	65	104 Å²	104	54%	0.537	50%	0.504	S	S	.	.	H	α-helix	trans	-62.2	-40.5	172	0	0	0	0	0	112.4	K255 S256 R263	K255-A259 WeakPolarHBondContact O-CB 3.46Å; K255-A259 PolarHBondContact O-N 3.43Å; S256-A259 PolarHBondContact O-N 3.02Å; A259-R263 WeakPolarHBondContact O-CB 3.38Å; A259-R263 PolarHBondContact O-N 3.06Å
260	A	94.8	Very high	90.1	Very high	24 Å²	24	107.8 Å²	107.8	20%	0.198	52%	0.516	C	S	.	.	H	α-helix	trans	-67.3	-34.6	174.7	0	0	0	0	0	112.6	S256 K257 N258 R264	S256-A260 WeakPolarHBondContact O-CB 3.37Å; S256-A260 PolarHBondContact O-N 2.9Å; K257-A260 PolarHBondContact O-N 3.24Å; N258-A260 VanDerWaalsContact C-N 3.35Å; N258-A260 PolarHBondContact O-N 3.4Å; A260-R264 WeakPolarHBondContact O-CG 3.49Å; A260-R264 PolarHBondContact O-N 2.66Å; A260-R264 VanDerWaalsContact O-N 3.14Å
261	R	95.6	Very high	91.3	Very high	150 Å²	150	104.5 Å²	104.5	57%	0.566	49%	0.49	S	S	*	.	H	α-helix	trans	-63.8	-55.3	172.4	179.6	-179.7	168.7	152.9	9.3	111	K257 N258 R263 R264 E265	K257-R261 WeakPolarHBondContact O-CB 3.33Å; K257-R261 PolarHBondContact O-N 3.14Å; N258-R261 WeakPolarHBondContact O-CB 3.42Å; N258-R261 PolarHBondContact O-N 2.71Å; R261-R263 PolarHBondContact O-N 2.87Å; R261-R264 WeakPolarHBondContact O-CB 3.36Å; R261-R264 PolarHBondContact O-N 3.5Å; R261-E265 HydrophobicContact CG-CG 4.42Å; R261-E265 IonicContact CZ-OE1 2.68Å; R261-E265 VanDerWaalsContact CZ-OE1 3.28Å; R261-E265 IonicContact NE-OE1 3.28Å; R261-E265 PolarHBondContact NE-OE1 2.97Å; R261-E265 IonicContact NE-OE2 2.9Å; R261-E265 IonicContact NH2-OE1 2.97Å; R261-E265 PolarHBondContact NH2-OE1 3.24Å; R261-E265 WeakPolarHBondContact O-CG 3.46Å; R261-E265 PolarHBondContact O-N 3.41Å
262	T	96.4	Very high	92.5	Very high	72 Å²	72	102.2 Å²	102.2	44%	0.442	48%	0.483	S	S	.	.	H	α-helix	trans	-61	-31.7	178.7	-56.7	0	0	0	0	112.7	N258 E265 K266	N258-T262 PolarHBondContact O-N 2.92Å; N258-T262 PolarHBondContact O-OG1 3.14Å; T262-E265 WeakPolarHBondContact CA-OE2 3.44Å; T262-K266 WeakPolarHBondContact O-CG 3.5Å; T262-K266 PolarHBondContact O-N 3.24Å
263	R	97.1	Very high	93.6	Very high	164 Å²	164	101 Å²	101	62%	0.619	48%	0.476	S	S	*	.	H	α-helix	trans	-63.4	-47.9	171.2	-170.9	179.6	70.3	-139	3	111.9	A259 R261 E265 K266 E267	A259-R263 WeakPolarHBondContact O-CB 3.38Å; A259-R263 PolarHBondContact O-N 3.06Å; R261-R263 PolarHBondContact O-N 2.87Å; R263-E265 VanDerWaalsContact C-N 3.33Å; R263-E265 PolarHBondContact O-N 3.21Å; R263-K266 PolarHBondContact O-N 2.91Å; R263-E267 WeakPolarHBondContact O-CB 3.42Å; R263-E267 PolarHBondContact O-N 3.25Å
264	R	96.4	Very high	94.5	Very high	157 Å²	157	97.2 Å²	97.2	59%	0.592	46%	0.462	S	S	*	.	H	α-helix	trans	-63.7	-37.2	176.7	-71.2	168.1	177.6	168.8	-2.3	112.5	A260 R261 E267 N268	A260-R264 WeakPolarHBondContact O-CG 3.49Å; A260-R264 PolarHBondContact O-N 2.66Å; A260-R264 VanDerWaalsContact O-N 3.14Å; R261-R264 WeakPolarHBondContact O-CB 3.36Å; R261-R264 PolarHBondContact O-N 3.5Å; R264-E267 PolarHBondContact O-N 3.12Å; R264-N268 WeakPolarHBondContact O-CB 3.21Å; R264-N268 PolarHBondContact O-N 3.19Å; R264-N268 PolarHBondContact O-OD1 3.01Å
265	E	96.2	Very high	95.2	Very high	80 Å²	80	93.5 Å²	93.5	37%	0.374	45%	0.445	S	S	.	.	H	α-helix	trans	-64	-46.7	177.3	-72.1	165.2	156.1	0	0	110.7	R261 T262 R263 N268 T269	R261-E265 HydrophobicContact CG-CG 4.42Å; R261-E265 IonicContact CZ-OE1 2.68Å; R261-E265 VanDerWaalsContact CZ-OE1 3.28Å; R261-E265 IonicContact NE-OE1 3.28Å; R261-E265 PolarHBondContact NE-OE1 2.97Å; R261-E265 IonicContact NE-OE2 2.9Å; R261-E265 IonicContact NH2-OE1 2.97Å; R261-E265 PolarHBondContact NH2-OE1 3.24Å; R261-E265 WeakPolarHBondContact O-CG 3.46Å; R261-E265 PolarHBondContact O-N 3.41Å; T262-E265 WeakPolarHBondContact CA-OE2 3.44Å; R263-E265 VanDerWaalsContact C-N 3.33Å; R263-E265 PolarHBondContact O-N 3.21Å; E265-N268 PolarHBondContact O-N 3.44Å; E265-T269 PolarHBondContact O-N 3.04Å; E265-T269 PolarHBondContact O-OG1 3.23Å
266	K	96.9	Very high	95.6	Very high	139 Å²	139	93.9 Å²	93.9	60%	0.604	44%	0.442	S	S	*	.	H	α-helix	trans	-62.7	-48.2	172	-73.1	-170.7	171.7	-159	0	112.9	T262 R263 N268 T269 E270	T262-K266 WeakPolarHBondContact O-CG 3.5Å; T262-K266 PolarHBondContact O-N 3.24Å; R263-K266 PolarHBondContact O-N 2.91Å; K266-N268 VanDerWaalsContact C-N 3.25Å; K266-N268 PolarHBondContact O-N 2.9Å; K266-T269 WeakPolarHBondContact O-CA 3.28Å; K266-T269 WeakPolarHBondContact O-CB 3.42Å; K266-T269 PolarHBondContact O-N 3.02Å; K266-E270 PolarHBondContact O-N 3.34Å
267	E	97.1	Very high	95.9	Very high	76 Å²	76	96 Å²	96	36%	0.355	45%	0.446	S	S	.	.	H	α-helix	trans	-52.3	-44.8	177.1	-176.8	-159.3	127.1	0	0	111.1	R263 R264 E270 F271 K290	R263-E267 WeakPolarHBondContact O-CB 3.42Å; R263-E267 PolarHBondContact O-N 3.25Å; R264-E267 PolarHBondContact O-N 3.12Å; E267-E270 PolarHBondContact O-N 3.4Å; E267-F271 HydrophobicContact CG-CD2 4.13Å; E267-F271 HydrophobicContact CG-CE2 3.99Å; E267-F271 VanDerWaalsContact O-CD2 3.23Å; E267-F271 WeakPolarHBondContact O-CD2 3.38Å; E267-F271 PolarHBondContact O-N 2.73Å; E267-K290 IonicContact OE1-NZ 2.74Å; E267-K290 PolarHBondContact OE1-NZ 3.05Å
268	N	96.1	Very high	96	Very high	61 Å²	61	90.8 Å²	90.8	33%	0.326	42%	0.424	S	S	.	.	H	α-helix	trans	-61.6	-41.9	174.4	-70.5	0	0	0	0	112.4	R264 E265 K266 F271 Y272 K290	R264-N268 WeakPolarHBondContact O-CB 3.21Å; R264-N268 PolarHBondContact O-N 3.19Å; R264-N268 PolarHBondContact O-OD1 3.01Å; E265-N268 PolarHBondContact O-N 3.44Å; K266-N268 VanDerWaalsContact C-N 3.25Å; K266-N268 PolarHBondContact O-N 2.9Å; N268-F271 WeakPolarHBondContact O-CB 3.23Å; N268-F271 PolarHBondContact O-N 3.36Å; N268-Y272 HydrophobicContact CB-CE2 4.22Å; N268-Y272 WeakPolarHBondContact O-CD2 3.34Å; N268-Y272 PolarHBondContact O-N 3.48Å; N268-K290 VanDerWaalsContact OD1-CE 3.28Å; N268-K290 WeakPolarHBondContact OD1-CE 3.45Å; N268-K290 PolarHBondContact OD1-NZ 2.96Å
269	T	96.6	Very high	96	Very high	79 Å²	79	91.6 Å²	91.6	49%	0.485	43%	0.433	S	S	.	.	H	α-helix	trans	-59.2	-46.1	175.4	-56.8	0	0	0	0	111.9	E265 K266 F271 Y272 E273	E265-T269 PolarHBondContact O-N 3.04Å; E265-T269 PolarHBondContact O-OG1 3.23Å; K266-T269 WeakPolarHBondContact O-CA 3.28Å; K266-T269 WeakPolarHBondContact O-CB 3.42Å; K266-T269 PolarHBondContact O-N 3.02Å; T269-F271 VanDerWaalsContact C-N 3.3Å; T269-F271 PolarHBondContact O-N 3.29Å; T269-Y272 PolarHBondContact O-N 3.23Å; T269-E273 PolarHBondContact O-N 3.08Å
270	E	97.3	Very high	95.9	Very high	132 Å²	132	90 Å²	90	62%	0.617	42%	0.416	S	S	*	.	H	α-helix	trans	-62.1	-37.4	176.3	-53.4	-55.5	147.1	0	0	111.7	K266 E267 L274	K266-E270 PolarHBondContact O-N 3.34Å; E267-E270 PolarHBondContact O-N 3.4Å; E270-L274 VanDerWaalsContact O-CB 3.26Å; E270-L274 WeakPolarHBondContact O-CB 3.04Å; E270-L274 PolarHBondContact O-N 2.97Å
271	F	97.3	Very high	95.8	Very high	40 Å²	40	92.3 Å²	92.3	18%	0.175	43%	0.428	C	S	.	.	H	α-helix	trans	-63.6	-41.6	173.9	-90.2	-72	0	0	0	113	E267 N268 T269 L274 A275 K290 I293 I294	E267-F271 HydrophobicContact CG-CD2 4.13Å; E267-F271 HydrophobicContact CG-CE2 3.99Å; E267-F271 VanDerWaalsContact O-CD2 3.23Å; E267-F271 WeakPolarHBondContact O-CD2 3.38Å; E267-F271 PolarHBondContact O-N 2.73Å; N268-F271 WeakPolarHBondContact O-CB 3.23Å; N268-F271 PolarHBondContact O-N 3.36Å; T269-F271 VanDerWaalsContact C-N 3.3Å; T269-F271 PolarHBondContact O-N 3.29Å; F271-L274 PolarHBondContact O-N 3.37Å; F271-A275 WeakPolarHBondContact O-CB 3.47Å; F271-A275 PolarHBondContact O-N 2.97Å; F271-K290 HydrophobicContact CD1-CB 4.09Å; F271-K290 HydrophobicContact CD1-CD 4.47Å; F271-K290 HydrophobicContact CD1-CG 3.85Å; F271-K290 HydrophobicContact CD2-CD 3.73Å; F271-K290 HydrophobicContact CD2-CG 3.97Å; F271-K290 HydrophobicContact CE1-CB 3.7Å; F271-K290 HydrophobicContact CE1-CD 4.33Å; F271-K290 HydrophobicContact CE1-CG 3.88Å; F271-K290 WeakPolarHBondContact CE1-O 3.25Å; F271-K290 HydrophobicContact CE2-CB 4.41Å; F271-K290 HydrophobicContact CE2-CD 3.58Å; F271-K290 HydrophobicContact CE2-CG 4.01Å; F271-K290 HydrophobicContact CG-CD 4.2Å; F271-K290 HydrophobicContact CG-CG 3.91Å; F271-K290 HydrophobicContact CZ-CB 3.89Å; F271-K290 HydrophobicContact CZ-CD 3.9Å; F271-K290 HydrophobicContact CZ-CG 3.97Å; F271-I293 HydrophobicContact CB-CD1 4.49Å; F271-I293 HydrophobicContact CD1-CB 4.31Å; F271-I293 HydrophobicContact CD1-CD1 4.12Å; F271-I293 HydrophobicContact CD1-CG2 4.18Å; F271-I294 HydrophobicContact CE1-CD1 3.81Å; F271-I294 HydrophobicContact CE1-CG1 3.88Å; F271-I294 HydrophobicContact CZ-CD1 4.33Å; F271-I294 HydrophobicContact CZ-CG1 4.38Å
272	Y	95.4	Very high	95.7	Very high	156 Å²	156	89.8 Å²	89.8	61%	0.612	43%	0.434	S	S	*	.	H	α-helix	trans	-68.9	-40.6	178	-70.8	-58.2	0	0	0	112.4	N268 T269 A275 R276	N268-Y272 HydrophobicContact CB-CE2 4.22Å; N268-Y272 WeakPolarHBondContact O-CD2 3.34Å; N268-Y272 PolarHBondContact O-N 3.48Å; T269-Y272 PolarHBondContact O-N 3.23Å; Y272-A275 PolarHBondContact O-N 3.16Å; Y272-R276 WeakPolarHBondContact O-CB 3.19Å; Y272-R276 PolarHBondContact O-N 3.45Å
273	E	96.5	Very high	95.6	Very high	82 Å²	82	89 Å²	89	38%	0.383	43%	0.434	S	S	.	.	H	α-helix	trans	-65.6	-39.9	173.4	-71.8	-59.1	142.7	0	0	111.7	T269 A275 R276 L277	T269-E273 PolarHBondContact O-N 3.08Å; E273-A275 PolarHBondContact O-N 3.29Å; E273-R276 WeakPolarHBondContact O-CB 3.3Å; E273-R276 PolarHBondContact O-N 3.3Å; E273-R276 IonicContact OE1-NE 3.8Å; E273-R276 IonicContact OE2-CZ 3.05Å; E273-R276 IonicContact OE2-NE 3.59Å; E273-R276 PolarHBondContact OE2-NE 3.29Å; E273-R276 IonicContact OE2-NH2 3.7Å; E273-R276 PolarHBondContact OE2-NH2 3.06Å; E273-L277 WeakPolarHBondContact O-CG 3.46Å; E273-L277 PolarHBondContact O-N 3.3Å; E273-L277 VanDerWaalsContact O-N 3.13Å
274	L	97.3	Very high	95.4	Very high	53 Å²	53	83.9 Å²	83.9	28%	0.277	42%	0.419	S	S	.	.	H	α-helix	trans	-63.9	-40	174.9	-176.2	59	0	0	0	112.3	E270 F271 R276 L277 L278 I293 I294 T297	E270-L274 VanDerWaalsContact O-CB 3.26Å; E270-L274 WeakPolarHBondContact O-CB 3.04Å; E270-L274 PolarHBondContact O-N 2.97Å; F271-L274 PolarHBondContact O-N 3.37Å; L274-R276 VanDerWaalsContact C-N 3.34Å; L274-L277 PolarHBondContact O-N 3.48Å; L274-L278 PolarHBondContact O-N 3.37Å; L274-I293 HydrophobicContact CB-CG2 4.21Å; L274-I293 HydrophobicContact CD2-CG2 3.86Å; L274-I293 HydrophobicContact CG-CG2 3.84Å; L274-I294 HydrophobicContact CD2-CD1 4.1Å; L274-T297 HydrophobicContact CD1-CG2 3.96Å; L274-T297 HydrophobicContact CD2-CG2 4.48Å
275	A	97.3	Very high	95.3	Very high	2 Å²	2	77.1 Å²	77.1	2%	0.017	40%	0.395	C	S	.	.	H	α-helix	trans	-63.1	-39.8	173.5	0	0	0	0	0	111.9	F271 Y272 E273 L277 L278 T285 I293	F271-A275 WeakPolarHBondContact O-CB 3.47Å; F271-A275 PolarHBondContact O-N 2.97Å; Y272-A275 PolarHBondContact O-N 3.16Å; E273-A275 PolarHBondContact O-N 3.29Å; A275-L277 PolarHBondContact O-N 2.88Å; A275-L278 WeakPolarHBondContact O-CB 3.27Å; A275-L278 PolarHBondContact O-N 3.19Å; A275-L278 VanDerWaalsContact O-N 3.16Å; A275-T285 WeakPolarHBondContact O-CB 3.35Å; A275-T285 VanDerWaalsContact O-CG2 3.31Å; A275-T285 WeakPolarHBondContact O-CG2 3.49Å; A275-I293 HydrophobicContact CB-CD1 3.86Å; A275-I293 HydrophobicContact CB-CG1 3.98Å; A275-I293 HydrophobicContact CB-CG2 4.49Å
276	R	95.8	Very high	95.2	Very high	164 Å²	164	77.1 Å²	77.1	62%	0.619	40%	0.404	S	S	*	.	H	α-helix	trans	-65.8	-19.3	176.2	-164.8	175.6	71.4	85	0.2	113.5	Y272 E273 L274	Y272-R276 WeakPolarHBondContact O-CB 3.19Å; Y272-R276 PolarHBondContact O-N 3.45Å; E273-R276 WeakPolarHBondContact O-CB 3.3Å; E273-R276 PolarHBondContact O-N 3.3Å; E273-R276 IonicContact OE1-NE 3.8Å; E273-R276 IonicContact OE2-CZ 3.05Å; E273-R276 IonicContact OE2-NE 3.59Å; E273-R276 PolarHBondContact OE2-NE 3.29Å; E273-R276 IonicContact OE2-NH2 3.7Å; E273-R276 PolarHBondContact OE2-NH2 3.06Å; L274-R276 VanDerWaalsContact C-N 3.34Å
277	L	95.4	Very high	95.1	Very high	126 Å²	126	78.3 Å²	78.3	66%	0.66	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.8	-3.6	175.7	-67.9	170.9	0	0	0	114	E273 L274 A275	E273-L277 WeakPolarHBondContact O-CG 3.46Å; E273-L277 PolarHBondContact O-N 3.3Å; E273-L277 VanDerWaalsContact O-N 3.13Å; L274-L277 PolarHBondContact O-N 3.48Å; A275-L277 PolarHBondContact O-N 2.88Å
278	L	94	Very high	95	Very high	14 Å²	14	76 Å²	76	7%	0.073	40%	0.401	C	S	.	.	S	Bend	trans	-71.9	146.6	172.5	-68.2	173.8	0	0	0	110.9	L274 A275 L280 T285 L288 L296	L274-L278 PolarHBondContact O-N 3.37Å; A275-L278 WeakPolarHBondContact O-CB 3.27Å; A275-L278 PolarHBondContact O-N 3.19Å; A275-L278 VanDerWaalsContact O-N 3.16Å; L278-L280 PolarHBondContact O-N 2.91Å; L278-T285 HydrophobicContact CB-CG2 4.2Å; L278-L288 HydrophobicContact CD1-CD1 3.63Å; L278-L296 HydrophobicContact CD1-CB 3.93Å; L278-L296 HydrophobicContact CD1-CD1 4.01Å; L278-L296 HydrophobicContact CD2-CB 3.94Å
279	P	91.8	Very high	95	Very high	88 Å²	88	77.1 Å²	77.1	57%	0.571	41%	0.408	S	S	*	.	S	Bend	trans	-78.6	56.1	178.5	35.8	-38.5	0	0	0	111.5	Y300	P279-Y300 HydrophobicContact CG-CD2 3.8Å; P279-Y300 HydrophobicContact CG-CE2 3.92Å
280	L	92.2	Very high	95	Very high	32 Å²	32	77 Å²	77	17%	0.168	40%	0.4	C	S	.	.	S	Bend	trans	-137.6	150	-176.5	-68.9	174.3	0	0	0	110.2	L278 I284 T285 L296 V367	L278-L280 PolarHBondContact O-N 2.91Å; L280-I284 HydrophobicContact CD1-CG2 4.48Å; L280-T285 HydrophobicContact CB-CG2 3.61Å; L280-L296 HydrophobicContact CD1-CD1 4.11Å; L280-V367 HydrophobicContact CD1-CG2 4.42Å
281	P	92.6	Very high	95	Very high	71 Å²	71	73.9 Å²	73.9	46%	0.461	40%	0.398	S	S	.	.			trans	-55	144.2	175.4	-26.9	34.9	0	0	0	113.7	A283 I284 T285	P281-A283 PolarHBondContact O-N 3.42Å; P281-I284 HydrophobicContact CG-CD1 4.5Å; P281-I284 WeakPolarHBondContact O-CA 3.26Å; P281-I284 WeakPolarHBondContact O-CB 3.12Å; P281-I284 PolarHBondContact O-N 2.75Å; P281-T285 PolarHBondContact O-N 3.37Å
282	S	93.5	Very high	94.9	Very high	97 Å²	97	72.7 Å²	72.7	68%	0.678	39%	0.394	S	S	*	.	H	α-helix	trans	-58.4	-32	179.8	52.6	0	0	0	0	113.9	I284 T285 S286	S282-I284 PolarHBondContact O-N 3.31Å; S282-T285 WeakPolarHBondContact CA-OG1 3.35Å; S282-T285 PolarHBondContact O-N 2.57Å; S282-S286 VanDerWaalsContact O-CB 3.29Å; S282-S286 WeakPolarHBondContact O-CB 3.41Å; S282-S286 PolarHBondContact O-N 3.43Å; S282-S286 VanDerWaalsContact O-N 3.07Å; S282-S286 PolarHBondContact O-OG 2.99Å
283	A	94.2	Very high	95	Very high	55 Å²	55	65.5 Å²	65.5	46%	0.455	37%	0.366	S	S	.	.	H	α-helix	trans	-60.9	-27.8	173.4	0	0	0	0	0	113.1	P281 Q287	P281-A283 PolarHBondContact O-N 3.42Å; A283-Q287 PolarHBondContact O-NE2 3Å
284	I	94	Very high	95.1	Very high	58 Å²	58	65.5 Å²	65.5	30%	0.297	37%	0.368	S	S	.	.	H	α-helix	trans	-88.9	-50.5	174.6	-60.6	-177.9	0	0	0	110.1	L280 P281 S282 S286 Q287 L288 V367	L280-I284 HydrophobicContact CD1-CG2 4.48Å; P281-I284 HydrophobicContact CG-CD1 4.5Å; P281-I284 WeakPolarHBondContact O-CA 3.26Å; P281-I284 WeakPolarHBondContact O-CB 3.12Å; P281-I284 PolarHBondContact O-N 2.75Å; S282-I284 PolarHBondContact O-N 3.31Å; I284-S286 VanDerWaalsContact C-N 3.25Å; I284-S286 PolarHBondContact O-N 2.92Å; I284-Q287 PolarHBondContact O-N 3.08Å; I284-L288 HydrophobicContact CG2-CD2 4.33Å; I284-V367 HydrophobicContact CG2-CG2 3.87Å
285	T	94.4	Very high	95.1	Very high	14 Å²	14	65.7 Å²	65.7	9%	0.086	37%	0.365	C	S	.	.	H	α-helix	trans	-65.5	-27.2	-172	59.7	0	0	0	0	113.7	A275 L278 L280 P281 S282 Q287 L288	A275-T285 WeakPolarHBondContact O-CB 3.35Å; A275-T285 VanDerWaalsContact O-CG2 3.31Å; A275-T285 WeakPolarHBondContact O-CG2 3.49Å; L278-T285 HydrophobicContact CB-CG2 4.2Å; L280-T285 HydrophobicContact CB-CG2 3.61Å; P281-T285 PolarHBondContact O-N 3.37Å; S282-T285 WeakPolarHBondContact CA-OG1 3.35Å; S282-T285 PolarHBondContact O-N 2.57Å; T285-Q287 PolarHBondContact O-N 3.27Å; T285-L288 HydrophobicContact CG2-CD1 4.3Å
286	S	93.9	Very high	95.1	Very high	81 Å²	81	66.2 Å²	66.2	57%	0.566	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.4	-17.1	172.5	54.5	0	0	0	0	114.8	S282 I284	S282-S286 VanDerWaalsContact O-CB 3.29Å; S282-S286 WeakPolarHBondContact O-CB 3.41Å; S282-S286 PolarHBondContact O-N 3.43Å; S282-S286 VanDerWaalsContact O-N 3.07Å; S282-S286 PolarHBondContact O-OG 2.99Å; I284-S286 VanDerWaalsContact C-N 3.25Å; I284-S286 PolarHBondContact O-N 2.92Å
287	Q	94	Very high	95.1	Very high	163 Å²	163	59.5 Å²	59.5	76%	0.762	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.9	-2.8	-177.4	-59	-173.6	56.4	0	0	113.5	A283 I284 T285	A283-Q287 PolarHBondContact O-NE2 3Å; I284-Q287 PolarHBondContact O-N 3.08Å; T285-Q287 PolarHBondContact O-N 3.27Å
288	L	95.7	Very high	95.2	Very high	27 Å²	27	56.7 Å²	56.7	14%	0.141	33%	0.333	C	S	.	.			trans	-70.6	139.4	-177.1	-63.1	174.6	0	0	0	112.5	L278 I284 T285 I293 L296 V367	L278-L288 HydrophobicContact CD1-CD1 3.63Å; I284-L288 HydrophobicContact CG2-CD2 4.33Å; T285-L288 HydrophobicContact CG2-CD1 4.3Å; L288-I293 HydrophobicContact CB-CD1 4.18Å; L288-I293 HydrophobicContact CB-CG1 3.68Å; L288-I293 HydrophobicContact CD1-CG1 4.07Å; L288-L296 HydrophobicContact CD1-CD1 3.82Å; L288-L296 HydrophobicContact CD2-CD1 4.01Å; L288-V367 HydrophobicContact CD2-CG1 3.43Å; L288-V367 VanDerWaalsContact CD2-CG1 3.43Å
289	D	95.8	Very high	95.2	Very high	85 Å²	85	56.3 Å²	56.3	46%	0.455	33%	0.331	S	S	.	.			trans	-76.7	162.4	166.1	81	-85.5	0	0	0	111.8	A291 S292 I293	D289-A291 VanDerWaalsContact C-N 3.34Å; D289-A291 PolarHBondContact O-N 3.39Å; D289-A291 WeakPolarHBondContact OD2-CA 3.29Å; D289-A291 VanDerWaalsContact OD2-CB 3.27Å; D289-A291 WeakPolarHBondContact OD2-CB 3.4Å; D289-A291 PolarHBondContact OD2-N 3.2Å; D289-S292 PolarHBondContact O-N 3.39Å; D289-S292 WeakPolarHBondContact OD1-CB 3.29Å; D289-S292 PolarHBondContact OD1-OG 2.97Å; D289-S292 PolarHBondContact OD2-N 3.38Å; D289-S292 VanDerWaalsContact OD2-N 3.08Å; D289-I293 WeakPolarHBondContact O-CG1 3.4Å; D289-I293 PolarHBondContact O-N 2.7Å
290	K	96.5	Very high	95.3	Very high	76 Å²	76	56.1 Å²	56.1	33%	0.33	32%	0.32	S	S	.	.	H	α-helix	trans	-59.6	-36.5	-177.4	-72.2	-174	168.7	-176.3	0	114.4	E267 N268 F271 I294	E267-K290 IonicContact OE1-NZ 2.74Å; E267-K290 PolarHBondContact OE1-NZ 3.05Å; N268-K290 VanDerWaalsContact OD1-CE 3.28Å; N268-K290 WeakPolarHBondContact OD1-CE 3.45Å; N268-K290 PolarHBondContact OD1-NZ 2.96Å; F271-K290 HydrophobicContact CD1-CB 4.09Å; F271-K290 HydrophobicContact CD1-CD 4.47Å; F271-K290 HydrophobicContact CD1-CG 3.85Å; F271-K290 HydrophobicContact CD2-CD 3.73Å; F271-K290 HydrophobicContact CD2-CG 3.97Å; F271-K290 HydrophobicContact CE1-CB 3.7Å; F271-K290 HydrophobicContact CE1-CD 4.33Å; F271-K290 HydrophobicContact CE1-CG 3.88Å; F271-K290 WeakPolarHBondContact CE1-O 3.25Å; F271-K290 HydrophobicContact CE2-CB 4.41Å; F271-K290 HydrophobicContact CE2-CD 3.58Å; F271-K290 HydrophobicContact CE2-CG 4.01Å; F271-K290 HydrophobicContact CG-CD 4.2Å; F271-K290 HydrophobicContact CG-CG 3.91Å; F271-K290 HydrophobicContact CZ-CB 3.89Å; F271-K290 HydrophobicContact CZ-CD 3.9Å; F271-K290 HydrophobicContact CZ-CG 3.97Å; K290-I294 WeakPolarHBondContact O-CG1 3.41Å; K290-I294 PolarHBondContact O-N 3.27Å
291	A	96.8	Very high	95.3	Very high	68 Å²	68	59.3 Å²	59.3	56%	0.562	34%	0.337	S	S	*	.	H	α-helix	trans	-72.6	-43	179.3	0	0	0	0	0	110.6	D289 I293 I294 R295	D289-A291 VanDerWaalsContact C-N 3.34Å; D289-A291 PolarHBondContact O-N 3.39Å; D289-A291 WeakPolarHBondContact OD2-CA 3.29Å; D289-A291 VanDerWaalsContact OD2-CB 3.27Å; D289-A291 WeakPolarHBondContact OD2-CB 3.4Å; D289-A291 PolarHBondContact OD2-N 3.2Å; A291-I293 VanDerWaalsContact C-N 3.33Å; A291-I293 PolarHBondContact O-N 2.92Å; A291-I294 PolarHBondContact O-N 3.35Å; A291-R295 VanDerWaalsContact O-CB 3.3Å; A291-R295 WeakPolarHBondContact O-CB 3.11Å; A291-R295 PolarHBondContact O-N 3.45Å
292	S	96.5	Very high	95.3	Very high	15 Å²	15	58.9 Å²	58.9	11%	0.105	33%	0.327	C	S	.	.	H	α-helix	trans	-59	-41.5	173	-66.3	0	0	0	0	112.2	D289 I294 R295 L296	D289-S292 PolarHBondContact O-N 3.39Å; D289-S292 WeakPolarHBondContact OD1-CB 3.29Å; D289-S292 PolarHBondContact OD1-OG 2.97Å; D289-S292 PolarHBondContact OD2-N 3.38Å; D289-S292 VanDerWaalsContact OD2-N 3.08Å; S292-I294 PolarHBondContact O-N 2.67Å; S292-R295 PolarHBondContact O-N 2.79Å; S292-R295 PolarHBondContact OG-NH2 2.83Å; S292-L296 WeakPolarHBondContact O-CB 3.46Å; S292-L296 WeakPolarHBondContact O-CD1 3.16Å; S292-L296 WeakPolarHBondContact O-CG 3.4Å; S292-L296 PolarHBondContact O-N 2.99Å
293	I	97.8	Very high	95.1	Very high	5 Å²	5	55 Å²	55	3%	0.026	30%	0.299	C	S	.	.	H	α-helix	trans	-56.4	-53.2	175.5	-65.5	161.4	0	0	0	110.8	F271 L274 A275 L288 D289 A291 R295 L296 T297	F271-I293 HydrophobicContact CB-CD1 4.49Å; F271-I293 HydrophobicContact CD1-CB 4.31Å; F271-I293 HydrophobicContact CD1-CD1 4.12Å; F271-I293 HydrophobicContact CD1-CG2 4.18Å; L274-I293 HydrophobicContact CB-CG2 4.21Å; L274-I293 HydrophobicContact CD2-CG2 3.86Å; L274-I293 HydrophobicContact CG-CG2 3.84Å; A275-I293 HydrophobicContact CB-CD1 3.86Å; A275-I293 HydrophobicContact CB-CG1 3.98Å; A275-I293 HydrophobicContact CB-CG2 4.49Å; L288-I293 HydrophobicContact CB-CD1 4.18Å; L288-I293 HydrophobicContact CB-CG1 3.68Å; L288-I293 HydrophobicContact CD1-CG1 4.07Å; D289-I293 WeakPolarHBondContact O-CG1 3.4Å; D289-I293 PolarHBondContact O-N 2.7Å; A291-I293 VanDerWaalsContact C-N 3.33Å; A291-I293 PolarHBondContact O-N 2.92Å; I293-R295 VanDerWaalsContact C-N 3.34Å; I293-R295 PolarHBondContact O-N 3.32Å; I293-L296 PolarHBondContact O-N 3.31Å; I293-T297 WeakPolarHBondContact O-CB 3.35Å; I293-T297 PolarHBondContact O-N 2.84Å; I293-T297 PolarHBondContact O-OG1 2.88Å
294	I	97.8	Very high	94.7	Very high	81 Å²	81	59.3 Å²	59.3	42%	0.415	30%	0.303	S	S	.	.	H	α-helix	trans	-62.2	-40.6	179	-60.4	-56	0	0	0	112	F271 L274 K290 A291 S292 T298	F271-I294 HydrophobicContact CE1-CD1 3.81Å; F271-I294 HydrophobicContact CE1-CG1 3.88Å; F271-I294 HydrophobicContact CZ-CD1 4.33Å; F271-I294 HydrophobicContact CZ-CG1 4.38Å; L274-I294 HydrophobicContact CD2-CD1 4.1Å; K290-I294 WeakPolarHBondContact O-CG1 3.41Å; K290-I294 PolarHBondContact O-N 3.27Å; A291-I294 PolarHBondContact O-N 3.35Å; S292-I294 PolarHBondContact O-N 2.67Å; I294-T298 VanDerWaalsContact O-CB 3.25Å; I294-T298 WeakPolarHBondContact O-CB 3.44Å; I294-T298 PolarHBondContact O-N 2.95Å; I294-T298 PolarHBondContact O-OG1 3.4Å
295	R	97.1	Very high	94.2	Very high	57 Å²	57	61.4 Å²	61.4	22%	0.215	32%	0.319	C	S	.	.	H	α-helix	trans	-62.1	-46.5	179.6	-173.9	178.7	71.6	-148.1	-11.3	111.3	A291 S292 I293 S299 V367 E368 T370 N372	A291-R295 VanDerWaalsContact O-CB 3.3Å; A291-R295 WeakPolarHBondContact O-CB 3.11Å; A291-R295 PolarHBondContact O-N 3.45Å; S292-R295 PolarHBondContact O-N 2.79Å; S292-R295 PolarHBondContact OG-NH2 2.83Å; I293-R295 VanDerWaalsContact C-N 3.34Å; I293-R295 PolarHBondContact O-N 3.32Å; R295-S299 WeakPolarHBondContact O-CB 3.28Å; R295-S299 PolarHBondContact O-N 2.9Å; R295-S299 PolarHBondContact O-OG 2.84Å; R295-V367 PolarHBondContact NH2-O 3.11Å; R295-E368 PolarHBondContact NH2-O 2.89Å; R295-E368 VanDerWaalsContact NH2-O 3.11Å; R295-T370 VanDerWaalsContact CD-O 3.28Å; R295-T370 WeakPolarHBondContact CD-O 3.38Å; R295-T370 VanDerWaalsContact CG-O 3.31Å; R295-T370 WeakPolarHBondContact CG-O 3.31Å; R295-T370 PolarHBondContact NE-O 3.49Å; R295-N372 WeakPolarHBondContact CD-OD1 3.32Å; R295-N372 PolarHBondContact NE-OD1 3.17Å; R295-N372 PolarHBondContact NH1-OD1 3.39Å
296	L	97.2	Very high	93.4	Very high	14 Å²	14	61.2 Å²	61.2	7%	0.073	32%	0.317	C	S	.	.	H	α-helix	trans	-67.8	-45.4	178	-66.4	164.7	0	0	0	111.6	L278 L280 L288 S292 I293 T298 S299 Y300 V367 T370	L278-L296 HydrophobicContact CD1-CB 3.93Å; L278-L296 HydrophobicContact CD1-CD1 4.01Å; L278-L296 HydrophobicContact CD2-CB 3.94Å; L280-L296 HydrophobicContact CD1-CD1 4.11Å; L288-L296 HydrophobicContact CD1-CD1 3.82Å; L288-L296 HydrophobicContact CD2-CD1 4.01Å; S292-L296 WeakPolarHBondContact O-CB 3.46Å; S292-L296 WeakPolarHBondContact O-CD1 3.16Å; S292-L296 WeakPolarHBondContact O-CG 3.4Å; S292-L296 PolarHBondContact O-N 2.99Å; I293-L296 PolarHBondContact O-N 3.31Å; L296-T298 VanDerWaalsContact C-N 3.35Å; L296-T298 PolarHBondContact O-N 3.39Å; L296-S299 PolarHBondContact O-N 3.03Å; L296-Y300 WeakPolarHBondContact O-CB 3.44Å; L296-Y300 PolarHBondContact O-N 3.43Å; L296-V367 HydrophobicContact CD1-CG1 4.1Å; L296-T370 HydrophobicContact CD2-CG2 3.88Å
297	T	96.9	Very high	92.7	Very high	23 Å²	23	59 Å²	59	14%	0.141	30%	0.297	C	S	.	.	H	α-helix	trans	-58.2	-46.9	175.1	-61.3	0	0	0	0	111.2	L274 I293 S299 Y300 L301	L274-T297 HydrophobicContact CD1-CG2 3.96Å; L274-T297 HydrophobicContact CD2-CG2 4.48Å; I293-T297 WeakPolarHBondContact O-CB 3.35Å; I293-T297 PolarHBondContact O-N 2.84Å; I293-T297 PolarHBondContact O-OG1 2.88Å; T297-S299 VanDerWaalsContact C-N 3.35Å; T297-S299 PolarHBondContact O-N 2.93Å; T297-Y300 PolarHBondContact O-N 3.11Å; T297-L301 HydrophobicContact CG2-CD1 3.98Å; T297-L301 HydrophobicContact CG2-CG 4.46Å; T297-L301 WeakPolarHBondContact O-CB 3.36Å; T297-L301 VanDerWaalsContact O-CG 3.29Å; T297-L301 WeakPolarHBondContact O-CG 3.35Å; T297-L301 PolarHBondContact O-N 3.18Å
298	T	95.7	Very high	91.4	Very high	66 Å²	66	55.4 Å²	55.4	41%	0.405	29%	0.288	S	S	.	.	H	α-helix	trans	-65.8	-39.8	-178.2	-60.8	0	0	0	0	111.2	I294 L296 L301 K302	I294-T298 VanDerWaalsContact O-CB 3.25Å; I294-T298 WeakPolarHBondContact O-CB 3.44Å; I294-T298 PolarHBondContact O-N 2.95Å; I294-T298 PolarHBondContact O-OG1 3.4Å; L296-T298 VanDerWaalsContact C-N 3.35Å; L296-T298 PolarHBondContact O-N 3.39Å; T298-L301 PolarHBondContact O-N 2.73Å; T298-K302 WeakPolarHBondContact O-CG 3.46Å; T298-K302 PolarHBondContact O-N 3.28Å
299	S	95.5	Very high	89.9	Confident	6 Å²	6	58.5 Å²	58.5	4%	0.042	31%	0.305	C	S	.	.	H	α-helix	trans	-65.1	-47.5	176.1	-55.7	0	0	0	0	111.3	R295 L296 T297 L301 K302 I303 G371	R295-S299 WeakPolarHBondContact O-CB 3.28Å; R295-S299 PolarHBondContact O-N 2.9Å; R295-S299 PolarHBondContact O-OG 2.84Å; L296-S299 PolarHBondContact O-N 3.03Å; T297-S299 VanDerWaalsContact C-N 3.35Å; T297-S299 PolarHBondContact O-N 2.93Å; S299-L301 VanDerWaalsContact C-N 3.34Å; S299-L301 PolarHBondContact O-N 2.88Å; S299-K302 CarbonylContact O-C 3.59Å; S299-K302 PolarHBondContact O-N 3.16Å; S299-K302 VanDerWaalsContact O-N 3.11Å; S299-I303 WeakPolarHBondContact O-CG1 3.31Å; S299-I303 PolarHBondContact O-N 3.22Å; S299-G371 WeakPolarHBondContact OG-CA 3.39Å
300	Y	93.4	Very high	87.9	Confident	85 Å²	85	56.2 Å²	56.2	33%	0.333	30%	0.301	S	S	.	.	H	α-helix	trans	-58.2	-42.5	175.5	176.1	-104.2	0	0	0	112.7	P279 L296 T297 I303 R304	P279-Y300 HydrophobicContact CG-CD2 3.8Å; P279-Y300 HydrophobicContact CG-CE2 3.92Å; L296-Y300 WeakPolarHBondContact O-CB 3.44Å; L296-Y300 PolarHBondContact O-N 3.43Å; T297-Y300 PolarHBondContact O-N 3.11Å; Y300-I303 PolarHBondContact O-N 3.48Å; Y300-R304 PolarHBondContact O-N 2.69Å; Y300-R304 VanDerWaalsContact O-N 3.17Å; Y300-R304 PolarHBondContact OH-NH1 3.22Å
301	L	93.1	Very high	85.8	Confident	99 Å²	99	59.1 Å²	59.1	52%	0.518	31%	0.314	S	S	.	.	H	α-helix	trans	-65.9	-39.6	174.6	-68.4	174	0	0	0	112.1	T297 T298 S299 R304 T305	T297-L301 HydrophobicContact CG2-CD1 3.98Å; T297-L301 HydrophobicContact CG2-CG 4.46Å; T297-L301 WeakPolarHBondContact O-CB 3.36Å; T297-L301 VanDerWaalsContact O-CG 3.29Å; T297-L301 WeakPolarHBondContact O-CG 3.35Å; T297-L301 PolarHBondContact O-N 3.18Å; T298-L301 PolarHBondContact O-N 2.73Å; S299-L301 VanDerWaalsContact C-N 3.34Å; S299-L301 PolarHBondContact O-N 2.88Å; L301-R304 PolarHBondContact O-N 2.87Å; L301-T305 PolarHBondContact O-N 3.07Å
302	K	91.5	Very high	83.2	Confident	61 Å²	61	56.8 Å²	56.8	27%	0.265	30%	0.297	S	S	.	.	H	α-helix	trans	-63.7	-35.1	172.6	-77.2	-169.3	-179.2	-170.7	0	112.6	T298 S299 R304 T305 I306 E348 L352	T298-K302 WeakPolarHBondContact O-CG 3.46Å; T298-K302 PolarHBondContact O-N 3.28Å; S299-K302 CarbonylContact O-C 3.59Å; S299-K302 PolarHBondContact O-N 3.16Å; S299-K302 VanDerWaalsContact O-N 3.11Å; K302-R304 VanDerWaalsContact C-N 3.34Å; K302-R304 PolarHBondContact O-N 3.28Å; K302-T305 PolarHBondContact O-N 3.23Å; K302-T305 PolarHBondContact O-OG1 3.45Å; K302-I306 WeakPolarHBondContact O-CD1 3.46Å; K302-I306 WeakPolarHBondContact O-CG1 3.47Å; K302-I306 PolarHBondContact O-N 3.13Å; K302-E348 IonicContact NZ-OE1 2.64Å; K302-E348 PolarHBondContact NZ-OE1 2.96Å; K302-E348 IonicContact NZ-OE2 3.49Å; K302-E348 PolarHBondContact NZ-OE2 2.83Å; K302-L352 HydrophobicContact CB-CD1 4.1Å; K302-L352 HydrophobicContact CB-CD2 3.79Å; K302-L352 HydrophobicContact CD-CD2 3.74Å; K302-L352 HydrophobicContact CG-CD2 4.39Å
303	I	89.5	Confident	80.5	Confident	16 Å²	16	60.8 Å²	60.8	8%	0.082	32%	0.317	C	S	.	.	H	α-helix	trans	-59.6	-47.4	170.8	-60.2	167.4	0	0	0	109.7	S299 Y300 T305 I306 F307 F311 L352 Y353	S299-I303 WeakPolarHBondContact O-CG1 3.31Å; S299-I303 PolarHBondContact O-N 3.22Å; Y300-I303 PolarHBondContact O-N 3.48Å; I303-T305 PolarHBondContact O-N 3.02Å; I303-I306 PolarHBondContact O-N 3.3Å; I303-F307 HydrophobicContact CG2-CD2 3.82Å; I303-F307 HydrophobicContact CG2-CE2 4.41Å; I303-F307 WeakPolarHBondContact O-CD2 3.42Å; I303-F307 PolarHBondContact O-N 3.47Å; I303-F311 HydrophobicContact CG2-CE2 3.69Å; I303-F311 HydrophobicContact CG2-CZ 3.6Å; I303-L352 WeakPolarHBondContact CD1-O 3.37Å; I303-L352 HydrophobicContact CG1-CB 4.11Å; I303-Y353 HydrophobicContact CD1-CD2 4.44Å
304	R	85.4	Confident	77.7	Confident	146 Å²	146	65.9 Å²	65.9	55%	0.551	35%	0.345	S	S	*	.	H	α-helix	trans	-66.7	-17.6	-177	-68.5	-173.3	68.8	159.6	-0.5	114.6	Y300 L301 K302 F307 P308	Y300-R304 PolarHBondContact O-N 2.69Å; Y300-R304 VanDerWaalsContact O-N 3.17Å; Y300-R304 PolarHBondContact OH-NH1 3.22Å; L301-R304 PolarHBondContact O-N 2.87Å; K302-R304 VanDerWaalsContact C-N 3.34Å; K302-R304 PolarHBondContact O-N 3.28Å; R304-F307 CarbonylContact O-C 3.57Å; R304-P308 WeakPolarHBondContact O-CA 3.47Å
305	T	82.8	Confident	75	Confident	101 Å²	101	73 Å²	73	62%	0.62	37%	0.366	S	S	*	.	H	α-helix	trans	-82.6	-26.6	170.4	61.3	0	0	0	0	113.1	L301 K302 I303	L301-T305 PolarHBondContact O-N 3.07Å; K302-T305 PolarHBondContact O-N 3.23Å; K302-T305 PolarHBondContact O-OG1 3.45Å; I303-T305 PolarHBondContact O-N 3.02Å
306	I	79.6	Confident	72	Confident	11 Å²	11	75.7 Å²	75.7	6%	0.056	39%	0.385	C	S	.	.	H	α-helix	trans	-79.3	-31.5	173.9	-60	162.7	0	0	0	110.9	K302 I303 P308 L352 R442 L457	K302-I306 WeakPolarHBondContact O-CD1 3.46Å; K302-I306 WeakPolarHBondContact O-CG1 3.47Å; K302-I306 PolarHBondContact O-N 3.13Å; I303-I306 PolarHBondContact O-N 3.3Å; I306-P308 WeakPolarHBondContact O-CD 3.48Å; I306-L352 HydrophobicContact CD1-CD1 3.33Å; I306-R442 PolarHBondContact O-NH1 2.82Å; I306-R442 PolarHBondContact O-NH2 2.91Å; I306-L457 WeakPolarHBondContact CD1-O 3.42Å; I306-L457 WeakPolarHBondContact CG1-O 3.23Å; I306-L457 HydrophobicContact CG2-CB 4.3Å
307	F	78.2	Confident	69.2	Low	34 Å²	34	84.8 Å²	84.8	15%	0.149	42%	0.42	C	S	.	.			trans	-125.9	69.8	-178.7	-59.1	-83.3	0	0	0	110.8	I303 R304 N309 G310 F311 I344 R442 I460	I303-F307 HydrophobicContact CG2-CD2 3.82Å; I303-F307 HydrophobicContact CG2-CE2 4.41Å; I303-F307 WeakPolarHBondContact O-CD2 3.42Å; I303-F307 PolarHBondContact O-N 3.47Å; R304-F307 CarbonylContact O-C 3.57Å; F307-N309 PolarHBondContact O-N 2.9Å; F307-G310 WeakPolarHBondContact CB-O 3.39Å; F307-G310 PolarHBondContact O-N 3.21Å; F307-F311 HydrophobicContact CD1-CD1 4.08Å; F307-F311 HydrophobicContact CD1-CE1 4.16Å; F307-F311 AromaticContact CD2-CE1 3.88Å; F307-F311 HydrophobicContact CD2-CE1 3.88Å; F307-F311 HydrophobicContact CD2-CZ 4.02Å; F307-F311 HydrophobicContact CE1-CD1 4.1Å; F307-F311 AromaticContact CE1-CE1 3.97Å; F307-F311 HydrophobicContact CE1-CE1 3.97Å; F307-F311 AromaticContact CE2-CE1 3.7Å; F307-F311 HydrophobicContact CE2-CE1 3.7Å; F307-F311 HydrophobicContact CE2-CZ 4.06Å; F307-F311 HydrophobicContact CG-CD1 4.28Å; F307-F311 HydrophobicContact CG-CE1 4.1Å; F307-F311 HydrophobicContact CG-CZ 4.48Å; F307-F311 HydrophobicContact CZ-CD1 4.33Å; F307-F311 AromaticContact CZ-CE1 3.72Å; F307-F311 HydrophobicContact CZ-CE1 3.72Å; F307-I344 HydrophobicContact CE2-CD1 3.89Å; F307-I344 HydrophobicContact CZ-CD1 4.29Å; F307-R442 VanDerWaalsContact CE1-NH1 3.33Å; F307-I460 HydrophobicContact CE1-CD1 4.25Å; F307-I460 HydrophobicContact CZ-CD1 3.6Å; F307-I460 HydrophobicContact CZ-CG1 4.16Å
308	P	67.3	Low	66.1	Low	87 Å²	87	87.5 Å²	87.5	57%	0.565	44%	0.44	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.3	-36	-175.9	25.2	-34	0	0	0	113	R304 I306 G310	R304-P308 WeakPolarHBondContact O-CA 3.47Å; I306-P308 WeakPolarHBondContact O-CD 3.48Å; P308-G310 PolarHBondContact O-N 3Å
309	N	62.7	Low	63.4	Low	92 Å²	92	92.1 Å²	92.1	49%	0.492	46%	0.457	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.7	37.7	175.9	-54.9	16.6	0	0	0	111	F307 G312 D313	F307-N309 PolarHBondContact O-N 2.9Å; N309-G312 PolarHBondContact O-N 3.34Å; N309-D313 PolarHBondContact O-N 3.17Å; N309-D313 VanDerWaalsContact O-N 3.07Å
310	G	54.5	Low	60.7	Low	37 Å²	37	96.1 Å²	96.1	38%	0.381	49%	0.49	S	S	.	.	T	Hydrogen-bonded Turn	trans	57.2	-167	-171.9	0	0	0	0	0	114.4	F307 P308 G312	F307-G310 WeakPolarHBondContact CB-O 3.39Å; F307-G310 PolarHBondContact O-N 3.21Å; P308-G310 PolarHBondContact O-N 3Å; G310-G312 PolarHBondContact O-N 2.66Å
311	F	53.5	Low	58	Low	137 Å²	137	100.3 Å²	100.3	60%	0.601	52%	0.517	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.5	47.1	164.3	-74.1	-79.7	0	0	0	111.3	I303 F307 I344	I303-F311 HydrophobicContact CG2-CE2 3.69Å; I303-F311 HydrophobicContact CG2-CZ 3.6Å; F307-F311 HydrophobicContact CD1-CD1 4.08Å; F307-F311 HydrophobicContact CD1-CE1 4.16Å; F307-F311 AromaticContact CD2-CE1 3.88Å; F307-F311 HydrophobicContact CD2-CE1 3.88Å; F307-F311 HydrophobicContact CD2-CZ 4.02Å; F307-F311 HydrophobicContact CE1-CD1 4.1Å; F307-F311 AromaticContact CE1-CE1 3.97Å; F307-F311 HydrophobicContact CE1-CE1 3.97Å; F307-F311 AromaticContact CE2-CE1 3.7Å; F307-F311 HydrophobicContact CE2-CE1 3.7Å; F307-F311 HydrophobicContact CE2-CZ 4.06Å; F307-F311 HydrophobicContact CG-CD1 4.28Å; F307-F311 HydrophobicContact CG-CE1 4.1Å; F307-F311 HydrophobicContact CG-CZ 4.48Å; F307-F311 HydrophobicContact CZ-CD1 4.33Å; F307-F311 AromaticContact CZ-CE1 3.72Å; F307-F311 HydrophobicContact CZ-CE1 3.72Å; F311-I344 HydrophobicContact CE1-CD1 3.99Å; F311-I344 HydrophobicContact CZ-CD1 3.89Å
312	G	40.3	Very low	55.7	Low	20 Å²	20	100.4 Å²	100.4	21%	0.206	53%	0.526	C	S	.	.	T	Hydrogen-bonded Turn	trans	100	67.6	169.4	0	0	0	0	0	116.1	N309 G310 N314 W315	N309-G312 PolarHBondContact O-N 3.34Å; G310-G312 PolarHBondContact O-N 2.66Å; G312-N314 PolarHBondContact O-N 3.37Å; G312-N314 VanDerWaalsContact O-N 3.12Å; G312-W315 PolarHBondContact O-N 3.21Å
313	D	40.9	Very low	53.8	Low	98 Å²	98	101.5 Å²	101.5	52%	0.524	54%	0.535	S	S	.	.	G	3₁₀ helix	trans	-53	-27	154.4	-65.7	-40.4	0	0	0	111	N309 W315 N316	N309-D313 PolarHBondContact O-N 3.17Å; N309-D313 VanDerWaalsContact O-N 3.07Å; D313-W315 VanDerWaalsContact C-N 3.31Å; D313-W315 PolarHBondContact O-N 2.66Å; D313-N316 WeakPolarHBondContact O-CB 3.39Å; D313-N316 PolarHBondContact O-N 2.86Å
314	N	38.3	Very low	52	Low	113 Å²	113	107.8 Å²	107.8	60%	0.604	56%	0.564	S	S	*	*	G	3₁₀ helix	trans	-70.2	-14.5	174.1	-69	13.4	0	0	0	115.1	G312 N316	G312-N314 PolarHBondContact O-N 3.37Å; G312-N314 VanDerWaalsContact O-N 3.12Å; N314-N316 VanDerWaalsContact C-N 3.26Å
315	W	41.9	Very low	50.6	Low	230 Å²	230	105.8 Å²	105.8	87%	0.871	57%	0.568	S	S	*	*	G	3₁₀ helix	trans	-76.8	-17.5	171.2	-75.6	68.9	0	0	0	111.8	G312 D313 Y317	G312-W315 PolarHBondContact O-N 3.21Å; D313-W315 VanDerWaalsContact C-N 3.31Å; D313-W315 PolarHBondContact O-N 2.66Å; W315-Y317 VanDerWaalsContact C-N 3.27Å; W315-Y317 PolarHBondContact O-N 3.41Å
316	N	34.5	Very low	49.3	Very low	114 Å²	114	105.4 Å²	105.4	61%	0.61	56%	0.561	S	S	*	*	G	3₁₀ helix	trans	-86.5	11.4	179.9	-61.9	-24.3	0	0	0	113.6	D313 N314 S318	D313-N316 WeakPolarHBondContact O-CB 3.39Å; D313-N316 PolarHBondContact O-N 2.86Å; N314-N316 VanDerWaalsContact C-N 3.26Å; N316-S318 VanDerWaalsContact C-N 3.25Å; N316-S318 PolarHBondContact O-N 3.1Å
317	Y	37.2	Very low	48.3	Very low	204 Å²	204	109.9 Å²	109.9	80%	0.8	58%	0.582	S	S	*	*	S	Bend	trans	-87.8	35.1	175.8	-90.9	-81.5	0	0	0	114.1	W315	W315-Y317 VanDerWaalsContact C-N 3.27Å; W315-Y317 PolarHBondContact O-N 3.41Å
318	S	33.2	Very low	47.5	Very low	81 Å²	81	118.5 Å²	118.5	57%	0.566	61%	0.613	S	S	*	*	S	Bend	trans	-149.6	144.5	152.5	-159.6	0	0	0	0	111.8	N316	N316-S318 VanDerWaalsContact C-N 3.25Å; N316-S318 PolarHBondContact O-N 3.1Å
319	H	38.9	Very low	47.4	Very low	163 Å²	163	119.8 Å²	119.8	76%	0.755	61%	0.611	S	S	*	*			trans	59.2	73.7	176.9	-54.8	-66.1	0	0	0	117	L321	H319-L321 PolarHBondContact O-N 3.16Å
320	A	37.1	Very low	47.9	Very low	90 Å²	90	119.7 Å²	119.7	74%	0.744	61%	0.611	S	S	*	*	S	Bend	trans	-52.1	137.3	146.8	0	0	0	0	0	110.2
321	L	38.4	Very low	48.5	Very low	172 Å²	172	120.3 Å²	120.3	90%	0.901	61%	0.612	S	S	*	*	S	Bend	trans	64.8	88	-176.2	-63.6	74.3	0	0	0	115.7	H319	H319-L321 PolarHBondContact O-N 3.16Å
322	S	43.6	Very low	49.5	Very low	101 Å²	101	116.8 Å²	116.8	71%	0.706	60%	0.603	S	S	*	*	S	Bend	trans	-168.4	-53.4	140.9	-156.7	0	0	0	0	115.2
323	N	52	Low	51.3	Low	85 Å²	85	119.2 Å²	119.2	46%	0.455	61%	0.611	S	S	.	*			trans	-113.2	31.9	-142.1	-77.1	-21.4	0	0	0	118	V325 I326 E327	N323-V325 PolarHBondContact O-N 3.1Å; N323-I326 HydrophobicContact CB-CB 4.36Å; N323-I326 HydrophobicContact CB-CD1 4.05Å; N323-I326 HydrophobicContact CB-CG1 4.23Å; N323-I326 PolarHBondContact O-N 2.95Å; N323-E327 PolarHBondContact O-N 2.97Å
324	H	52.2	Low	53.2	Low	147 Å²	147	118.2 Å²	118.2	68%	0.681	61%	0.605	S	S	*	*	H	α-helix	trans	-55.3	-20	179.9	-73	-37.3	0	0	0	116.4	E327	H324-E327 IonicContact CE1-OE2 2.74Å; H324-E327 IonicContact CG-OE2 3.31Å; H324-E327 IonicContact ND1-OE1 2.82Å; H324-E327 IonicContact ND1-OE2 2.92Å; H324-E327 PolarHBondContact ND1-OE2 3.28Å
325	V	55.4	Low	55.1	Low	105 Å²	105	115.7 Å²	115.7	64%	0.636	59%	0.589	S	S	*	*	H	α-helix	trans	-70.6	-46	172.5	-178.7	0	0	0	0	110.7	N323 E327 R328 E329	N323-V325 PolarHBondContact O-N 3.1Å; V325-E327 PolarHBondContact O-N 3.26Å; V325-R328 PolarHBondContact O-N 3.14Å; V325-E329 PolarHBondContact O-N 2.81Å
326	I	56.5	Low	56.7	Low	93 Å²	93	112.6 Å²	112.6	48%	0.477	58%	0.581	S	S	.	*	H	α-helix	trans	-64.6	-44.7	-177.7	-53.7	-176.1	0	0	0	109.9	N323 R328 E329 L330	N323-I326 HydrophobicContact CB-CB 4.36Å; N323-I326 HydrophobicContact CB-CD1 4.05Å; N323-I326 HydrophobicContact CB-CG1 4.23Å; N323-I326 PolarHBondContact O-N 2.95Å; I326-R328 VanDerWaalsContact C-N 3.27Å; I326-R328 PolarHBondContact O-N 2.83Å; I326-E329 PolarHBondContact O-N 2.94Å; I326-L330 WeakPolarHBondContact O-CB 3.47Å; I326-L330 PolarHBondContact O-N 3Å
327	E	57.8	Low	59	Low	105 Å²	105	112.1 Å²	112.1	49%	0.491	59%	0.587	S	S	.	*	H	α-helix	trans	-54.7	-39.3	179.8	-68.7	162.8	-173	0	0	113.1	N323 H324 V325	N323-E327 PolarHBondContact O-N 2.97Å; H324-E327 IonicContact CE1-OE2 2.74Å; H324-E327 IonicContact CG-OE2 3.31Å; H324-E327 IonicContact ND1-OE1 2.82Å; H324-E327 IonicContact ND1-OE2 2.92Å; H324-E327 PolarHBondContact ND1-OE2 3.28Å; V325-E327 PolarHBondContact O-N 3.26Å
328	R	60.2	Low	61.2	Low	214 Å²	214	104.5 Å²	104.5	81%	0.808	56%	0.56	S	S	*	*	H	α-helix	trans	-75.7	-35.5	-179.9	-76.4	-175.6	169.6	-172.2	-3.1	113.6	V325 I326 P332	V325-R328 PolarHBondContact O-N 3.14Å; I326-R328 VanDerWaalsContact C-N 3.27Å; I326-R328 PolarHBondContact O-N 2.83Å; R328-P332 WeakPolarHBondContact O-CD 3.27Å
329	E	67.1	Low	63.6	Low	114 Å²	114	107 Å²	107	53%	0.533	57%	0.566	S	S	.	*	H	α-helix	trans	-85.4	-24.8	179.8	-64.9	-171.4	175.8	0	0	112.9	V325 I326 A331 P332 N333	V325-E329 PolarHBondContact O-N 2.81Å; I326-E329 PolarHBondContact O-N 2.94Å; E329-A331 PolarHBondContact O-N 3.48Å; E329-P332 WeakPolarHBondContact O-CD 3.47Å; E329-N333 VanDerWaalsContact O-CB 3.28Å; E329-N333 WeakPolarHBondContact O-CB 3.29Å; E329-N333 PolarHBondContact O-N 2.94Å; E329-N333 PolarHBondContact O-ND2 3.34Å
330	L	72	Confident	66.1	Low	91 Å²	91	99.5 Å²	99.5	48%	0.476	53%	0.533	S	S	.	.	H	α-helix	trans	-59.8	-48.1	-174.1	179.4	61.9	0	0	0	112.9	I326 N333 I334	I326-L330 WeakPolarHBondContact O-CB 3.47Å; I326-L330 PolarHBondContact O-N 3Å; L330-N333 PolarHBondContact O-N 3.47Å; L330-I334 HydrophobicContact CD1-CD1 3.84Å; L330-I334 HydrophobicContact CD1-CG1 4Å; L330-I334 HydrophobicContact CD2-CD1 4.45Å; L330-I334 HydrophobicContact CG-CD1 3.75Å; L330-I334 HydrophobicContact CG-CG1 4.33Å; L330-I334 VanDerWaalsContact O-CG1 3.31Å; L330-I334 WeakPolarHBondContact O-CG1 3.49Å; L330-I334 PolarHBondContact O-N 3.22Å
331	A	68.4	Low	68.9	Low	50 Å²	50	95.3 Å²	95.3	41%	0.413	50%	0.498	S	S	.	.	H	α-helix	trans	-64.8	-49.2	-176.8	0	0	0	0	0	113.1	E329 N333 I334 F335	E329-A331 PolarHBondContact O-N 3.48Å; A331-N333 VanDerWaalsContact C-N 3.27Å; A331-N333 PolarHBondContact O-N 2.94Å; A331-I334 PolarHBondContact O-N 2.94Å; A331-F335 WeakPolarHBondContact O-CD2 3.43Å; A331-F335 PolarHBondContact O-N 3.24Å
332	P	74.2	Confident	71.6	Confident	62 Å²	62	89.3 Å²	89.3	40%	0.403	47%	0.467	S	S	.	.	H	α-helix	trans	-57.2	-37.4	170.7	-26.5	34.8	0	0	0	113.7	R328 E329 F335 K336	R328-P332 WeakPolarHBondContact O-CD 3.27Å; E329-P332 WeakPolarHBondContact O-CD 3.47Å; P332-F335 PolarHBondContact O-N 3.36Å; P332-K336 VanDerWaalsContact O-CG 3.28Å; P332-K336 WeakPolarHBondContact O-CG 3.29Å; P332-K336 PolarHBondContact O-N 2.97Å
333	N	78.1	Confident	74.1	Confident	71 Å²	71	84.6 Å²	84.6	38%	0.38	43%	0.434	S	S	.	.	H	α-helix	trans	-72.9	-36.5	-179.6	-69.6	-17.5	0	0	0	112	E329 L330 A331 F335 K336 S337	E329-N333 VanDerWaalsContact O-CB 3.28Å; E329-N333 WeakPolarHBondContact O-CB 3.29Å; E329-N333 PolarHBondContact O-N 2.94Å; E329-N333 PolarHBondContact O-ND2 3.34Å; L330-N333 PolarHBondContact O-N 3.47Å; A331-N333 VanDerWaalsContact C-N 3.27Å; A331-N333 PolarHBondContact O-N 2.94Å; N333-F335 PolarHBondContact O-N 3.19Å; N333-K336 PolarHBondContact O-N 3.22Å; N333-S337 WeakPolarHBondContact O-CB 3.29Å; N333-S337 PolarHBondContact O-N 3.22Å; N333-S337 PolarHBondContact O-OG 3.38Å
334	I	80.5	Confident	76.2	Confident	78 Å²	78	80.8 Å²	80.8	40%	0.4	41%	0.413	S	S	.	.	H	α-helix	trans	-56.9	-50.1	170.1	-73.3	166.3	0	0	0	110.4	L330 A331 K336 S337 M338	L330-I334 HydrophobicContact CD1-CD1 3.84Å; L330-I334 HydrophobicContact CD1-CG1 4Å; L330-I334 HydrophobicContact CD2-CD1 4.45Å; L330-I334 HydrophobicContact CG-CD1 3.75Å; L330-I334 HydrophobicContact CG-CG1 4.33Å; L330-I334 VanDerWaalsContact O-CG1 3.31Å; L330-I334 WeakPolarHBondContact O-CG1 3.49Å; L330-I334 PolarHBondContact O-N 3.22Å; A331-I334 PolarHBondContact O-N 2.94Å; I334-K336 VanDerWaalsContact C-N 3.3Å; I334-K336 PolarHBondContact O-N 2.99Å; I334-S337 PolarHBondContact O-N 3.16Å; I334-M338 HydrophobicContact CG2-CE 3.91Å; I334-M338 HydrophobicContact CG2-SD 4.26Å; I334-M338 WeakPolarHBondContact O-CG 3.26Å; I334-M338 PolarHBondContact O-N 2.73Å; I334-M338 VanDerWaalsContact O-N 3.08Å
335	F	78.1	Confident	78.3	Confident	60 Å²	60	73.8 Å²	73.8	26%	0.263	38%	0.38	S	S	.	.	H	α-helix	trans	-64.4	-31.3	179.1	-71.8	-62.3	0	0	0	113.5	A331 P332 N333 M338 I342 T357	A331-F335 WeakPolarHBondContact O-CD2 3.43Å; A331-F335 PolarHBondContact O-N 3.24Å; P332-F335 PolarHBondContact O-N 3.36Å; N333-F335 PolarHBondContact O-N 3.19Å; F335-M338 HydrophobicContact CD1-CE 3.45Å; F335-M338 VanDerWaalsContact CD1-CE 3.45Å; F335-M338 HydrophobicContact CE1-CE 3.86Å; F335-M338 HydrophobicContact CG-CE 4.31Å; F335-I342 HydrophobicContact CE1-CD1 4.31Å; F335-T357 HydrophobicContact CB-CG2 4.09Å
336	K	76.3	Confident	80.1	Confident	164 Å²	164	69.2 Å²	69.2	71%	0.713	35%	0.353	S	S	*	.	H	α-helix	trans	-77.6	-26	174.2	-70.3	168.7	-175.2	173.9	0	113.9	P332 N333 I334	P332-K336 VanDerWaalsContact O-CG 3.28Å; P332-K336 WeakPolarHBondContact O-CG 3.29Å; P332-K336 PolarHBondContact O-N 2.97Å; N333-K336 PolarHBondContact O-N 3.22Å; I334-K336 VanDerWaalsContact C-N 3.3Å; I334-K336 PolarHBondContact O-N 2.99Å
337	S	82.4	Confident	81.7	Confident	105 Å²	105	70.3 Å²	70.3	73%	0.734	36%	0.36	S	S	*	.	H	α-helix	trans	-86.4	-14.7	178.1	-63.3	0	0	0	0	113.6	N333 I334	N333-S337 WeakPolarHBondContact O-CB 3.29Å; N333-S337 PolarHBondContact O-N 3.22Å; N333-S337 PolarHBondContact O-OG 3.38Å; I334-S337 PolarHBondContact O-N 3.16Å
338	M	82.3	Confident	83.2	Confident	44 Å²	44	70.3 Å²	70.3	22%	0.217	36%	0.359	C	S	.	.			trans	-89.1	120.4	172.6	-71.8	-173	-55.9	0	0	110.8	I334 F335 G340 I342 F462	I334-M338 HydrophobicContact CG2-CE 3.91Å; I334-M338 HydrophobicContact CG2-SD 4.26Å; I334-M338 WeakPolarHBondContact O-CG 3.26Å; I334-M338 PolarHBondContact O-N 2.73Å; I334-M338 VanDerWaalsContact O-N 3.08Å; F335-M338 HydrophobicContact CD1-CE 3.45Å; F335-M338 VanDerWaalsContact CD1-CE 3.45Å; F335-M338 HydrophobicContact CE1-CE 3.86Å; F335-M338 HydrophobicContact CG-CE 4.31Å; M338-G340 PolarHBondContact O-N 2.9Å; M338-I342 HydrophobicContact CE-CD1 3.74Å; M338-I342 HydrophobicContact CE-CG1 3.97Å; M338-I342 HydrophobicContact SD-CD1 3.96Å; M338-I342 HydrophobicContact SD-CG1 4.18Å; M338-F462 HydrophobicContact CB-CE2 3.84Å; M338-F462 HydrophobicContact CB-CZ 4.24Å; M338-F462 HydrophobicContact CG-CE2 4.09Å; M338-F462 HydrophobicContact SD-CD2 3.82Å; M338-F462 HydrophobicContact SD-CE2 3.76Å
339	D	84.1	Confident	84.8	Confident	132 Å²	132	60.5 Å²	60.5	71%	0.706	33%	0.325	S	S	*	.	S	Bend	trans	-77.8	62.5	168.7	-167.2	10.8	0	0	0	110.6	Y464	D339-Y464 WeakPolarHBondContact O-CB 3.4Å
340	G	92	Very high	86.2	Confident	6 Å²	6	59 Å²	59	6%	0.062	31%	0.314	C	S	.	.	S	Bend	trans	171.3	-164.7	-171.3	0	0	0	0	0	115.1	M338 T357 A463	M338-G340 PolarHBondContact O-N 2.9Å; G340-T357 VanDerWaalsContact O-CB 3.29Å; G340-T357 WeakPolarHBondContact O-CB 3.24Å; G340-T357 PolarHBondContact O-OG1 3.33Å; G340-A463 CarbonylContact C-O 3.49Å; G340-A463 WeakPolarHBondContact CA-O 3.44Å
341	F	94.7	Very high	87.4	Confident	3 Å²	3	54.6 Å²	54.6	1%	0.013	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	152.5	-178.7	65.7	-92.3	0	0	0	112.5	F343 I354 S355 T357 A358 L361 L362 I435 F462 A463	F341-F343 HydrophobicContact CD2-CD1 4.12Å; F341-F343 AromaticContact CE2-CD1 3.7Å; F341-F343 HydrophobicContact CE2-CD1 3.7Å; F341-F343 HydrophobicContact CE2-CE1 4.37Å; F341-F343 HydrophobicContact CE2-CG 4.47Å; F341-I354 HydrophobicContact CD2-CD1 3.84Å; F341-I354 HydrophobicContact CD2-CG1 3.84Å; F341-I354 HydrophobicContact CE2-CD1 3.79Å; F341-I354 HydrophobicContact CE2-CG1 4.27Å; F341-S355 VanDerWaalsContact CA-OG 3.32Å; F341-S355 WeakPolarHBondContact CA-OG 3.12Å; F341-S355 WeakPolarHBondContact CB-OG 3.37Å; F341-T357 WeakPolarHBondContact CA-OG1 3.39Å; F341-T357 WeakPolarHBondContact CB-OG1 3.33Å; F341-A358 HydrophobicContact CB-CB 3.93Å; F341-A358 HydrophobicContact CD1-CB 4.09Å; F341-A358 HydrophobicContact CD2-CB 4.03Å; F341-A358 HydrophobicContact CG-CB 3.78Å; F341-L361 HydrophobicContact CD1-CB 4.46Å; F341-L361 HydrophobicContact CD1-CD2 3.91Å; F341-L361 HydrophobicContact CE1-CD2 4Å; F341-L362 HydrophobicContact CE1-CD1 3.69Å; F341-L362 HydrophobicContact CE1-CG 4.28Å; F341-L362 HydrophobicContact CZ-CD1 3.75Å; F341-I435 HydrophobicContact CE1-CG2 4.31Å; F341-I435 HydrophobicContact CZ-CG2 4.3Å; F341-F462 CarbonylContact O-C 3.47Å; F341-F462 WeakPolarHBondContact O-CD2 3.28Å; F341-A463 HydrophobicContact CD1-CB 4.15Å; F341-A463 HydrophobicContact CD2-CB 3.98Å; F341-A463 HydrophobicContact CE1-CB 3.81Å; F341-A463 HydrophobicContact CE2-CB 3.63Å; F341-A463 HydrophobicContact CG-CB 4.24Å; F341-A463 HydrophobicContact CZ-CB 3.53Å; F341-A463 PolarHBondContact N-O 3.3Å; F341-A463 PolarHBondContact O-N 3.39Å
342	I	94.9	Very high	88.7	Confident	46 Å²	46	52.4 Å²	52.4	24%	0.236	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	139.8	173.1	-65.3	177.1	0	0	0	108.3	F335 M338 Y353 I354 S355 S461 F462	F335-I342 HydrophobicContact CE1-CD1 4.31Å; M338-I342 HydrophobicContact CE-CD1 3.74Å; M338-I342 HydrophobicContact CE-CG1 3.97Å; M338-I342 HydrophobicContact SD-CD1 3.96Å; M338-I342 HydrophobicContact SD-CG1 4.18Å; I342-Y353 HydrophobicContact CG2-CE1 4.42Å; I342-I354 CarbonylContact O-C 3.53Å; I342-I354 VanDerWaalsContact O-CA 3.32Å; I342-I354 WeakPolarHBondContact O-CA 3.34Å; I342-S355 PolarHBondContact N-OG 3.43Å; I342-S355 PolarHBondContact O-N 3.06Å; I342-S461 CarbonylContact C-O 3.6Å; I342-S461 WeakPolarHBondContact CA-O 3.24Å; I342-F462 HydrophobicContact CG1-CD2 4.11Å
343	F	96.2	Very high	89.8	Confident	2 Å²	2	52.3 Å²	52.3	1%	0.009	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	157.4	170.7	69.3	-91	0	0	0	112.3	F341 V345 Y353 I354 F412 C437 L459 S461 A463	F341-F343 HydrophobicContact CD2-CD1 4.12Å; F341-F343 AromaticContact CE2-CD1 3.7Å; F341-F343 HydrophobicContact CE2-CD1 3.7Å; F341-F343 HydrophobicContact CE2-CE1 4.37Å; F341-F343 HydrophobicContact CE2-CG 4.47Å; F343-V345 HydrophobicContact CD2-CB 4.46Å; F343-V345 HydrophobicContact CD2-CG2 3.78Å; F343-V345 HydrophobicContact CE2-CG2 4.07Å; F343-Y353 CarbonylContact C-O 3.56Å; F343-Y353 VanDerWaalsContact CA-O 3.28Å; F343-Y353 WeakPolarHBondContact CA-O 3.27Å; F343-I354 HydrophobicContact CB-CB 4.33Å; F343-I354 HydrophobicContact CB-CG1 4.13Å; F343-F412 HydrophobicContact CZ-CZ 4.14Å; F343-C437 HydrophobicContact CE1-CB 4.42Å; F343-C437 HydrophobicContact CZ-CB 4.4Å; F343-L459 HydrophobicContact CE2-CD2 4.31Å; F343-S461 VanDerWaalsContact CZ-CB 3.44Å; F343-S461 PolarHBondContact N-O 2.99Å; F343-S461 PolarHBondContact O-N 2.9Å; F343-A463 HydrophobicContact CD1-CB 4.02Å; F343-A463 HydrophobicContact CE1-CB 3.76Å
344	I	96.2	Very high	90.6	Very high	4 Å²	4	49 Å²	49	2%	0.021	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	122.6	174.7	-52.6	179	0	0	0	107.6	F307 F311 L352 Y353 L459 I460	F307-I344 HydrophobicContact CE2-CD1 3.89Å; F307-I344 HydrophobicContact CZ-CD1 4.29Å; F311-I344 HydrophobicContact CE1-CD1 3.99Å; F311-I344 HydrophobicContact CZ-CD1 3.89Å; I344-L352 HydrophobicContact CG2-CB 4.41Å; I344-L352 PolarHBondContact O-N 2.92Å; I344-Y353 HydrophobicContact CD1-CD1 4.4Å; I344-Y353 HydrophobicContact CG1-CD1 4.3Å; I344-Y353 PolarHBondContact N-O 3.41Å; I344-Y353 PolarHBondContact O-N 2.82Å; I344-L459 CarbonylContact C-O 3.54Å; I344-L459 VanDerWaalsContact CA-O 3.27Å; I344-L459 WeakPolarHBondContact CA-O 3.45Å; I344-I460 HydrophobicContact CG1-CG1 4.39Å; I344-I460 HydrophobicContact CG1-CG2 4.38Å; I344-I460 HydrophobicContact CG2-CG1 4.25Å
345	V	96.4	Very high	91.2	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	135.6	-179.1	162.3	0	0	0	0	110	F343 R350 I351 M374 L390 G458 L459	F343-V345 HydrophobicContact CD2-CB 4.46Å; F343-V345 HydrophobicContact CD2-CG2 3.78Å; F343-V345 HydrophobicContact CE2-CG2 4.07Å; V345-R350 CarbonylContact C-O 3.58Å; V345-R350 WeakPolarHBondContact CA-O 3.38Å; V345-I351 HydrophobicContact CG2-CG1 4.14Å; V345-M374 HydrophobicContact CG2-CB 4.28Å; V345-M374 HydrophobicContact CG2-CG 4.37Å; V345-M374 HydrophobicContact CG2-SD 4.18Å; V345-L390 HydrophobicContact CG1-CD1 3.98Å; V345-L390 HydrophobicContact CG1-CD2 4.01Å; V345-G458 CarbonylContact O-C 3.57Å; V345-G458 VanDerWaalsContact O-CA 3.24Å; V345-G458 WeakPolarHBondContact O-CA 3.42Å; V345-L459 PolarHBondContact N-O 3.35Å; V345-L459 PolarHBondContact O-N 2.94Å
346	S	93.2	Very high	91.9	Very high	9 Å²	9	48 Å²	48	6%	0.063	24%	0.241	C	C	.	.			trans	-76.8	167.4	178.8	71.3	0	0	0	0	112.8	E348 G349 R350	S346-E348 PolarHBondContact O-N 2.99Å; S346-E348 VanDerWaalsContact O-N 3.14Å; S346-E348 WeakPolarHBondContact OG-CB 3.36Å; S346-E348 PolarHBondContact OG-N 3.49Å; S346-G349 PolarHBondContact O-N 3.37Å; S346-R350 PolarHBondContact N-O 3.47Å; S346-R350 PolarHBondContact OG-N 3.11Å; S346-R350 PolarHBondContact OG-O 2.83Å
347	L	90.2	Very high	92.7	Very high	117 Å²	117	41.5 Å²	41.5	61%	0.613	22%	0.216	S	C	*	.	T	Hydrogen-bonded Turn	trans	-45.2	-35.3	163.1	161.5	65.5	0	0	0	113.4	G349	L347-G349 PolarHBondContact O-N 3.25Å
348	E	90.5	Very high	93.3	Very high	104 Å²	104	36.6 Å²	36.6	49%	0.486	18%	0.181	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.5	-0.2	179.3	-58.8	158.5	-147.8	0	0	113.1	K302 S346 R350	K302-E348 IonicContact NZ-OE1 2.64Å; K302-E348 PolarHBondContact NZ-OE1 2.96Å; K302-E348 IonicContact NZ-OE2 3.49Å; K302-E348 PolarHBondContact NZ-OE2 2.83Å; S346-E348 PolarHBondContact O-N 2.99Å; S346-E348 VanDerWaalsContact O-N 3.14Å; S346-E348 WeakPolarHBondContact OG-CB 3.36Å; S346-E348 PolarHBondContact OG-N 3.49Å; E348-R350 HydrophobicContact CB-CG 4.19Å; E348-R350 PolarHBondContact O-N 2.68Å; E348-R350 WeakPolarHBondContact OE2-CD 3.43Å; E348-R350 IonicContact OE2-NE 2.8Å; E348-R350 PolarHBondContact OE2-NE 2.84Å
349	G	94	Very high	93.8	Very high	8 Å²	8	37 Å²	37	8%	0.082	19%	0.189	C	C	.	.	S	Bend	trans	74.9	4.8	-171	0	0	0	0	0	114.4	S346 L347 M374	S346-G349 PolarHBondContact O-N 3.37Å; L347-G349 PolarHBondContact O-N 3.25Å; G349-M374 VanDerWaalsContact O-CB 3.27Å; G349-M374 WeakPolarHBondContact O-CB 3.39Å; G349-M374 PolarHBondContact O-N 3.27Å
350	R	96.1	Very high	94.1	Very high	82 Å²	82	36.1 Å²	36.1	31%	0.309	19%	0.188	S	C	.	.	B	Isolated β-bridge	trans	-80	136.2	179.5	-62.8	-172.3	-167.7	-67.5	-21.7	112.3	V345 S346 E348 L352 N372 E373	V345-R350 CarbonylContact C-O 3.58Å; V345-R350 WeakPolarHBondContact CA-O 3.38Å; S346-R350 PolarHBondContact N-O 3.47Å; S346-R350 PolarHBondContact OG-N 3.11Å; S346-R350 PolarHBondContact OG-O 2.83Å; E348-R350 HydrophobicContact CB-CG 4.19Å; E348-R350 PolarHBondContact O-N 2.68Å; E348-R350 WeakPolarHBondContact OE2-CD 3.43Å; E348-R350 IonicContact OE2-NE 2.8Å; E348-R350 PolarHBondContact OE2-NE 2.84Å; R350-L352 PolarHBondContact O-N 3.27Å; R350-N372 CarbonylContact C-O 3.58Å; R350-N372 VanDerWaalsContact CA-O 3.29Å; R350-N372 WeakPolarHBondContact CA-O 3.47Å; R350-E373 HydrophobicContact CG-CG 3.91Å; R350-E373 IonicContact CZ-OE1 2.67Å; R350-E373 IonicContact NH1-OE1 3.26Å; R350-E373 PolarHBondContact NH1-OE1 3Å; R350-E373 IonicContact NH2-OE1 3.07Å; R350-E373 PolarHBondContact NH2-OE1 2.84Å
351	I	97.7	Very high	94.1	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.4	108.9	173.5	-57.3	173.6	0	0	0	108.1	V345 Y353 I354 M369 G371 N372 M374 Y377	V345-I351 HydrophobicContact CG2-CG1 4.14Å; I351-Y353 WeakPolarHBondContact CG2-O 3.25Å; I351-I354 HydrophobicContact CG2-CB 4.14Å; I351-I354 HydrophobicContact CG2-CG2 4.37Å; I351-M369 HydrophobicContact CD1-CB 3.99Å; I351-M369 HydrophobicContact CD1-CE 3.92Å; I351-G371 VanDerWaalsContact O-CA 3.26Å; I351-G371 WeakPolarHBondContact O-CA 3.37Å; I351-G371 PolarHBondContact O-N 3.24Å; I351-N372 PolarHBondContact N-O 2.91Å; I351-M374 HydrophobicContact CD1-SD 3.67Å; I351-M374 HydrophobicContact CG1-CB 4.09Å; I351-M374 HydrophobicContact CG1-SD 3.72Å; I351-Y377 HydrophobicContact CD1-CD2 3.99Å; I351-Y377 HydrophobicContact CD1-CE2 4.23Å
352	L	95.9	Very high	94.1	Very high	4 Å²	4	36.6 Å²	36.6	2%	0.021	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	-34.1	175.6	-58.6	-174.6	0	0	0	111.8	K302 I303 I306 I344 R350	K302-L352 HydrophobicContact CB-CD1 4.1Å; K302-L352 HydrophobicContact CB-CD2 3.79Å; K302-L352 HydrophobicContact CD-CD2 3.74Å; K302-L352 HydrophobicContact CG-CD2 4.39Å; I303-L352 WeakPolarHBondContact CD1-O 3.37Å; I303-L352 HydrophobicContact CG1-CB 4.11Å; I306-L352 HydrophobicContact CD1-CD1 3.33Å; I344-L352 HydrophobicContact CG2-CB 4.41Å; I344-L352 PolarHBondContact O-N 2.92Å; R350-L352 PolarHBondContact O-N 3.27Å
353	Y	95.4	Very high	94.1	Very high	59 Å²	59	35.8 Å²	35.8	23%	0.231	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.7	147.6	175.8	175.9	-99.7	0	0	0	109.9	I303 I342 F343 I344 I351	I303-Y353 HydrophobicContact CD1-CD2 4.44Å; I342-Y353 HydrophobicContact CG2-CE1 4.42Å; F343-Y353 CarbonylContact C-O 3.56Å; F343-Y353 VanDerWaalsContact CA-O 3.28Å; F343-Y353 WeakPolarHBondContact CA-O 3.27Å; I344-Y353 HydrophobicContact CD1-CD1 4.4Å; I344-Y353 HydrophobicContact CG1-CD1 4.3Å; I344-Y353 PolarHBondContact N-O 3.41Å; I344-Y353 PolarHBondContact O-N 2.82Å; I351-Y353 WeakPolarHBondContact CG2-O 3.25Å
354	I	95.8	Very high	94.1	Very high	1 Å²	1	35.8 Å²	35.8	1%	0.005	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	145.9	162.2	-169.4	166.6	0	0	0	108.4	F341 I342 F343 I351 A358 Q366 M369	F341-I354 HydrophobicContact CD2-CD1 3.84Å; F341-I354 HydrophobicContact CD2-CG1 3.84Å; F341-I354 HydrophobicContact CE2-CD1 3.79Å; F341-I354 HydrophobicContact CE2-CG1 4.27Å; I342-I354 CarbonylContact O-C 3.53Å; I342-I354 VanDerWaalsContact O-CA 3.32Å; I342-I354 WeakPolarHBondContact O-CA 3.34Å; F343-I354 HydrophobicContact CB-CB 4.33Å; F343-I354 HydrophobicContact CB-CG1 4.13Å; I351-I354 HydrophobicContact CG2-CB 4.14Å; I351-I354 HydrophobicContact CG2-CG2 4.37Å; I354-A358 HydrophobicContact CD1-CB 3.54Å; I354-A358 HydrophobicContact CG1-CB 3.78Å; I354-Q366 HydrophobicContact CG2-CB 4.12Å; I354-Q366 HydrophobicContact CG2-CG 3.93Å; I354-Q366 WeakPolarHBondContact O-CG 3.23Å; I354-Q366 PolarHBondContact O-NE2 3.17Å; I354-M369 HydrophobicContact CD1-CE 3.81Å; I354-M369 HydrophobicContact CD1-SD 3.81Å; I354-M369 HydrophobicContact CG2-CB 4.29Å
355	S	94.1	Very high	94.1	Very high	1 Å²	1	38 Å²	38	1%	0.007	21%	0.208	C	C	.	.			trans	-78.7	149.6	176.5	61.7	0	0	0	0	112	F341 I342 T357 A358	F341-S355 VanDerWaalsContact CA-OG 3.32Å; F341-S355 WeakPolarHBondContact CA-OG 3.12Å; F341-S355 WeakPolarHBondContact CB-OG 3.37Å; I342-S355 PolarHBondContact N-OG 3.43Å; I342-S355 PolarHBondContact O-N 3.06Å; S355-T357 PolarHBondContact O-N 2.62Å; S355-T357 PolarHBondContact OG-OG1 3.34Å; S355-A358 WeakPolarHBondContact O-CB 3.48Å; S355-A358 PolarHBondContact O-N 3.11Å
356	E	92.2	Very high	94	Very high	116 Å²	116	39.3 Å²	39.3	54%	0.542	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55	-28.7	-179.6	-62.8	178.1	157.2	0	0	112.8	A358 S359	E356-A358 PolarHBondContact O-N 3.02Å; E356-A358 VanDerWaalsContact O-N 3.09Å; E356-S359 WeakPolarHBondContact O-CB 3.13Å; E356-S359 PolarHBondContact O-N 3.29Å; E356-S359 PolarHBondContact O-OG 3.01Å
357	T	92.5	Very high	94.2	Very high	29 Å²	29	39.9 Å²	39.9	18%	0.178	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.2	-17.8	176.7	57.5	0	0	0	0	114.4	F335 G340 F341 S355 S359 V360 L361	F335-T357 HydrophobicContact CB-CG2 4.09Å; G340-T357 VanDerWaalsContact O-CB 3.29Å; G340-T357 WeakPolarHBondContact O-CB 3.24Å; G340-T357 PolarHBondContact O-OG1 3.33Å; F341-T357 WeakPolarHBondContact CA-OG1 3.39Å; F341-T357 WeakPolarHBondContact CB-OG1 3.33Å; S355-T357 PolarHBondContact O-N 2.62Å; S355-T357 PolarHBondContact OG-OG1 3.34Å; T357-S359 PolarHBondContact O-N 2.9Å; T357-V360 WeakPolarHBondContact O-CB 3.45Å; T357-V360 PolarHBondContact O-N 3.35Å; T357-L361 PolarHBondContact O-N 3.38Å
358	A	94.4	Very high	94.4	Very high	1 Å²	1	38.4 Å²	38.4	1%	0.008	21%	0.207	C	C	.	.	H	α-helix	trans	-58.2	-31.8	170.6	0	0	0	0	0	112.3	F341 I354 S355 E356 V360 L361 L362	F341-A358 HydrophobicContact CB-CB 3.93Å; F341-A358 HydrophobicContact CD1-CB 4.09Å; F341-A358 HydrophobicContact CD2-CB 4.03Å; F341-A358 HydrophobicContact CG-CB 3.78Å; I354-A358 HydrophobicContact CD1-CB 3.54Å; I354-A358 HydrophobicContact CG1-CB 3.78Å; S355-A358 WeakPolarHBondContact O-CB 3.48Å; S355-A358 PolarHBondContact O-N 3.11Å; E356-A358 PolarHBondContact O-N 3.02Å; E356-A358 VanDerWaalsContact O-N 3.09Å; A358-V360 VanDerWaalsContact C-N 3.3Å; A358-V360 PolarHBondContact O-N 3.36Å; A358-L361 PolarHBondContact O-N 3.46Å; A358-L362 WeakPolarHBondContact O-CB 3.49Å; A358-L362 PolarHBondContact O-N 3.21Å
359	S	93.9	Very high	94.7	Very high	53 Å²	53	33.5 Å²	33.5	37%	0.371	19%	0.185	S	C	.	.	H	α-helix	trans	-64.2	-32.6	174.8	66.3	0	0	0	0	112.9	E356 T357 G363 L364	E356-S359 WeakPolarHBondContact O-CB 3.13Å; E356-S359 PolarHBondContact O-N 3.29Å; E356-S359 PolarHBondContact O-OG 3.01Å; T357-S359 PolarHBondContact O-N 2.9Å; S359-G363 WeakPolarHBondContact O-CA 3.46Å; S359-G363 PolarHBondContact O-N 3.44Å; S359-L364 VanDerWaalsContact CA-O 3.23Å; S359-L364 WeakPolarHBondContact CA-O 3.43Å; S359-L364 WeakPolarHBondContact CB-O 3.5Å; S359-L364 PolarHBondContact N-O 2.96Å
360	V	91	Very high	94.9	Very high	113 Å²	113	33.8 Å²	33.8	69%	0.685	18%	0.184	S	C	*	.	H	α-helix	trans	-71.2	-35.9	177.2	-175	0	0	0	0	111	T357 A358 L420	T357-V360 WeakPolarHBondContact O-CB 3.45Å; T357-V360 PolarHBondContact O-N 3.35Å; A358-V360 VanDerWaalsContact C-N 3.3Å; A358-V360 PolarHBondContact O-N 3.36Å; V360-L420 WeakPolarHBondContact O-CD1 3.28Å
361	L	90.7	Very high	94.9	Very high	19 Å²	19	30.3 Å²	30.3	10%	0.099	17%	0.174	C	C	.	.	H	α-helix	trans	-92.8	-27.6	-173.2	-160.1	67.2	0	0	0	114.4	F341 T357 A358 L420 K433 I435 A465	F341-L361 HydrophobicContact CD1-CB 4.46Å; F341-L361 HydrophobicContact CD1-CD2 3.91Å; F341-L361 HydrophobicContact CE1-CD2 4Å; T357-L361 PolarHBondContact O-N 3.38Å; A358-L361 PolarHBondContact O-N 3.46Å; L361-L420 WeakPolarHBondContact O-CD1 3.34Å; L361-K433 PolarHBondContact O-NZ 3.14Å; L361-I435 HydrophobicContact CD2-CD1 3.91Å; L361-I435 HydrophobicContact CG-CD1 4.42Å; L361-A465 HydrophobicContact CD1-CB 3.79Å; L361-A465 HydrophobicContact CD2-CB 4.11Å; L361-A465 HydrophobicContact CG-CB 4.2Å
362	L	94.8	Very high	94.9	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-127.4	-16.1	-174	-62.4	171.4	0	0	0	114.1	F341 A358 L364 V416 C418 V419 K433 I435	F341-L362 HydrophobicContact CE1-CD1 3.69Å; F341-L362 HydrophobicContact CE1-CG 4.28Å; F341-L362 HydrophobicContact CZ-CD1 3.75Å; A358-L362 WeakPolarHBondContact O-CB 3.49Å; A358-L362 PolarHBondContact O-N 3.21Å; L362-L364 HydrophobicContact CB-CD1 4.35Å; L362-L364 HydrophobicContact CB-CG 4.23Å; L362-L364 HydrophobicContact CD1-CD1 4.48Å; L362-L364 PolarHBondContact O-N 3.23Å; L362-V416 HydrophobicContact CD1-CB 4.19Å; L362-V416 HydrophobicContact CD1-CG1 3.62Å; L362-V416 HydrophobicContact CD2-CB 4.08Å; L362-V416 HydrophobicContact CD2-CG1 4.25Å; L362-C418 HydrophobicContact CD2-CB 4.4Å; L362-C418 CarbonylContact O-C 3.56Å; L362-C418 WeakPolarHBondContact O-CA 3.44Å; L362-V419 PolarHBondContact O-N 2.85Å; L362-K433 HydrophobicContact CD2-CB 4.24Å; L362-K433 HydrophobicContact CD2-CD 4.3Å; L362-I435 HydrophobicContact CD2-CD1 4.07Å; L362-I435 HydrophobicContact CD2-CG1 4.19Å
363	G	95.3	Very high	95	Very high	30 Å²	30	34.8 Å²	34.8	31%	0.309	20%	0.196	S	C	.	.			trans	78.2	-2.2	-175.1	0	0	0	0	0	115	S359 V419	S359-G363 WeakPolarHBondContact O-CA 3.46Å; S359-G363 PolarHBondContact O-N 3.44Å; G363-V419 VanDerWaalsContact O-CG2 3.27Å; G363-V419 WeakPolarHBondContact O-CG2 3.37Å
364	L	96.2	Very high	95.1	Very high	1 Å²	1	32.1 Å²	32.1	1%	0.005	19%	0.185	C	C	.	.			trans	-84.8	145.4	-178.6	-60.1	175	0	0	0	111.7	S359 L362 M369 Y377 K417 V419	S359-L364 VanDerWaalsContact CA-O 3.23Å; S359-L364 WeakPolarHBondContact CA-O 3.43Å; S359-L364 WeakPolarHBondContact CB-O 3.5Å; S359-L364 PolarHBondContact N-O 2.96Å; L362-L364 HydrophobicContact CB-CD1 4.35Å; L362-L364 HydrophobicContact CB-CG 4.23Å; L362-L364 HydrophobicContact CD1-CD1 4.48Å; L362-L364 PolarHBondContact O-N 3.23Å; L364-M369 HydrophobicContact CB-CG 4.18Å; L364-M369 HydrophobicContact CB-SD 3.47Å; L364-M369 WeakPolarHBondContact CB-SD 3.28Å; L364-M369 HydrophobicContact CD1-CE 3.82Å; L364-M369 HydrophobicContact CD1-SD 3.76Å; L364-M369 HydrophobicContact CG-SD 4.28Å; L364-Y377 HydrophobicContact CD1-CD1 3.72Å; L364-Y377 HydrophobicContact CD1-CE1 4.44Å; L364-Y377 HydrophobicContact CD1-CG 4.4Å; L364-Y377 HydrophobicContact CD2-CD1 4.42Å; L364-K417 HydrophobicContact CD1-CB 4.5Å; L364-K417 WeakPolarHBondContact CD1-O 3.24Å; L364-V419 HydrophobicContact CD2-CG1 4.03Å; L364-V419 HydrophobicContact CD2-CG2 3.94Å
365	S	95.4	Very high	95.2	Very high	51 Å²	51	33.7 Å²	33.7	36%	0.357	20%	0.195	S	C	.	.			trans	-85.1	135.2	-179.7	175.7	0	0	0	0	112.5	V367 E368 M369	S365-V367 PolarHBondContact O-N 3.21Å; S365-V367 PolarHBondContact OG-N 2.88Å; S365-E368 WeakPolarHBondContact O-CB 3.47Å; S365-E368 PolarHBondContact O-N 3.2Å; S365-M369 WeakPolarHBondContact O-CG 3.5Å; S365-M369 PolarHBondContact O-N 2.9Å
366	Q	95.7	Very high	95.3	Very high	28 Å²	28	38.6 Å²	38.6	13%	0.131	22%	0.218	C	C	.	.	H	α-helix	trans	-52.3	-41.9	170.5	173.4	-169.3	66.8	0	0	111.8	I354 E368 M369 T370	I354-Q366 HydrophobicContact CG2-CB 4.12Å; I354-Q366 HydrophobicContact CG2-CG 3.93Å; I354-Q366 WeakPolarHBondContact O-CG 3.23Å; I354-Q366 PolarHBondContact O-NE2 3.17Å; Q366-E368 VanDerWaalsContact C-N 3.34Å; Q366-M369 PolarHBondContact O-N 3.31Å; Q366-T370 VanDerWaalsContact O-CB 3.25Å; Q366-T370 WeakPolarHBondContact O-CB 3.46Å; Q366-T370 PolarHBondContact O-N 3.5Å; Q366-T370 PolarHBondContact O-OG1 3.11Å
367	V	95.9	Very high	95.6	Very high	21 Å²	21	33.5 Å²	33.5	13%	0.127	19%	0.194	C	C	.	.	H	α-helix	trans	-69.5	-34.4	-176	-179.3	0	0	0	0	111.5	L280 I284 L288 R295 L296 S365	L280-V367 HydrophobicContact CD1-CG2 4.42Å; I284-V367 HydrophobicContact CG2-CG2 3.87Å; L288-V367 HydrophobicContact CD2-CG1 3.43Å; L288-V367 VanDerWaalsContact CD2-CG1 3.43Å; R295-V367 PolarHBondContact NH2-O 3.11Å; L296-V367 HydrophobicContact CD1-CG1 4.1Å; S365-V367 PolarHBondContact O-N 3.21Å; S365-V367 PolarHBondContact OG-N 2.88Å
368	E	95.1	Very high	95.8	Very high	86 Å²	86	32.4 Å²	32.4	40%	0.402	19%	0.187	S	C	.	.	H	α-helix	trans	-70.5	-50.1	174.9	-175.8	-163.6	153.6	0	0	110.9	R295 S365 Q366 N372 Y377	R295-E368 PolarHBondContact NH2-O 2.89Å; R295-E368 VanDerWaalsContact NH2-O 3.11Å; S365-E368 WeakPolarHBondContact O-CB 3.47Å; S365-E368 PolarHBondContact O-N 3.2Å; Q366-E368 VanDerWaalsContact C-N 3.34Å; E368-N372 PolarHBondContact O-ND2 3.21Å; E368-Y377 PolarHBondContact O-OH 3.49Å
369	M	97.4	Very high	96	Very high	1 Å²	1	34 Å²	34	1%	0.005	19%	0.194	C	C	.	.	H	α-helix	trans	-73.6	-34.3	-174.2	-65.1	179.4	81.5	0	0	113.9	I351 I354 L364 S365 Q366 G371 N372 Y377	I351-M369 HydrophobicContact CD1-CB 3.99Å; I351-M369 HydrophobicContact CD1-CE 3.92Å; I354-M369 HydrophobicContact CD1-CE 3.81Å; I354-M369 HydrophobicContact CD1-SD 3.81Å; I354-M369 HydrophobicContact CG2-CB 4.29Å; L364-M369 HydrophobicContact CB-CG 4.18Å; L364-M369 HydrophobicContact CB-SD 3.47Å; L364-M369 WeakPolarHBondContact CB-SD 3.28Å; L364-M369 HydrophobicContact CD1-CE 3.82Å; L364-M369 HydrophobicContact CD1-SD 3.76Å; L364-M369 HydrophobicContact CG-SD 4.28Å; S365-M369 WeakPolarHBondContact O-CG 3.5Å; S365-M369 PolarHBondContact O-N 2.9Å; Q366-M369 PolarHBondContact O-N 3.31Å; M369-G371 PolarHBondContact O-N 3.48Å; M369-G371 VanDerWaalsContact O-N 3.16Å; M369-N372 PolarHBondContact O-N 3.4Å; M369-Y377 HydrophobicContact CB-CE2 4.26Å; M369-Y377 HydrophobicContact CE-CD1 4.14Å; M369-Y377 HydrophobicContact CE-CD2 4.07Å; M369-Y377 HydrophobicContact CE-CG 3.83Å; M369-Y377 HydrophobicContact CG-CD1 4.19Å; M369-Y377 HydrophobicContact CG-CD2 4.45Å; M369-Y377 HydrophobicContact CG-CE1 3.8Å; M369-Y377 HydrophobicContact CG-CE2 4.08Å
370	T	97.8	Very high	96.1	Very high	13 Å²	13	35.7 Å²	35.7	8%	0.08	20%	0.204	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.9	117	-170.9	-61.1	0	0	0	0	111.7	R295 L296 Q366	R295-T370 VanDerWaalsContact CD-O 3.28Å; R295-T370 WeakPolarHBondContact CD-O 3.38Å; R295-T370 VanDerWaalsContact CG-O 3.31Å; R295-T370 WeakPolarHBondContact CG-O 3.31Å; R295-T370 PolarHBondContact NE-O 3.49Å; L296-T370 HydrophobicContact CD2-CG2 3.88Å; Q366-T370 VanDerWaalsContact O-CB 3.25Å; Q366-T370 WeakPolarHBondContact O-CB 3.46Å; Q366-T370 PolarHBondContact O-N 3.5Å; Q366-T370 PolarHBondContact O-OG1 3.11Å
371	G	96.7	Very high	96.4	Very high	9 Å²	9	35.3 Å²	35.3	9%	0.093	20%	0.197	C	C	.	.	T	Hydrogen-bonded Turn	trans	95.8	-9.4	178.6	0	0	0	0	0	115.5	S299 I351 M369	S299-G371 WeakPolarHBondContact OG-CA 3.39Å; I351-G371 VanDerWaalsContact O-CA 3.26Å; I351-G371 WeakPolarHBondContact O-CA 3.37Å; I351-G371 PolarHBondContact O-N 3.24Å; M369-G371 PolarHBondContact O-N 3.48Å; M369-G371 VanDerWaalsContact O-N 3.16Å
372	N	97.6	Very high	96.7	Very high	27 Å²	27	34.5 Å²	34.5	14%	0.144	19%	0.193	C	C	.	.	S	Bend	trans	-75.6	168.9	169.4	-77.7	3.5	0	0	0	110.7	R295 R350 I351 E368 M369 E376 Y377	R295-N372 WeakPolarHBondContact CD-OD1 3.32Å; R295-N372 PolarHBondContact NE-OD1 3.17Å; R295-N372 PolarHBondContact NH1-OD1 3.39Å; R350-N372 CarbonylContact C-O 3.58Å; R350-N372 VanDerWaalsContact CA-O 3.29Å; R350-N372 WeakPolarHBondContact CA-O 3.47Å; I351-N372 PolarHBondContact N-O 2.91Å; E368-N372 PolarHBondContact O-ND2 3.21Å; M369-N372 PolarHBondContact O-N 3.4Å; N372-E376 WeakPolarHBondContact CB-OE1 3.43Å; N372-E376 PolarHBondContact ND2-OE2 3.3Å; N372-Y377 HydrophobicContact CB-CE2 3.93Å; N372-Y377 PolarHBondContact ND2-OH 3.18Å
373	E	97.1	Very high	96.8	Very high	71 Å²	71	36.8 Å²	36.8	33%	0.332	20%	0.204	S	C	.	.	B	Isolated β-bridge	trans	-79.2	132.9	174.3	-71.7	165.8	-139.2	0	0	110.3	R350 T375 E376	R350-E373 HydrophobicContact CG-CG 3.91Å; R350-E373 IonicContact CZ-OE1 2.67Å; R350-E373 IonicContact NH1-OE1 3.26Å; R350-E373 PolarHBondContact NH1-OE1 3Å; R350-E373 IonicContact NH2-OE1 3.07Å; R350-E373 PolarHBondContact NH2-OE1 2.84Å; E373-T375 WeakPolarHBondContact CB-OG1 3.18Å; E373-T375 PolarHBondContact O-N 2.84Å; E373-T375 VanDerWaalsContact O-N 3.14Å; E373-E376 HydrophobicContact CB-CG 4.31Å; E373-E376 PolarHBondContact N-OE1 2.68Å; E373-E376 VanDerWaalsContact O-CB 3.29Å; E373-E376 WeakPolarHBondContact O-CB 3.43Å; E373-E376 WeakPolarHBondContact O-CG 3.39Å; E373-E376 PolarHBondContact O-N 3.28Å
374	M	97.3	Very high	96.9	Very high	3 Å²	3	39.9 Å²	39.9	2%	0.015	21%	0.213	C	C	.	.	G	3₁₀ helix	trans	-56.6	-34	-178.4	-174.3	73.5	-178.9	0	0	111.4	V345 G349 I351 E376 Y377 L378 L386	V345-M374 HydrophobicContact CG2-CB 4.28Å; V345-M374 HydrophobicContact CG2-CG 4.37Å; V345-M374 HydrophobicContact CG2-SD 4.18Å; G349-M374 VanDerWaalsContact O-CB 3.27Å; G349-M374 WeakPolarHBondContact O-CB 3.39Å; G349-M374 PolarHBondContact O-N 3.27Å; I351-M374 HydrophobicContact CD1-SD 3.67Å; I351-M374 HydrophobicContact CG1-CB 4.09Å; I351-M374 HydrophobicContact CG1-SD 3.72Å; M374-E376 PolarHBondContact O-N 2.77Å; M374-Y377 PolarHBondContact O-N 2.92Å; M374-L378 HydrophobicContact CE-CD2 4.15Å; M374-L378 HydrophobicContact CG-CD1 4.07Å; M374-L378 HydrophobicContact CG-CG 4.2Å; M374-L378 WeakPolarHBondContact O-CG 3.35Å; M374-L378 PolarHBondContact O-N 3.4Å; M374-L386 HydrophobicContact CB-CD2 3.86Å; M374-L386 HydrophobicContact CG-CD2 4.05Å
375	T	97.3	Very high	96.9	Very high	34 Å²	34	42.5 Å²	42.5	21%	0.209	23%	0.225	C	C	.	.	G	3₁₀ helix	trans	-55.1	-29.2	174.8	42	0	0	0	0	114.1	E373 Y377 L378 H383 L386	E373-T375 WeakPolarHBondContact CB-OG1 3.18Å; E373-T375 PolarHBondContact O-N 2.84Å; E373-T375 VanDerWaalsContact O-N 3.14Å; T375-Y377 PolarHBondContact O-N 2.84Å; T375-L378 PolarHBondContact O-N 2.84Å; T375-H383 HydrophobicContact CG2-CB 4.2Å; T375-H383 PolarHBondContact O-CE1 2.88Å; T375-H383 VanDerWaalsContact O-CE1 3.26Å; T375-H383 PolarHBondContact O-NE2 2.86Å; T375-L386 HydrophobicContact CG2-CD2 4.07Å
376	E	97.3	Very high	96.9	Very high	104 Å²	104	40.3 Å²	40.3	49%	0.486	21%	0.21	S	C	.	.	G	3₁₀ helix	trans	-61.7	-23.1	174.5	-61.7	172.6	-130.7	0	0	112.5	N372 E373 M374	N372-E376 WeakPolarHBondContact CB-OE1 3.43Å; N372-E376 PolarHBondContact ND2-OE2 3.3Å; E373-E376 HydrophobicContact CB-CG 4.31Å; E373-E376 PolarHBondContact N-OE1 2.68Å; E373-E376 VanDerWaalsContact O-CB 3.29Å; E373-E376 WeakPolarHBondContact O-CB 3.43Å; E373-E376 WeakPolarHBondContact O-CG 3.39Å; E373-E376 PolarHBondContact O-N 3.28Å; M374-E376 PolarHBondContact O-N 2.77Å
377	Y	97.9	Very high	96.9	Very high	9 Å²	9	44.6 Å²	44.6	4%	0.035	23%	0.228	C	C	.	.	G	3₁₀ helix	trans	-110.5	0.4	-178.1	-54.5	-80	0	0	0	113.3	I351 L364 E368 M369 N372 M374 T375 V416 K417	I351-Y377 HydrophobicContact CD1-CD2 3.99Å; I351-Y377 HydrophobicContact CD1-CE2 4.23Å; L364-Y377 HydrophobicContact CD1-CD1 3.72Å; L364-Y377 HydrophobicContact CD1-CE1 4.44Å; L364-Y377 HydrophobicContact CD1-CG 4.4Å; L364-Y377 HydrophobicContact CD2-CD1 4.42Å; E368-Y377 PolarHBondContact O-OH 3.49Å; M369-Y377 HydrophobicContact CB-CE2 4.26Å; M369-Y377 HydrophobicContact CE-CD1 4.14Å; M369-Y377 HydrophobicContact CE-CD2 4.07Å; M369-Y377 HydrophobicContact CE-CG 3.83Å; M369-Y377 HydrophobicContact CG-CD1 4.19Å; M369-Y377 HydrophobicContact CG-CD2 4.45Å; M369-Y377 HydrophobicContact CG-CE1 3.8Å; M369-Y377 HydrophobicContact CG-CE2 4.08Å; N372-Y377 HydrophobicContact CB-CE2 3.93Å; N372-Y377 PolarHBondContact ND2-OH 3.18Å; M374-Y377 PolarHBondContact O-N 2.92Å; T375-Y377 PolarHBondContact O-N 2.84Å; Y377-V416 CarbonylContact O-C 3.59Å; Y377-V416 WeakPolarHBondContact O-CA 3.39Å; Y377-K417 PolarHBondContact O-N 2.82Å
378	L	97.8	Very high	96.8	Very high	6 Å²	6	49.5 Å²	49.5	3%	0.031	25%	0.249	C	C	.	.	B	Isolated β-bridge	trans	-104.9	146.8	-180	-65.2	-174.4	0	0	0	112.5	M374 T375 H383 L386 L414 V416	M374-L378 HydrophobicContact CE-CD2 4.15Å; M374-L378 HydrophobicContact CG-CD1 4.07Å; M374-L378 HydrophobicContact CG-CG 4.2Å; M374-L378 WeakPolarHBondContact O-CG 3.35Å; M374-L378 PolarHBondContact O-N 3.4Å; T375-L378 PolarHBondContact O-N 2.84Å; L378-H383 PolarHBondContact O-NE2 3.27Å; L378-L386 HydrophobicContact CD1-CB 4.15Å; L378-L386 HydrophobicContact CD1-CD2 3.86Å; L378-L386 HydrophobicContact CD1-CG 4.42Å; L378-L414 HydrophobicContact CD1-CD1 3.88Å; L378-L414 HydrophobicContact CD1-CD2 4.3Å; L378-L414 HydrophobicContact CD2-CB 3.89Å; L378-L414 HydrophobicContact CD2-CD1 3.9Å; L378-L414 HydrophobicContact CD2-CG 4.39Å; L378-V416 HydrophobicContact CD2-CB 4.48Å; L378-V416 HydrophobicContact CD2-CG2 3.89Å
379	H	97.6	Very high	96.8	Very high	36 Å²	36	46 Å²	46	17%	0.167	23%	0.233	C	C	.	.			trans	-57.2	131.9	168.3	-172.1	-83.7	0	0	0	110.4	L381 D382 H383 R415 F432	H379-L381 VanDerWaalsContact C-N 3.28Å; H379-L381 PolarHBondContact ND1-N 3.11Å; H379-L381 PolarHBondContact O-N 3.32Å; H379-L381 VanDerWaalsContact O-N 3.1Å; H379-D382 PolarHBondContact O-N 3.19Å; H379-H383 PolarHBondContact O-CD2 3.44Å; H379-H383 VanDerWaalsContact O-CD2 3.28Å; H379-R415 HydrophobicContact CB-CB 3.58Å; H379-R415 PolarHBondContact N-O 3.42Å; H379-F432 HydrophobicContact CB-CD1 3.85Å; H379-F432 HydrophobicContact CB-CE1 3.97Å; H379-F432 HydrophobicContact CB-CG 4.18Å; H379-F432 HydrophobicContact CB-CZ 4.37Å; H379-F432 AromaticContact CD2-CD2 3.72Å; H379-F432 AromaticContact CD2-CE2 3.83Å; H379-F432 VanDerWaalsContact N-CE1 3.33Å
380	P	97	Very high	96.7	Very high	87 Å²	87	46.6 Å²	46.6	57%	0.565	24%	0.236	S	C	*	.	G	3₁₀ helix	trans	-51.9	-39.8	-171.9	-31.8	36.7	0	0	0	115.3	D382 H383	P380-D382 PolarHBondContact O-N 2.84Å; P380-D382 VanDerWaalsContact O-N 3.16Å; P380-H383 VanDerWaalsContact O-CB 3.29Å; P380-H383 WeakPolarHBondContact O-CB 3.37Å; P380-H383 PolarHBondContact O-N 2.8Å; P380-H383 VanDerWaalsContact O-N 3.1Å
381	L	96.6	Very high	96.5	Very high	106 Å²	106	49 Å²	49	56%	0.555	25%	0.251	S	S	*	.	G	3₁₀ helix	trans	-62.8	-17.9	177.7	-62	178.7	0	0	0	114.7	H379 T761	H379-L381 VanDerWaalsContact C-N 3.28Å; H379-L381 PolarHBondContact ND1-N 3.11Å; H379-L381 PolarHBondContact O-N 3.32Å; H379-L381 VanDerWaalsContact O-N 3.1Å; L381-T761 HydrophobicContact CD1-CG2 4.37Å
382	D	97.3	Very high	96.2	Very high	2 Å²	2	50 Å²	50	1%	0.011	26%	0.255	C	S	.	.	G	3₁₀ helix	trans	-94.9	-0.2	178.4	-60.9	-14.4	0	0	0	112.1	H379 P380 E385 L386 L414 R415 K538	H379-D382 PolarHBondContact O-N 3.19Å; P380-D382 PolarHBondContact O-N 2.84Å; P380-D382 VanDerWaalsContact O-N 3.16Å; D382-E385 PolarHBondContact O-N 3Å; D382-L386 PolarHBondContact O-N 3.03Å; D382-L386 VanDerWaalsContact O-N 3.11Å; D382-L414 HydrophobicContact CB-CD2 3.99Å; D382-R415 IonicContact OD1-CZ 2.92Å; D382-R415 IonicContact OD1-NE 2.67Å; D382-R415 PolarHBondContact OD1-NE 3.17Å; D382-R415 IonicContact OD1-NH2 2.66Å; D382-R415 PolarHBondContact OD1-NH2 3.38Å; D382-R415 VanDerWaalsContact OD2-CB 3.24Å; D382-R415 WeakPolarHBondContact OD2-CB 3.43Å; D382-R415 WeakPolarHBondContact OD2-CG 3.38Å; D382-R415 IonicContact OD2-CZ 2.71Å; D382-R415 PolarHBondContact OD2-N 2.88Å; D382-R415 IonicContact OD2-NE 3.6Å; D382-R415 PolarHBondContact OD2-NE 3.21Å; D382-R415 IonicContact OD2-NH2 3.28Å; D382-K538 WeakPolarHBondContact OD1-CE 3.45Å
383	H	97.2	Very high	95.8	Very high	47 Å²	47	52.6 Å²	52.6	22%	0.218	27%	0.266	C	S	.	.	H	α-helix	trans	-68.2	-36.2	-176.2	-72.9	-161.2	0	0	0	113.2	T375 L378 H379 P380 K387	T375-H383 HydrophobicContact CG2-CB 4.2Å; T375-H383 PolarHBondContact O-CE1 2.88Å; T375-H383 VanDerWaalsContact O-CE1 3.26Å; T375-H383 PolarHBondContact O-NE2 2.86Å; L378-H383 PolarHBondContact O-NE2 3.27Å; H379-H383 PolarHBondContact O-CD2 3.44Å; H379-H383 VanDerWaalsContact O-CD2 3.28Å; P380-H383 VanDerWaalsContact O-CB 3.29Å; P380-H383 WeakPolarHBondContact O-CB 3.37Å; P380-H383 PolarHBondContact O-N 2.8Å; P380-H383 VanDerWaalsContact O-N 3.1Å; H383-K387 WeakPolarHBondContact O-CG 3.24Å; H383-K387 PolarHBondContact O-N 3.4Å
384	D	96.5	Very high	95.3	Very high	96 Å²	96	54.1 Å²	54.1	51%	0.513	28%	0.283	S	S	.	.	H	α-helix	trans	-76.9	-26.3	176	-73.9	-33.9	0	0	0	112.6	K387 Q388	D384-K387 PolarHBondContact O-N 3.39Å; D384-K387 WeakPolarHBondContact OD1-CD 3.46Å; D384-K387 WeakPolarHBondContact OD1-CE 3.15Å; D384-K387 IonicContact OD1-NZ 3.85Å; D384-K387 PolarHBondContact OD1-NZ 2.98Å; D384-Q388 WeakPolarHBondContact O-CG 3.48Å; D384-Q388 PolarHBondContact O-N 3.41Å; D384-Q388 VanDerWaalsContact O-N 3.11Å
385	E	96.1	Very high	95	Very high	55 Å²	55	58.1 Å²	58.1	26%	0.257	31%	0.311	S	S	.	.	H	α-helix	trans	-67.1	-42.3	171.6	-170.5	175	150.4	0	0	110.7	D382 K387 Q388 I389 K538	D382-E385 PolarHBondContact O-N 3Å; E385-K387 VanDerWaalsContact C-N 3.28Å; E385-K387 PolarHBondContact O-N 2.83Å; E385-Q388 WeakPolarHBondContact O-CB 3.35Å; E385-Q388 PolarHBondContact O-N 3.27Å; E385-Q388 VanDerWaalsContact O-N 3.09Å; E385-I389 HydrophobicContact CG-CD1 3.94Å; E385-I389 WeakPolarHBondContact O-CD1 3.37Å; E385-I389 VanDerWaalsContact O-CG1 3.28Å; E385-I389 WeakPolarHBondContact O-CG1 3.48Å; E385-I389 PolarHBondContact O-N 2.81Å; E385-K538 IonicContact OE1-NZ 2.79Å; E385-K538 PolarHBondContact OE1-NZ 3.25Å; E385-K538 WeakPolarHBondContact OE2-CE 3.28Å; E385-K538 IonicContact OE2-NZ 3.72Å; E385-K538 PolarHBondContact OE2-NZ 3.09Å
386	L	96.3	Very high	94.6	Very high	5 Å²	5	58.3 Å²	58.3	3%	0.026	31%	0.31	C	S	.	.	H	α-helix	trans	-56.6	-41.8	172.3	-179.3	67.5	0	0	0	112	M374 T375 L378 D382 Q388 I389 L390	M374-L386 HydrophobicContact CB-CD2 3.86Å; M374-L386 HydrophobicContact CG-CD2 4.05Å; T375-L386 HydrophobicContact CG2-CD2 4.07Å; L378-L386 HydrophobicContact CD1-CB 4.15Å; L378-L386 HydrophobicContact CD1-CD2 3.86Å; L378-L386 HydrophobicContact CD1-CG 4.42Å; D382-L386 PolarHBondContact O-N 3.03Å; D382-L386 VanDerWaalsContact O-N 3.11Å; L386-Q388 VanDerWaalsContact C-N 3.33Å; L386-Q388 PolarHBondContact O-N 2.66Å; L386-I389 PolarHBondContact O-N 3.06Å; L386-L390 HydrophobicContact CD1-CD1 4.06Å; L386-L390 HydrophobicContact CD1-CG 4.25Å; L386-L390 HydrophobicContact CG-CD1 3.97Å; L386-L390 WeakPolarHBondContact O-CB 3.46Å; L386-L390 WeakPolarHBondContact O-CG 3.49Å; L386-L390 PolarHBondContact O-N 2.97Å
387	K	95.1	Very high	94	Very high	118 Å²	118	55 Å²	55	51%	0.513	30%	0.295	S	S	.	.	H	α-helix	trans	-62.8	-39.6	176.6	-63.5	168.6	-158.4	165.3	0	111.6	H383 D384 E385 T391	H383-K387 WeakPolarHBondContact O-CG 3.24Å; H383-K387 PolarHBondContact O-N 3.4Å; D384-K387 PolarHBondContact O-N 3.39Å; D384-K387 WeakPolarHBondContact OD1-CD 3.46Å; D384-K387 WeakPolarHBondContact OD1-CE 3.15Å; D384-K387 IonicContact OD1-NZ 3.85Å; D384-K387 PolarHBondContact OD1-NZ 2.98Å; E385-K387 VanDerWaalsContact C-N 3.28Å; E385-K387 PolarHBondContact O-N 2.83Å; K387-T391 WeakPolarHBondContact O-CB 3.29Å; K387-T391 PolarHBondContact O-N 3.47Å; K387-T391 VanDerWaalsContact O-N 3.11Å; K387-T391 PolarHBondContact O-OG1 2.79Å
388	Q	94.5	Very high	93.5	Very high	124 Å²	124	57.5 Å²	57.5	58%	0.579	32%	0.318	S	S	*	.	H	α-helix	trans	-67	-45.4	175.6	-68.3	170.2	42.5	0	0	111.6	D384 E385 L386 L390 T391	D384-Q388 WeakPolarHBondContact O-CG 3.48Å; D384-Q388 PolarHBondContact O-N 3.41Å; D384-Q388 VanDerWaalsContact O-N 3.11Å; E385-Q388 WeakPolarHBondContact O-CB 3.35Å; E385-Q388 PolarHBondContact O-N 3.27Å; E385-Q388 VanDerWaalsContact O-N 3.09Å; L386-Q388 VanDerWaalsContact C-N 3.33Å; L386-Q388 PolarHBondContact O-N 2.66Å; Q388-L390 VanDerWaalsContact C-N 3.29Å; Q388-L390 PolarHBondContact O-N 3.45Å; Q388-T391 WeakPolarHBondContact O-CB 3.22Å; Q388-T391 PolarHBondContact O-N 2.85Å
389	I	95.2	Very high	93	Very high	13 Å²	13	61.2 Å²	61.2	7%	0.067	35%	0.349	C	S	.	.	H	α-helix	trans	-57.3	-41.6	176.7	-67.9	155	0	0	0	111.6	E385 L386 T391 R410 F412 L414 L459	E385-I389 HydrophobicContact CG-CD1 3.94Å; E385-I389 WeakPolarHBondContact O-CD1 3.37Å; E385-I389 VanDerWaalsContact O-CG1 3.28Å; E385-I389 WeakPolarHBondContact O-CG1 3.48Å; E385-I389 PolarHBondContact O-N 2.81Å; L386-I389 PolarHBondContact O-N 3.06Å; I389-T391 VanDerWaalsContact C-N 3.3Å; I389-R410 HydrophobicContact CG2-CG 4.39Å; I389-R410 PolarHBondContact O-NE 2.94Å; I389-F412 HydrophobicContact CD1-CB 3.72Å; I389-F412 HydrophobicContact CD1-CD1 4.08Å; I389-F412 HydrophobicContact CD1-CD2 3.31Å; I389-F412 HydrophobicContact CD1-CE2 3.86Å; I389-F412 HydrophobicContact CD1-CG 3.43Å; I389-F412 VanDerWaalsContact CD1-CG 3.43Å; I389-F412 HydrophobicContact CD1-CZ 4.46Å; I389-F412 HydrophobicContact CG1-CB 4.13Å; I389-F412 HydrophobicContact CG1-CD1 4.2Å; I389-F412 HydrophobicContact CG1-CD2 4.3Å; I389-F412 HydrophobicContact CG1-CG 3.96Å; I389-F412 HydrophobicContact CG2-CD1 3.9Å; I389-F412 HydrophobicContact CG2-CE1 3.71Å; I389-F412 HydrophobicContact CG2-CE2 4.48Å; I389-F412 HydrophobicContact CG2-CG 4.38Å; I389-F412 HydrophobicContact CG2-CZ 4.02Å; I389-L414 HydrophobicContact CD1-CD2 4.44Å; I389-L459 HydrophobicContact CG2-CD2 3.75Å
390	L	94.7	Very high	92.4	Very high	13 Å²	13	61.2 Å²	61.2	7%	0.068	35%	0.35	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.4	-7.5	177.7	-65.2	174.2	0	0	0	113.8	V345 L386 Q388 L441 N456 L459	V345-L390 HydrophobicContact CG1-CD1 3.98Å; V345-L390 HydrophobicContact CG1-CD2 4.01Å; L386-L390 HydrophobicContact CD1-CD1 4.06Å; L386-L390 HydrophobicContact CD1-CG 4.25Å; L386-L390 HydrophobicContact CG-CD1 3.97Å; L386-L390 WeakPolarHBondContact O-CB 3.46Å; L386-L390 WeakPolarHBondContact O-CG 3.49Å; L386-L390 PolarHBondContact O-N 2.97Å; Q388-L390 VanDerWaalsContact C-N 3.29Å; Q388-L390 PolarHBondContact O-N 3.45Å; L390-L441 HydrophobicContact CD2-CD1 4.23Å; L390-N456 PolarHBondContact O-ND2 2.97Å; L390-L459 HydrophobicContact CD2-CB 3.68Å; L390-L459 HydrophobicContact CD2-CD2 4.05Å
391	T	92.6	Very high	91.5	Very high	64 Å²	64	61.2 Å²	61.2	39%	0.393	35%	0.352	S	S	.	.	P	Polyproline II helix	trans	-82.3	142.6	176.2	-65.2	0	0	0	0	110.6	K387 Q388 I389 R410	K387-T391 WeakPolarHBondContact O-CB 3.29Å; K387-T391 PolarHBondContact O-N 3.47Å; K387-T391 VanDerWaalsContact O-N 3.11Å; K387-T391 PolarHBondContact O-OG1 2.79Å; Q388-T391 WeakPolarHBondContact O-CB 3.22Å; Q388-T391 PolarHBondContact O-N 2.85Å; I389-T391 VanDerWaalsContact C-N 3.3Å; T391-R410 PolarHBondContact O-NH2 3.02Å
392	V	90.6	Very high	90.7	Very high	30 Å²	30	60.1 Å²	60.1	18%	0.182	37%	0.366	C	S	.	.	P	Polyproline II helix	trans	-99.9	116.5	170	-177.4	0	0	0	0	107.4	I397 L408 L441 V443 N456	V392-I397 HydrophobicContact CG1-CD1 3.78Å; V392-I397 HydrophobicContact CG1-CG1 3.66Å; V392-L408 HydrophobicContact CG1-CD1 4.06Å; V392-L441 HydrophobicContact CG2-CD2 3.72Å; V392-V443 HydrophobicContact CG1-CG2 4.33Å; V392-V443 HydrophobicContact CG2-CG2 3.62Å; V392-N456 HydrophobicContact CG2-CB 4.37Å
393	H	89.5	Confident	90	Very high	81 Å²	81	64.7 Å²	64.7	38%	0.375	39%	0.387	S	S	.	.	P	Polyproline II helix	trans	-84.4	147.8	-177.5	-68	-91	0	0	0	112	S395 E396 I397	H393-S395 PolarHBondContact O-N 3.37Å; H393-S395 VanDerWaalsContact O-N 3.16Å; H393-E396 HydrophobicContact CB-CG 4.08Å; H393-E396 IonicContact CD2-OE2 3.16Å; H393-E396 IonicContact CG-OE2 2.95Å; H393-E396 PolarHBondContact N-OE2 2.99Å; H393-E396 WeakPolarHBondContact O-CB 3.43Å; H393-E396 PolarHBondContact O-N 2.7Å; H393-I397 PolarHBondContact O-N 2.88Å; H393-I397 VanDerWaalsContact O-N 3.16Å
394	P	87.1	Confident	89.3	Confident	104 Å²	104	66.8 Å²	66.8	68%	0.675	41%	0.407	S	S	*	.	H	α-helix	trans	-58.5	-29.1	179.7	-27.4	36	0	0	0	114.8	A398	P394-A398 PolarHBondContact O-N 3.29Å
395	S	89.8	Confident	88.9	Confident	87 Å²	87	65.3 Å²	65.3	61%	0.608	40%	0.397	S	S	*	.	H	α-helix	trans	-65.8	-39.2	173.3	43.5	0	0	0	0	112.7	H393 A398 A399	H393-S395 PolarHBondContact O-N 3.37Å; H393-S395 VanDerWaalsContact O-N 3.16Å; S395-A398 PolarHBondContact O-N 3.15Å; S395-A399 WeakPolarHBondContact O-CB 3.24Å; S395-A399 PolarHBondContact O-N 2.87Å
396	E	89.1	Confident	88.6	Confident	38 Å²	38	63 Å²	63	18%	0.178	39%	0.387	C	S	.	.	H	α-helix	trans	-69.5	-37.6	177.8	-57.1	179.2	116	0	0	111.2	H393 A399 N400 L408 R410	H393-E396 HydrophobicContact CB-CG 4.08Å; H393-E396 IonicContact CD2-OE2 3.16Å; H393-E396 IonicContact CG-OE2 2.95Å; H393-E396 PolarHBondContact N-OE2 2.99Å; H393-E396 WeakPolarHBondContact O-CB 3.43Å; H393-E396 PolarHBondContact O-N 2.7Å; E396-A399 PolarHBondContact O-N 2.86Å; E396-N400 PolarHBondContact O-N 2.83Å; E396-N400 PolarHBondContact O-ND2 3.09Å; E396-L408 HydrophobicContact CB-CD1 3.89Å; E396-L408 HydrophobicContact CB-CD2 3.88Å; E396-L408 HydrophobicContact CG-CD1 4.39Å; E396-L408 HydrophobicContact CG-CD2 4.49Å; E396-R410 VanDerWaalsContact CD-NH2 3.34Å; E396-R410 IonicContact OE1-CZ 2.87Å; E396-R410 VanDerWaalsContact OE1-CZ 3.28Å; E396-R410 IonicContact OE1-NH1 2.86Å; E396-R410 PolarHBondContact OE1-NH1 2.93Å; E396-R410 IonicContact OE1-NH2 2.66Å; E396-R410 PolarHBondContact OE1-NH2 3.45Å; E396-R410 IonicContact OE2-CZ 3.93Å; E396-R410 IonicContact OE2-NH2 3.28Å; E396-R410 PolarHBondContact OE2-NH2 3.11Å
397	I	85.5	Confident	88.3	Confident	34 Å²	34	66.7 Å²	66.7	17%	0.174	41%	0.409	C	S	.	.	H	α-helix	trans	-62.3	-46.4	171.7	-74.3	163.7	0	0	0	111	V392 H393 A399 N400 S401 F406 Y454	V392-I397 HydrophobicContact CG1-CD1 3.78Å; V392-I397 HydrophobicContact CG1-CG1 3.66Å; H393-I397 PolarHBondContact O-N 2.88Å; H393-I397 VanDerWaalsContact O-N 3.16Å; I397-A399 VanDerWaalsContact C-N 3.35Å; I397-A399 PolarHBondContact O-N 3.32Å; I397-N400 CarbonylContact O-C 3.59Å; I397-N400 PolarHBondContact O-N 2.93Å; I397-S401 PolarHBondContact O-N 2.88Å; I397-S401 VanDerWaalsContact O-N 3.15Å; I397-F406 HydrophobicContact CG1-CZ 4.4Å; I397-Y454 HydrophobicContact CB-CE1 4.42Å; I397-Y454 HydrophobicContact CD1-CD1 4.27Å; I397-Y454 HydrophobicContact CD1-CD2 3.94Å; I397-Y454 HydrophobicContact CD1-CE2 4.38Å; I397-Y454 HydrophobicContact CD1-CG 3.9Å; I397-Y454 HydrophobicContact CG1-CD1 3.96Å; I397-Y454 HydrophobicContact CG1-CD2 4.43Å; I397-Y454 HydrophobicContact CG1-CE1 4.16Å; I397-Y454 HydrophobicContact CG1-CG 4.11Å; I397-Y454 HydrophobicContact CG2-CD1 4.25Å; I397-Y454 HydrophobicContact CG2-CD2 4.38Å; I397-Y454 HydrophobicContact CG2-CE1 3.6Å; I397-Y454 HydrophobicContact CG2-CE2 3.78Å; I397-Y454 WeakPolarHBondContact CG2-OH 3.39Å
398	A	86.6	Confident	88.2	Confident	62 Å²	62	61.6 Å²	61.6	51%	0.512	39%	0.388	S	S	.	.	H	α-helix	trans	-61.9	-42.6	178.4	0	0	0	0	0	112	P394 S395 N400 S401	P394-A398 PolarHBondContact O-N 3.29Å; S395-A398 PolarHBondContact O-N 3.15Å; A398-N400 VanDerWaalsContact C-N 3.3Å; A398-N400 PolarHBondContact O-N 3.02Å; A398-S401 WeakPolarHBondContact O-CB 3.47Å; A398-S401 PolarHBondContact O-N 2.87Å; A398-S401 PolarHBondContact O-OG 3.37Å
399	A	87.5	Confident	88.2	Confident	84 Å²	84	60.4 Å²	60.4	69%	0.694	38%	0.382	S	S	*	.	H	α-helix	trans	-64.1	-30.6	178.4	0	0	0	0	0	113.7	S395 E396 I397	S395-A399 WeakPolarHBondContact O-CB 3.24Å; S395-A399 PolarHBondContact O-N 2.87Å; E396-A399 PolarHBondContact O-N 2.86Å; I397-A399 VanDerWaalsContact C-N 3.35Å; I397-A399 PolarHBondContact O-N 3.32Å
400	N	86	Confident	88.2	Confident	36 Å²	36	61.2 Å²	61.2	19%	0.193	38%	0.384	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103.2	17.9	179.3	-64.1	-85.3	0	0	0	113.1	E396 I397 A398 G402 Q403 F406	E396-N400 PolarHBondContact O-N 2.83Å; E396-N400 PolarHBondContact O-ND2 3.09Å; I397-N400 CarbonylContact O-C 3.59Å; I397-N400 PolarHBondContact O-N 2.93Å; A398-N400 VanDerWaalsContact C-N 3.3Å; A398-N400 PolarHBondContact O-N 3.02Å; N400-G402 PolarHBondContact O-N 2.91Å; N400-Q403 PolarHBondContact O-N 2.95Å; N400-F406 HydrophobicContact CB-CB 4.15Å; N400-F406 HydrophobicContact CB-CD1 3.95Å; N400-F406 HydrophobicContact CB-CD2 3.73Å; N400-F406 HydrophobicContact CB-CE1 4.21Å; N400-F406 HydrophobicContact CB-CE2 4.01Å; N400-F406 HydrophobicContact CB-CG 3.71Å; N400-F406 HydrophobicContact CB-CZ 4.23Å
401	S	77.6	Confident	88.3	Confident	87 Å²	87	63.8 Å²	63.8	61%	0.608	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59	136.3	-177.4	63	0	0	0	0	112.5	I397 A398	I397-S401 PolarHBondContact O-N 2.88Å; I397-S401 VanDerWaalsContact O-N 3.15Å; A398-S401 WeakPolarHBondContact O-CB 3.47Å; A398-S401 PolarHBondContact O-N 2.87Å; A398-S401 PolarHBondContact O-OG 3.37Å
402	G	79.4	Confident	88.5	Confident	82 Å²	82	61.3 Å²	61.3	85%	0.845	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	91	-11.4	-176.8	0	0	0	0	0	115.8	N400	N400-G402 PolarHBondContact O-N 2.91Å
403	Q	83.2	Confident	88.8	Confident	98 Å²	98	60.4 Å²	60.4	46%	0.458	38%	0.381	S	S	.	.			trans	-81.7	144.8	172.6	-62	-174.8	-3.8	0	0	111.4	N400 F406 V445	N400-Q403 PolarHBondContact O-N 2.95Å; Q403-F406 HydrophobicContact CB-CB 4.36Å; Q403-V445 WeakPolarHBondContact O-CG2 3.36Å
404	S	83	Confident	89.2	Confident	91 Å²	91	56.6 Å²	56.6	64%	0.636	36%	0.364	S	S	*	.	S	Bend	trans	-86.7	-29.1	178.3	52.5	0	0	0	0	113.4	V445	S404-V445 PolarHBondContact O-N 3.33Å
405	E	86.7	Confident	89.7	Confident	65 Å²	65	53 Å²	53	30%	0.304	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146	138.8	166.4	-163.6	177.7	120	0	0	108.3	R442 V443 R444	E405-R442 IonicContact OE1-CZ 3.89Å; E405-R442 VanDerWaalsContact OE1-CZ 3.26Å; E405-R442 IonicContact OE1-NE 3.54Å; E405-R442 PolarHBondContact OE1-NE 3.14Å; E405-R442 IonicContact OE1-NH2 2.62Å; E405-R442 PolarHBondContact OE1-NH2 2.94Å; E405-R442 IonicContact OE2-NH2 2.66Å; E405-V443 CarbonylContact C-O 3.52Å; E405-V443 WeakPolarHBondContact CA-O 3.43Å; E405-V443 WeakPolarHBondContact CG-O 3.29Å; E405-R444 HydrophobicContact CG-CB 4.13Å; E405-R444 IonicContact OE2-CZ 3.2Å; E405-R444 VanDerWaalsContact OE2-CZ 3.24Å; E405-R444 IonicContact OE2-NE 2.69Å; E405-R444 PolarHBondContact OE2-NE 2.9Å; E405-R444 IonicContact OE2-NH2 3.21Å; E405-R444 PolarHBondContact OE2-NH2 3.4Å
406	F	89.5	Confident	90	Very high	7 Å²	7	49 Å²	49	3%	0.031	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.5	164.5	-176.7	64	-94.7	0	0	0	112.2	I397 N400 Q403 L408 V443 V445 Y454	I397-F406 HydrophobicContact CG1-CZ 4.4Å; N400-F406 HydrophobicContact CB-CB 4.15Å; N400-F406 HydrophobicContact CB-CD1 3.95Å; N400-F406 HydrophobicContact CB-CD2 3.73Å; N400-F406 HydrophobicContact CB-CE1 4.21Å; N400-F406 HydrophobicContact CB-CE2 4.01Å; N400-F406 HydrophobicContact CB-CG 3.71Å; N400-F406 HydrophobicContact CB-CZ 4.23Å; Q403-F406 HydrophobicContact CB-CB 4.36Å; F406-L408 HydrophobicContact CD2-CD2 3.94Å; F406-L408 HydrophobicContact CD2-CG 4.08Å; F406-L408 HydrophobicContact CE2-CD1 4.08Å; F406-L408 HydrophobicContact CE2-CD2 3.89Å; F406-L408 HydrophobicContact CE2-CG 3.96Å; F406-V443 HydrophobicContact CD1-CB 4.4Å; F406-V443 HydrophobicContact CD2-CB 4.1Å; F406-V443 HydrophobicContact CD2-CG2 4.48Å; F406-V443 HydrophobicContact CE1-CB 4.06Å; F406-V443 HydrophobicContact CE1-CG1 3.9Å; F406-V443 HydrophobicContact CE2-CB 3.73Å; F406-V443 HydrophobicContact CE2-CG1 4.13Å; F406-V443 HydrophobicContact CE2-CG2 3.96Å; F406-V443 HydrophobicContact CG-CB 4.42Å; F406-V443 HydrophobicContact CZ-CB 3.71Å; F406-V443 HydrophobicContact CZ-CG1 3.61Å; F406-V443 HydrophobicContact CZ-CG2 4.28Å; F406-V443 PolarHBondContact N-O 2.83Å; F406-V443 PolarHBondContact O-N 2.85Å; F406-V445 HydrophobicContact CD1-CG2 4.19Å; F406-V445 HydrophobicContact CE1-CG2 3.83Å; F406-Y454 HydrophobicContact CE1-CD1 4.08Å; F406-Y454 HydrophobicContact CE1-CE1 4.26Å; F406-Y454 HydrophobicContact CZ-CD1 4.22Å
407	T	91.1	Very high	90.4	Very high	82 Å²	82	51.3 Å²	51.3	50%	0.503	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	133.1	-178.2	49.7	0	0	0	0	111.1	H440 L441 R442	T407-H440 HydrophobicContact CG2-CB 4.48Å; T407-L441 WeakPolarHBondContact CA-O 3.38Å; T407-R442 HydrophobicContact CG2-CG 3.91Å
408	L	92.9	Very high	90.9	Very high	11 Å²	11	50.3 Å²	50.3	6%	0.058	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	121	176.2	-57.3	173.5	0	0	0	109.7	V392 E396 F406 H440 L441 V443	V392-L408 HydrophobicContact CG1-CD1 4.06Å; E396-L408 HydrophobicContact CB-CD1 3.89Å; E396-L408 HydrophobicContact CB-CD2 3.88Å; E396-L408 HydrophobicContact CG-CD1 4.39Å; E396-L408 HydrophobicContact CG-CD2 4.49Å; F406-L408 HydrophobicContact CD2-CD2 3.94Å; F406-L408 HydrophobicContact CD2-CG 4.08Å; F406-L408 HydrophobicContact CE2-CD1 4.08Å; F406-L408 HydrophobicContact CE2-CD2 3.89Å; F406-L408 HydrophobicContact CE2-CG 3.96Å; L408-H440 CarbonylContact O-C 3.5Å; L408-H440 VanDerWaalsContact O-CA 3.26Å; L408-H440 WeakPolarHBondContact O-CA 3.37Å; L408-L441 HydrophobicContact CB-CB 4.34Å; L408-L441 PolarHBondContact N-O 3.16Å; L408-L441 PolarHBondContact O-N 2.77Å; L408-V443 HydrophobicContact CD1-CG2 4.25Å
409	E	94.5	Very high	91.3	Very high	100 Å²	100	51.1 Å²	51.1	47%	0.467	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.6	139.1	175.6	-167.5	168.9	173.5	0	0	109.8	R670	E409-R670 IonicContact OE1-CZ 2.86Å; E409-R670 VanDerWaalsContact OE1-CZ 3.31Å; E409-R670 IonicContact OE1-NH1 3.11Å; E409-R670 PolarHBondContact OE1-NH1 2.66Å; E409-R670 IonicContact OE1-NH2 3.21Å; E409-R670 PolarHBondContact OE1-NH2 2.79Å; E409-R670 IonicContact OE2-NH1 3.56Å; E409-R670 PolarHBondContact OE2-NH1 2.91Å
410	R	95.7	Very high	91.6	Very high	29 Å²	29	49 Å²	49	11%	0.109	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	115.6	-179.9	-69.4	-69.4	-176.1	-101.4	12.3	108.3	I389 T391 E396 F412 N438 G439 L441 L459	I389-R410 HydrophobicContact CG2-CG 4.39Å; I389-R410 PolarHBondContact O-NE 2.94Å; T391-R410 PolarHBondContact O-NH2 3.02Å; E396-R410 VanDerWaalsContact CD-NH2 3.34Å; E396-R410 IonicContact OE1-CZ 2.87Å; E396-R410 VanDerWaalsContact OE1-CZ 3.28Å; E396-R410 IonicContact OE1-NH1 2.86Å; E396-R410 PolarHBondContact OE1-NH1 2.93Å; E396-R410 IonicContact OE1-NH2 2.66Å; E396-R410 PolarHBondContact OE1-NH2 3.45Å; E396-R410 IonicContact OE2-CZ 3.93Å; E396-R410 IonicContact OE2-NH2 3.28Å; E396-R410 PolarHBondContact OE2-NH2 3.11Å; R410-F412 HydrophobicContact CB-CD1 4.03Å; R410-F412 HydrophobicContact CB-CE1 4Å; R410-N438 CarbonylContact O-C 3.42Å; R410-N438 WeakPolarHBondContact O-CA 3.4Å; R410-G439 PolarHBondContact N-O 2.82Å; R410-G439 PolarHBondContact O-N 3.04Å; R410-L441 HydrophobicContact CG-CB 4.32Å; R410-L459 HydrophobicContact CB-CD1 4.08Å; R410-L459 HydrophobicContact CG-CD1 4.1Å
411	S	95.9	Very high	91.6	Very high	68 Å²	68	50.5 Å²	50.5	48%	0.476	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	121.7	172.8	-169.1	0	0	0	0	108.3	H436 C437 N438	S411-H436 PolarHBondContact OG-NE2 2.87Å; S411-C437 WeakPolarHBondContact CA-O 3.48Å; S411-N438 WeakPolarHBondContact CB-OD1 3.27Å; S411-N438 PolarHBondContact OG-OD1 3.23Å
412	F	96.9	Very high	91.7	Very high	11 Å²	11	55 Å²	55	5%	0.048	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.3	163.9	-167.9	59.2	-88	0	0	0	112.1	F343 I389 R410 L414 H436 C437 L459	F343-F412 HydrophobicContact CZ-CZ 4.14Å; I389-F412 HydrophobicContact CD1-CB 3.72Å; I389-F412 HydrophobicContact CD1-CD1 4.08Å; I389-F412 HydrophobicContact CD1-CD2 3.31Å; I389-F412 HydrophobicContact CD1-CE2 3.86Å; I389-F412 HydrophobicContact CD1-CG 3.43Å; I389-F412 VanDerWaalsContact CD1-CG 3.43Å; I389-F412 HydrophobicContact CD1-CZ 4.46Å; I389-F412 HydrophobicContact CG1-CB 4.13Å; I389-F412 HydrophobicContact CG1-CD1 4.2Å; I389-F412 HydrophobicContact CG1-CD2 4.3Å; I389-F412 HydrophobicContact CG1-CG 3.96Å; I389-F412 HydrophobicContact CG2-CD1 3.9Å; I389-F412 HydrophobicContact CG2-CE1 3.71Å; I389-F412 HydrophobicContact CG2-CE2 4.48Å; I389-F412 HydrophobicContact CG2-CG 4.38Å; I389-F412 HydrophobicContact CG2-CZ 4.02Å; R410-F412 HydrophobicContact CB-CD1 4.03Å; R410-F412 HydrophobicContact CB-CE1 4Å; F412-L414 HydrophobicContact CD2-CD1 4.09Å; F412-L414 HydrophobicContact CD2-CD2 4.4Å; F412-L414 HydrophobicContact CD2-CG 3.86Å; F412-L414 HydrophobicContact CE2-CD1 3.65Å; F412-L414 HydrophobicContact CE2-CG 3.95Å; F412-H436 PolarHBondContact O-CD2 3.37Å; F412-C437 HydrophobicContact CD1-CB 4.14Å; F412-C437 HydrophobicContact CD2-CB 3.68Å; F412-C437 HydrophobicContact CE1-CB 3.73Å; F412-C437 HydrophobicContact CE2-CB 3.23Å; F412-C437 HydrophobicContact CG-CB 4.12Å; F412-C437 HydrophobicContact CZ-CB 3.25Å; F412-C437 PolarHBondContact N-O 3.24Å; F412-C437 PolarHBondContact O-N 2.87Å; F412-L459 HydrophobicContact CE1-CD2 4.11Å; F412-L459 HydrophobicContact CZ-CD2 3.81Å
413	F	97.6	Very high	91.7	Very high	12 Å²	12	60.1 Å²	60.1	5%	0.053	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	129.2	-175.2	-61.1	-91.7	0	0	0	110.3	V434 I435 H436 I466 I534 K538 V541 T542	F413-V434 HydrophobicContact CB-CG1 4.44Å; F413-V434 HydrophobicContact CD1-CG1 4.46Å; F413-I435 WeakPolarHBondContact CA-O 3.44Å; F413-H436 HydrophobicContact CD1-CB 3.81Å; F413-H436 AromaticContact CD1-CD2 3.91Å; F413-H436 AromaticContact CD1-CG 3.93Å; F413-H436 HydrophobicContact CE1-CB 3.57Å; F413-H436 AromaticContact CE1-CD2 3.46Å; F413-H436 VanDerWaalsContact CE1-CD2 3.46Å; F413-H436 WeakPolarHBondContact CE1-CD2 3.2Å; F413-H436 AromaticContact CE1-CG 3.34Å; F413-H436 AromaticContact CE1-ND1 3.8Å; F413-H436 AromaticContact CE1-NE2 3.96Å; F413-H436 HydrophobicContact CZ-CB 4.48Å; F413-H436 AromaticContact CZ-CD2 3.52Å; F413-H436 AromaticContact CZ-CE1 3.81Å; F413-H436 AromaticContact CZ-CG 3.77Å; F413-H436 AromaticContact CZ-ND1 3.96Å; F413-H436 AromaticContact CZ-NE2 3.56Å; F413-I466 HydrophobicContact CD1-CD1 3.88Å; F413-I466 HydrophobicContact CE1-CD1 3.88Å; F413-I534 HydrophobicContact CB-CG2 4.25Å; F413-I534 HydrophobicContact CD2-CD1 3.93Å; F413-I534 HydrophobicContact CD2-CG2 3.82Å; F413-I534 HydrophobicContact CE2-CD1 4.05Å; F413-I534 HydrophobicContact CE2-CG2 4.4Å; F413-I534 HydrophobicContact CG-CG2 4.03Å; F413-K538 HydrophobicContact CB-CD 4.09Å; F413-K538 PolarHBondContact O-NZ 3.07Å; F413-V541 HydrophobicContact CE1-CG2 4.3Å; F413-V541 HydrophobicContact CE2-CG2 3.99Å; F413-V541 HydrophobicContact CZ-CG2 3.85Å; F413-T542 WeakPolarHBondContact CZ-O 3.36Å
414	L	97.2	Very high	91.4	Very high	1 Å²	1	61 Å²	61	1%	0.005	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	142.1	176.7	-63.1	176.9	0	0	0	110.9	L378 D382 I389 F412 V416 I435	L378-L414 HydrophobicContact CD1-CD1 3.88Å; L378-L414 HydrophobicContact CD1-CD2 4.3Å; L378-L414 HydrophobicContact CD2-CB 3.89Å; L378-L414 HydrophobicContact CD2-CD1 3.9Å; L378-L414 HydrophobicContact CD2-CG 4.39Å; D382-L414 HydrophobicContact CB-CD2 3.99Å; I389-L414 HydrophobicContact CD1-CD2 4.44Å; F412-L414 HydrophobicContact CD2-CD1 4.09Å; F412-L414 HydrophobicContact CD2-CD2 4.4Å; F412-L414 HydrophobicContact CD2-CG 3.86Å; F412-L414 HydrophobicContact CE2-CD1 3.65Å; F412-L414 HydrophobicContact CE2-CG 3.95Å; L414-V416 HydrophobicContact CB-CG2 4.19Å; L414-V416 PolarHBondContact O-N 2.73Å; L414-I435 PolarHBondContact N-O 2.89Å; L414-I435 PolarHBondContact O-N 3.03Å
415	R	97.4	Very high	91.2	Very high	29 Å²	29	56.8 Å²	56.8	11%	0.109	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	102.1	167.1	-68.9	171	-75.2	-164.4	-11.6	108.6	H379 D382 F432 K433 V434 N537 K538	H379-R415 HydrophobicContact CB-CB 3.58Å; H379-R415 PolarHBondContact N-O 3.42Å; D382-R415 IonicContact OD1-CZ 2.92Å; D382-R415 IonicContact OD1-NE 2.67Å; D382-R415 PolarHBondContact OD1-NE 3.17Å; D382-R415 IonicContact OD1-NH2 2.66Å; D382-R415 PolarHBondContact OD1-NH2 3.38Å; D382-R415 VanDerWaalsContact OD2-CB 3.24Å; D382-R415 WeakPolarHBondContact OD2-CB 3.43Å; D382-R415 WeakPolarHBondContact OD2-CG 3.38Å; D382-R415 IonicContact OD2-CZ 2.71Å; D382-R415 PolarHBondContact OD2-N 2.88Å; D382-R415 IonicContact OD2-NE 3.6Å; D382-R415 PolarHBondContact OD2-NE 3.21Å; D382-R415 IonicContact OD2-NH2 3.28Å; R415-F432 HydrophobicContact CB-CB 4.02Å; R415-K433 WeakPolarHBondContact CA-O 3.48Å; R415-V434 HydrophobicContact CG-CG2 4.3Å; R415-N537 PolarHBondContact NH1-O 2.72Å; R415-K538 HydrophobicContact CG-CB 4.5Å; R415-K538 HydrophobicContact CG-CG 4.49Å
416	V	97.2	Very high	90.8	Very high	2 Å²	2	54.7 Å²	54.7	1%	0.012	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	139.9	-178.7	-166.5	0	0	0	0	109.5	L362 Y377 L378 L414 C418 F432 K433 I435	L362-V416 HydrophobicContact CD1-CB 4.19Å; L362-V416 HydrophobicContact CD1-CG1 3.62Å; L362-V416 HydrophobicContact CD2-CB 4.08Å; L362-V416 HydrophobicContact CD2-CG1 4.25Å; Y377-V416 CarbonylContact O-C 3.59Å; Y377-V416 WeakPolarHBondContact O-CA 3.39Å; L378-V416 HydrophobicContact CD2-CB 4.48Å; L378-V416 HydrophobicContact CD2-CG2 3.89Å; L414-V416 HydrophobicContact CB-CG2 4.19Å; L414-V416 PolarHBondContact O-N 2.73Å; V416-C418 PolarHBondContact O-N 3Å; V416-F432 CarbonylContact O-C 3.59Å; V416-F432 WeakPolarHBondContact O-CA 3.22Å; V416-K433 PolarHBondContact N-O 2.77Å; V416-K433 PolarHBondContact O-N 2.96Å; V416-I435 HydrophobicContact CB-CG1 4.12Å; V416-I435 HydrophobicContact CG2-CB 4.03Å; V416-I435 HydrophobicContact CG2-CG1 3.74Å
417	K	97.4	Very high	90.6	Very high	86 Å²	86	56.7 Å²	56.7	37%	0.374	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-55.4	131	176.7	-177	-177.9	179.2	-174.7	0	110.2	L364 Y377 V419 F432	L364-K417 HydrophobicContact CD1-CB 4.5Å; L364-K417 WeakPolarHBondContact CD1-O 3.24Å; Y377-K417 PolarHBondContact O-N 2.82Å; K417-V419 HydrophobicContact CG-CG1 4.32Å; K417-F432 HydrophobicContact CB-CD1 4.34Å; K417-F432 HydrophobicContact CB-CE1 4.19Å
418	C	95.8	Very high	90.5	Very high	13 Å²	13	55 Å²	55	9%	0.088	28%	0.283	C	S	.	.			trans	-124.7	120.1	179.8	-173.4	0	0	0	0	109.1	L362 V416 T428 G431 K433	L362-C418 HydrophobicContact CD2-CB 4.4Å; L362-C418 CarbonylContact O-C 3.56Å; L362-C418 WeakPolarHBondContact O-CA 3.44Å; V416-C418 PolarHBondContact O-N 3Å; C418-T428 HydrophobicContact CB-CG2 4.05Å; C418-G431 PolarHBondContact N-O 2.83Å; C418-K433 HydrophobicContact CB-CB 3.88Å
419	V	95.4	Very high	90.2	Very high	79 Å²	79	58.4 Å²	58.4	48%	0.479	31%	0.305	S	S	.	.			trans	-108.9	9.4	-179	-58.8	0	0	0	0	112.7	L362 G363 L364 K417	L362-V419 PolarHBondContact O-N 2.85Å; G363-V419 VanDerWaalsContact O-CG2 3.27Å; G363-V419 WeakPolarHBondContact O-CG2 3.37Å; L364-V419 HydrophobicContact CD2-CG1 4.03Å; L364-V419 HydrophobicContact CD2-CG2 3.94Å; K417-V419 HydrophobicContact CG-CG1 4.32Å
420	L	92.4	Very high	89.9	Confident	41 Å²	41	57.9 Å²	57.9	22%	0.215	32%	0.317	C	S	.	.	S	Bend	trans	-66.1	145.4	171	-66	171.6	0	0	0	110.9	V360 L361 A425	V360-L420 WeakPolarHBondContact O-CD1 3.28Å; L361-L420 WeakPolarHBondContact O-CD1 3.34Å; L420-A425 HydrophobicContact CB-CB 3.85Å
421	A	86.6	Confident	89.8	Confident	67 Å²	67	58.2 Å²	58.2	55%	0.554	33%	0.33	S	S	*	.			trans	-59.9	145.2	170.3	0	0	0	0	0	111.1	R423 N424 A425	A421-R423 PolarHBondContact O-N 2.94Å; A421-N424 PolarHBondContact O-N 2.89Å; A421-A425 PolarHBondContact O-N 2.78Å
422	K	80	Confident	89.7	Confident	182 Å²	182	57 Å²	57	79%	0.791	32%	0.316	S	S	*	.	H	α-helix	trans	-49.1	-29.5	-171.6	-171	174.3	-179.9	177.9	0	115.8	N424	K422-N424 VanDerWaalsContact C-N 3.34Å
423	R	78.7	Confident	89.6	Confident	189 Å²	189	57.3 Å²	57.3	71%	0.713	32%	0.318	S	S	*	.	H	α-helix	trans	-73.1	-22.5	177.3	-54	-173.8	-167.6	107.1	0.2	114.2	A421	A421-R423 PolarHBondContact O-N 2.94Å
424	N	77.4	Confident	89.5	Confident	117 Å²	117	57.2 Å²	57.2	63%	0.626	32%	0.318	S	S	*	.	H	α-helix	trans	-115.5	-24.1	-174.1	-60.1	15.3	0	0	0	111.6	A421 K422 G426	A421-N424 PolarHBondContact O-N 2.89Å; K422-N424 VanDerWaalsContact C-N 3.34Å; N424-G426 PolarHBondContact O-N 3.23Å
425	A	78	Confident	89.5	Confident	2 Å²	2	57.1 Å²	57.1	2%	0.017	32%	0.317	C	S	.	.	H	α-helix	trans	-59.4	-30.7	176.7	0	0	0	0	0	112.9	L420 A421 T428 K433	L420-A425 HydrophobicContact CB-CB 3.85Å; A421-A425 PolarHBondContact O-N 2.78Å; A425-T428 HydrophobicContact CB-CG2 3.81Å; A425-K433 WeakPolarHBondContact O-CD 3.47Å; A425-K433 WeakPolarHBondContact O-CE 3.42Å; A425-K433 PolarHBondContact O-NZ 3.36Å
426	G	80.1	Confident	89.5	Confident	21 Å²	21	56.2 Å²	56.2	22%	0.216	31%	0.314	C	S	.	.			trans	74.5	-148	-166.1	0	0	0	0	0	110.6	N424 T428	N424-G426 PolarHBondContact O-N 3.23Å; G426-T428 PolarHBondContact O-N 2.84Å
427	L	84.6	Confident	89.5	Confident	48 Å²	48	56.2 Å²	56.2	25%	0.251	31%	0.314	S	S	.	.	S	Bend	trans	-73.6	125.7	175.4	-174	61	0	0	0	110.9	Q540 T563	L427-Q540 HydrophobicContact CD2-CG 4.12Å; L427-T563 HydrophobicContact CD2-CG2 3.31Å
428	T	88.8	Confident	89.4	Confident	46 Å²	46	54.2 Å²	54.2	28%	0.282	31%	0.308	S	S	.	.			trans	-141.6	144.4	175.3	58.4	0	0	0	0	111	C418 A425 G426 F432 K433	C418-T428 HydrophobicContact CB-CG2 4.05Å; A425-T428 HydrophobicContact CB-CG2 3.81Å; G426-T428 PolarHBondContact O-N 2.84Å; T428-F432 CarbonylContact C-O 3.59Å; T428-F432 WeakPolarHBondContact CA-O 3.21Å; T428-F432 WeakPolarHBondContact CB-O 3.42Å; T428-K433 HydrophobicContact CG2-CB 4.09Å; T428-K433 HydrophobicContact CG2-CG 4.49Å
429	T	87.1	Confident	89.4	Confident	83 Å²	83	54 Å²	54	51%	0.509	31%	0.307	S	S	.	.	B	Isolated β-bridge	trans	-119.5	125.3	175.7	-56.5	0	0	0	0	108.7	G431 F432	T429-G431 PolarHBondContact O-N 3.49Å; T429-G431 VanDerWaalsContact O-N 3.11Å; T429-F432 PolarHBondContact N-O 3.5Å; T429-F432 PolarHBondContact O-N 2.99Å
430	A	88.7	Confident	89.3	Confident	89 Å²	89	54.3 Å²	54.3	74%	0.736	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.2	33.8	-178.6	0	0	0	0	0	115	F432	A430-F432 VanDerWaalsContact O-CD2 3.28Å; A430-F432 WeakPolarHBondContact O-CD2 3.41Å
431	G	92.2	Very high	89.3	Confident	36 Å²	36	52.4 Å²	52.4	37%	0.371	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	80.5	8.1	-177.1	0	0	0	0	0	115.3	C418 T429	C418-G431 PolarHBondContact N-O 2.83Å; T429-G431 PolarHBondContact O-N 3.49Å; T429-G431 VanDerWaalsContact O-N 3.11Å
432	F	94.9	Very high	89.5	Confident	44 Å²	44	51.1 Å²	51.1	19%	0.193	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	147.1	174.2	-61	-94	0	0	0	111.9	H379 R415 V416 K417 T428 T429 A430	H379-F432 HydrophobicContact CB-CD1 3.85Å; H379-F432 HydrophobicContact CB-CE1 3.97Å; H379-F432 HydrophobicContact CB-CG 4.18Å; H379-F432 HydrophobicContact CB-CZ 4.37Å; H379-F432 AromaticContact CD2-CD2 3.72Å; H379-F432 AromaticContact CD2-CE2 3.83Å; H379-F432 VanDerWaalsContact N-CE1 3.33Å; R415-F432 HydrophobicContact CB-CB 4.02Å; V416-F432 CarbonylContact O-C 3.59Å; V416-F432 WeakPolarHBondContact O-CA 3.22Å; K417-F432 HydrophobicContact CB-CD1 4.34Å; K417-F432 HydrophobicContact CB-CE1 4.19Å; T428-F432 CarbonylContact C-O 3.59Å; T428-F432 WeakPolarHBondContact CA-O 3.21Å; T428-F432 WeakPolarHBondContact CB-O 3.42Å; T429-F432 PolarHBondContact N-O 3.5Å; T429-F432 PolarHBondContact O-N 2.99Å; A430-F432 VanDerWaalsContact O-CD2 3.28Å; A430-F432 WeakPolarHBondContact O-CD2 3.41Å
433	K	94.5	Very high	90	Very high	17 Å²	17	42.4 Å²	42.4	7%	0.074	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	138.2	179.1	-172.6	167.4	177.6	171.5	0	109.5	L361 L362 R415 V416 C418 A425 T428 I435	L361-K433 PolarHBondContact O-NZ 3.14Å; L362-K433 HydrophobicContact CD2-CB 4.24Å; L362-K433 HydrophobicContact CD2-CD 4.3Å; R415-K433 WeakPolarHBondContact CA-O 3.48Å; V416-K433 PolarHBondContact N-O 2.77Å; V416-K433 PolarHBondContact O-N 2.96Å; C418-K433 HydrophobicContact CB-CB 3.88Å; A425-K433 WeakPolarHBondContact O-CD 3.47Å; A425-K433 WeakPolarHBondContact O-CE 3.42Å; A425-K433 PolarHBondContact O-NZ 3.36Å; T428-K433 HydrophobicContact CG2-CB 4.09Å; T428-K433 HydrophobicContact CG2-CG 4.49Å; K433-I435 HydrophobicContact CD-CD1 4.4Å; K433-I435 HydrophobicContact CG-CD1 4.18Å; K433-I435 PolarHBondContact O-N 2.87Å
434	V	95.6	Very high	90.4	Very high	9 Å²	9	36.7 Å²	36.7	6%	0.055	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	122.2	176.6	-170.6	0	0	0	0	109.3	F413 R415 I466 K538 Q540	F413-V434 HydrophobicContact CB-CG1 4.44Å; F413-V434 HydrophobicContact CD1-CG1 4.46Å; R415-V434 HydrophobicContact CG-CG2 4.3Å; V434-I466 HydrophobicContact CB-CD1 4.35Å; V434-I466 HydrophobicContact CG1-CD1 3.75Å; V434-K538 HydrophobicContact CG2-CB 4.42Å; V434-K538 WeakPolarHBondContact CG2-O 3.49Å; V434-Q540 HydrophobicContact CB-CB 4.04Å; V434-Q540 HydrophobicContact CB-CG 4.42Å; V434-Q540 HydrophobicContact CG1-CB 4.22Å; V434-Q540 HydrophobicContact CG2-CB 4.05Å; V434-Q540 HydrophobicContact CG2-CG 4.19Å
435	I	96.3	Very high	90.8	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	129.3	178.4	-59.3	-58.9	0	0	0	108.5	F341 L361 L362 F413 L414 V416 K433 A463 Y464 A465	F341-I435 HydrophobicContact CE1-CG2 4.31Å; F341-I435 HydrophobicContact CZ-CG2 4.3Å; L361-I435 HydrophobicContact CD2-CD1 3.91Å; L361-I435 HydrophobicContact CG-CD1 4.42Å; L362-I435 HydrophobicContact CD2-CD1 4.07Å; L362-I435 HydrophobicContact CD2-CG1 4.19Å; F413-I435 WeakPolarHBondContact CA-O 3.44Å; L414-I435 PolarHBondContact N-O 2.89Å; L414-I435 PolarHBondContact O-N 3.03Å; V416-I435 HydrophobicContact CB-CG1 4.12Å; V416-I435 HydrophobicContact CG2-CB 4.03Å; V416-I435 HydrophobicContact CG2-CG1 3.74Å; K433-I435 HydrophobicContact CD-CD1 4.4Å; K433-I435 HydrophobicContact CG-CD1 4.18Å; K433-I435 PolarHBondContact O-N 2.87Å; I435-A463 HydrophobicContact CG2-CB 3.45Å; I435-A463 VanDerWaalsContact CG2-CB 3.45Å; I435-Y464 CarbonylContact C-O 3.57Å; I435-Y464 WeakPolarHBondContact CA-O 3.22Å; I435-A465 HydrophobicContact CD1-CB 4.22Å
436	H	97	Very high	91.1	Very high	10 Å²	10	34.3 Å²	34.3	5%	0.046	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	118.2	170.7	-173.5	-168.3	0	0	0	108.8	S411 F412 F413 N438 A463 Y464 I466	S411-H436 PolarHBondContact OG-NE2 2.87Å; F412-H436 PolarHBondContact O-CD2 3.37Å; F413-H436 HydrophobicContact CD1-CB 3.81Å; F413-H436 AromaticContact CD1-CD2 3.91Å; F413-H436 AromaticContact CD1-CG 3.93Å; F413-H436 HydrophobicContact CE1-CB 3.57Å; F413-H436 AromaticContact CE1-CD2 3.46Å; F413-H436 VanDerWaalsContact CE1-CD2 3.46Å; F413-H436 WeakPolarHBondContact CE1-CD2 3.2Å; F413-H436 AromaticContact CE1-CG 3.34Å; F413-H436 AromaticContact CE1-ND1 3.8Å; F413-H436 AromaticContact CE1-NE2 3.96Å; F413-H436 HydrophobicContact CZ-CB 4.48Å; F413-H436 AromaticContact CZ-CD2 3.52Å; F413-H436 AromaticContact CZ-CE1 3.81Å; F413-H436 AromaticContact CZ-CG 3.77Å; F413-H436 AromaticContact CZ-ND1 3.96Å; F413-H436 AromaticContact CZ-NE2 3.56Å; H436-N438 PolarHBondContact CD2-ND2 3.13Å; H436-N438 VanDerWaalsContact CD2-ND2 3.34Å; H436-N438 PolarHBondContact CE1-ND2 3.05Å; H436-N438 VanDerWaalsContact CE1-ND2 3.34Å; H436-N438 PolarHBondContact NE2-ND2 3.09Å; H436-N438 VanDerWaalsContact NE2-ND2 3.19Å; H436-N438 PolarHBondContact NE2-OD1 3.47Å; H436-A463 WeakPolarHBondContact O-CA 3.44Å; H436-Y464 HydrophobicContact CB-CD1 4.24Å; H436-Y464 HydrophobicContact CB-CE1 3.77Å; H436-Y464 AromaticContact CG-CE1 3.8Å; H436-Y464 AromaticContact CG-CZ 3.99Å; H436-Y464 PolarHBondContact N-O 2.93Å; H436-Y464 AromaticContact ND1-CE1 3.56Å; H436-Y464 AromaticContact ND1-CZ 3.42Å; H436-Y464 PolarHBondContact ND1-OH 2.85Å; H436-Y464 WeakPolarHBondContact O-CD1 3.44Å; H436-Y464 PolarHBondContact O-N 2.87Å; H436-I466 HydrophobicContact CB-CG1 4.34Å
437	C	97.5	Very high	91.3	Very high	1 Å²	1	38.9 Å²	38.9	1%	0.007	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	132.4	179.5	-59.4	0	0	0	0	110	F343 S411 F412 F462	F343-C437 HydrophobicContact CE1-CB 4.42Å; F343-C437 HydrophobicContact CZ-CB 4.4Å; S411-C437 WeakPolarHBondContact CA-O 3.48Å; F412-C437 HydrophobicContact CD1-CB 4.14Å; F412-C437 HydrophobicContact CD2-CB 3.68Å; F412-C437 HydrophobicContact CE1-CB 3.73Å; F412-C437 HydrophobicContact CE2-CB 3.23Å; F412-C437 HydrophobicContact CG-CB 4.12Å; F412-C437 HydrophobicContact CZ-CB 3.25Å; F412-C437 PolarHBondContact N-O 3.24Å; F412-C437 PolarHBondContact O-N 2.87Å; C437-F462 CarbonylContact C-O 3.54Å; C437-F462 WeakPolarHBondContact CA-O 3.39Å
438	N	96	Very high	91.3	Very high	45 Å²	45	41 Å²	41	24%	0.241	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	130.3	174.4	-66.7	-90.9	0	0	0	108.6	R410 S411 H436 S461 F462	R410-N438 CarbonylContact O-C 3.42Å; R410-N438 WeakPolarHBondContact O-CA 3.4Å; S411-N438 WeakPolarHBondContact CB-OD1 3.27Å; S411-N438 PolarHBondContact OG-OD1 3.23Å; H436-N438 PolarHBondContact CD2-ND2 3.13Å; H436-N438 VanDerWaalsContact CD2-ND2 3.34Å; H436-N438 PolarHBondContact CE1-ND2 3.05Å; H436-N438 VanDerWaalsContact CE1-ND2 3.34Å; H436-N438 PolarHBondContact NE2-ND2 3.09Å; H436-N438 VanDerWaalsContact NE2-ND2 3.19Å; H436-N438 PolarHBondContact NE2-OD1 3.47Å; N438-S461 WeakPolarHBondContact O-CA 3.4Å; N438-F462 PolarHBondContact N-O 3.02Å; N438-F462 PolarHBondContact O-N 3.16Å
439	G	95.2	Very high	91.1	Very high	8 Å²	8	46.2 Å²	46.2	8%	0.082	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-176.4	-166.5	-171.2	0	0	0	0	0	114.6	R410 I460	R410-G439 PolarHBondContact N-O 2.82Å; R410-G439 PolarHBondContact O-N 3.04Å; G439-I460 CarbonylContact C-O 3.52Å; G439-I460 WeakPolarHBondContact CA-O 3.37Å
440	H	93.8	Very high	90.7	Very high	86 Å²	86	46 Å²	46	40%	0.398	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	133.6	-176.2	-59.5	90.6	0	0	0	111.7	T407 L408 I460	T407-H440 HydrophobicContact CG2-CB 4.48Å; L408-H440 CarbonylContact O-C 3.5Å; L408-H440 VanDerWaalsContact O-CA 3.26Å; L408-H440 WeakPolarHBondContact O-CA 3.37Å; H440-I460 PolarHBondContact N-O 2.99Å; H440-I460 PolarHBondContact O-N 3.42Å
441	L	93.1	Very high	90.4	Very high	0 Å²	0	49.5 Å²	49.5	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	120.8	165.9	-163.7	70.5	0	0	0	108	L390 V392 T407 L408 R410 N456 L459	L390-L441 HydrophobicContact CD2-CD1 4.23Å; V392-L441 HydrophobicContact CG2-CD2 3.72Å; T407-L441 WeakPolarHBondContact CA-O 3.38Å; L408-L441 HydrophobicContact CB-CB 4.34Å; L408-L441 PolarHBondContact N-O 3.16Å; L408-L441 PolarHBondContact O-N 2.77Å; R410-L441 HydrophobicContact CG-CB 4.32Å; L441-N456 WeakPolarHBondContact CD1-OD1 3.35Å; L441-L459 HydrophobicContact CD1-CB 3.91Å
442	R	90.4	Very high	89.9	Confident	40 Å²	40	52.5 Å²	52.5	15%	0.151	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	129.8	176.6	-82.8	178.4	72.4	-159.4	1.1	110.4	I306 F307 E405 T407 L457 G458 I460	I306-R442 PolarHBondContact O-NH1 2.82Å; I306-R442 PolarHBondContact O-NH2 2.91Å; F307-R442 VanDerWaalsContact CE1-NH1 3.33Å; E405-R442 IonicContact OE1-CZ 3.89Å; E405-R442 VanDerWaalsContact OE1-CZ 3.26Å; E405-R442 IonicContact OE1-NE 3.54Å; E405-R442 PolarHBondContact OE1-NE 3.14Å; E405-R442 IonicContact OE1-NH2 2.62Å; E405-R442 PolarHBondContact OE1-NH2 2.94Å; E405-R442 IonicContact OE2-NH2 2.66Å; T407-R442 HydrophobicContact CG2-CG 3.91Å; R442-L457 HydrophobicContact CB-CB 4Å; R442-L457 HydrophobicContact CB-CD1 4.25Å; R442-L457 PolarHBondContact O-N 2.98Å; R442-G458 PolarHBondContact N-O 2.83Å; R442-I460 HydrophobicContact CG-CD1 4.18Å
443	V	89.4	Confident	89.3	Confident	0 Å²	0	55 Å²	55	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	125.6	-179.8	-172.6	0	0	0	0	109.8	V392 E405 F406 L408 Y454 Q455	V392-V443 HydrophobicContact CG1-CG2 4.33Å; V392-V443 HydrophobicContact CG2-CG2 3.62Å; E405-V443 CarbonylContact C-O 3.52Å; E405-V443 WeakPolarHBondContact CA-O 3.43Å; E405-V443 WeakPolarHBondContact CG-O 3.29Å; F406-V443 HydrophobicContact CD1-CB 4.4Å; F406-V443 HydrophobicContact CD2-CB 4.1Å; F406-V443 HydrophobicContact CD2-CG2 4.48Å; F406-V443 HydrophobicContact CE1-CB 4.06Å; F406-V443 HydrophobicContact CE1-CG1 3.9Å; F406-V443 HydrophobicContact CE2-CB 3.73Å; F406-V443 HydrophobicContact CE2-CG1 4.13Å; F406-V443 HydrophobicContact CE2-CG2 3.96Å; F406-V443 HydrophobicContact CG-CB 4.42Å; F406-V443 HydrophobicContact CZ-CB 3.71Å; F406-V443 HydrophobicContact CZ-CG1 3.61Å; F406-V443 HydrophobicContact CZ-CG2 4.28Å; F406-V443 PolarHBondContact N-O 2.83Å; F406-V443 PolarHBondContact O-N 2.85Å; L408-V443 HydrophobicContact CD1-CG2 4.25Å; V443-Y454 HydrophobicContact CG1-CD1 4.33Å; V443-Q455 WeakPolarHBondContact CA-O 3.43Å
444	R	87.5	Confident	88.9	Confident	69 Å²	69	57.8 Å²	57.8	26%	0.26	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	134.6	173.5	-177.9	175.7	-63.7	147.5	2.1	110.4	E405 I446 Q455 L457	E405-R444 HydrophobicContact CG-CB 4.13Å; E405-R444 IonicContact OE2-CZ 3.2Å; E405-R444 VanDerWaalsContact OE2-CZ 3.24Å; E405-R444 IonicContact OE2-NE 2.69Å; E405-R444 PolarHBondContact OE2-NE 2.9Å; E405-R444 IonicContact OE2-NH2 3.21Å; E405-R444 PolarHBondContact OE2-NH2 3.4Å; R444-I446 HydrophobicContact CG-CG1 4.22Å; R444-Q455 HydrophobicContact CB-CB 4.42Å; R444-Q455 PolarHBondContact N-O 3.26Å; R444-Q455 PolarHBondContact O-N 3.05Å; R444-L457 HydrophobicContact CB-CD1 4.2Å; R444-L457 HydrophobicContact CB-CD2 4.45Å; R444-L457 HydrophobicContact CB-CG 4.35Å
445	V	86.3	Confident	88.4	Confident	14 Å²	14	61.4 Å²	61.4	9%	0.085	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	127.4	170.8	-169.7	0	0	0	0	108.5	Q403 S404 F406 Q452 Y453 Y454	Q403-V445 WeakPolarHBondContact O-CG2 3.36Å; S404-V445 PolarHBondContact O-N 3.33Å; F406-V445 HydrophobicContact CD1-CG2 4.19Å; F406-V445 HydrophobicContact CE1-CG2 3.83Å; V445-Q452 HydrophobicContact CG1-CB 4.26Å; V445-Y453 CarbonylContact C-O 3.55Å; V445-Y453 WeakPolarHBondContact CA-O 3.4Å; V445-Y454 HydrophobicContact CB-CE1 4.49Å; V445-Y454 HydrophobicContact CG1-CE1 4.15Å; V445-Y454 HydrophobicContact CG2-CD1 3.83Å; V445-Y454 HydrophobicContact CG2-CE1 3.63Å
446	I	85.2	Confident	88	Confident	54 Å²	54	62.3 Å²	62.3	28%	0.277	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	120.5	178.2	-51.8	-179.7	0	0	0	108.1	R444 L448 Y453 Q455	R444-I446 HydrophobicContact CG-CG1 4.22Å; I446-L448 HydrophobicContact CG2-CD1 3.84Å; I446-L448 HydrophobicContact CG2-CG 3.93Å; I446-Y453 PolarHBondContact N-O 2.74Å; I446-Y453 PolarHBondContact O-N 3Å; I446-Q455 HydrophobicContact CD1-CB 3.84Å; I446-Q455 HydrophobicContact CD1-CG 4.45Å; I446-Q455 HydrophobicContact CG1-CB 4.36Å
447	H	84.1	Confident	87.6	Confident	117 Å²	117	62.7 Å²	62.7	54%	0.542	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	111.9	175.9	-58.6	73.7	0	0	0	109.2	Y451 Q452	H447-Y451 WeakPolarHBondContact CA-O 3.32Å; H447-Q452 PolarHBondContact NE2-NE2 2.9Å
448	L	83.7	Confident	87.3	Confident	92 Å²	92	62.7 Å²	62.7	48%	0.482	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	128.9	178.6	-78.1	161.8	0	0	0	108.8	I446 G450 Y451 Y453	I446-L448 HydrophobicContact CG2-CD1 3.84Å; I446-L448 HydrophobicContact CG2-CG 3.93Å; L448-G450 PolarHBondContact O-N 2.97Å; L448-Y451 PolarHBondContact N-O 2.95Å; L448-Y451 PolarHBondContact O-N 2.68Å; L448-Y453 HydrophobicContact CB-CD2 3.93Å; L448-Y453 HydrophobicContact CB-CE2 3.76Å; L448-Y453 HydrophobicContact CD1-CD2 4.33Å
449	D	84.4	Confident	87.2	Confident	156 Å²	156	60.6 Å²	60.6	83%	0.834	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.1	30.7	178.4	-55.6	-29.5	0	0	0	115	Y451	D449-Y451 VanDerWaalsContact C-N 3.32Å; D449-Y451 WeakPolarHBondContact O-CD2 3.18Å
450	G	79.3	Confident	87.2	Confident	79 Å²	79	62.3 Å²	62.3	81%	0.814	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	86	-8.8	-177.3	0	0	0	0	0	115.2	L448	L448-G450 PolarHBondContact O-N 2.97Å
451	Y	82.3	Confident	87.3	Confident	162 Å²	162	58.4 Å²	58.4	64%	0.635	29%	0.29	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91.7	149.6	176.2	-62.5	-85.5	0	0	0	111.7	H447 L448 D449	H447-Y451 WeakPolarHBondContact CA-O 3.32Å; L448-Y451 PolarHBondContact N-O 2.95Å; L448-Y451 PolarHBondContact O-N 2.68Å; D449-Y451 VanDerWaalsContact C-N 3.32Å; D449-Y451 WeakPolarHBondContact O-CD2 3.18Å
452	Q	81.1	Confident	87.5	Confident	99 Å²	99	61.4 Å²	61.4	46%	0.463	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	118.6	175.1	-60.6	-168.2	-3	0	0	110	V445 H447 Y454	V445-Q452 HydrophobicContact CG1-CB 4.26Å; H447-Q452 PolarHBondContact NE2-NE2 2.9Å; Q452-Y454 HydrophobicContact CB-CE2 4.3Å; Q452-Y454 PolarHBondContact OE1-OH 3.41Å
453	Y	83.5	Confident	87.7	Confident	98 Å²	98	59.5 Å²	59.5	38%	0.384	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	139.3	176.5	-63.2	-89.2	0	0	0	110.2	V445 I446 L448	V445-Y453 CarbonylContact C-O 3.55Å; V445-Y453 WeakPolarHBondContact CA-O 3.4Å; I446-Y453 PolarHBondContact N-O 2.74Å; I446-Y453 PolarHBondContact O-N 3Å; L448-Y453 HydrophobicContact CB-CD2 3.93Å; L448-Y453 HydrophobicContact CB-CE2 3.76Å; L448-Y453 HydrophobicContact CD1-CD2 4.33Å
454	Y	84.8	Confident	87.9	Confident	74 Å²	74	61.3 Å²	61.3	29%	0.29	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	99.1	-177.8	-61.7	-86.6	0	0	0	109.6	I397 F406 V443 V445 Q452 N456	I397-Y454 HydrophobicContact CB-CE1 4.42Å; I397-Y454 HydrophobicContact CD1-CD1 4.27Å; I397-Y454 HydrophobicContact CD1-CD2 3.94Å; I397-Y454 HydrophobicContact CD1-CE2 4.38Å; I397-Y454 HydrophobicContact CD1-CG 3.9Å; I397-Y454 HydrophobicContact CG1-CD1 3.96Å; I397-Y454 HydrophobicContact CG1-CD2 4.43Å; I397-Y454 HydrophobicContact CG1-CE1 4.16Å; I397-Y454 HydrophobicContact CG1-CG 4.11Å; I397-Y454 HydrophobicContact CG2-CD1 4.25Å; I397-Y454 HydrophobicContact CG2-CD2 4.38Å; I397-Y454 HydrophobicContact CG2-CE1 3.6Å; I397-Y454 HydrophobicContact CG2-CE2 3.78Å; I397-Y454 WeakPolarHBondContact CG2-OH 3.39Å; F406-Y454 HydrophobicContact CE1-CD1 4.08Å; F406-Y454 HydrophobicContact CE1-CE1 4.26Å; F406-Y454 HydrophobicContact CZ-CD1 4.22Å; V443-Y454 HydrophobicContact CG1-CD1 4.33Å; V445-Y454 HydrophobicContact CB-CE1 4.49Å; V445-Y454 HydrophobicContact CG1-CE1 4.15Å; V445-Y454 HydrophobicContact CG2-CD1 3.83Å; V445-Y454 HydrophobicContact CG2-CE1 3.63Å; Q452-Y454 HydrophobicContact CB-CE2 4.3Å; Q452-Y454 PolarHBondContact OE1-OH 3.41Å; Y454-N456 PolarHBondContact O-N 2.67Å
455	Q	86.6	Confident	88.1	Confident	86 Å²	86	59 Å²	59	40%	0.402	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83	104.9	176.9	-175.6	-179.4	51.4	0	0	109.6	V443 R444 I446 L457	V443-Q455 WeakPolarHBondContact CA-O 3.43Å; R444-Q455 HydrophobicContact CB-CB 4.42Å; R444-Q455 PolarHBondContact N-O 3.26Å; R444-Q455 PolarHBondContact O-N 3.05Å; I446-Q455 HydrophobicContact CD1-CB 3.84Å; I446-Q455 HydrophobicContact CD1-CG 4.45Å; I446-Q455 HydrophobicContact CG1-CB 4.36Å; Q455-L457 HydrophobicContact CG-CD2 3.97Å; Q455-L457 PolarHBondContact O-N 3.24Å
456	N	87.8	Confident	88.2	Confident	19 Å²	19	58.7 Å²	58.7	10%	0.102	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.9	117.1	165.2	-178.1	-3.1	0	0	0	109.2	L390 V392 L441 Y454 G458	L390-N456 PolarHBondContact O-ND2 2.97Å; V392-N456 HydrophobicContact CG2-CB 4.37Å; L441-N456 WeakPolarHBondContact CD1-OD1 3.35Å; Y454-N456 PolarHBondContact O-N 2.67Å; N456-G458 WeakPolarHBondContact OD1-CA 3.34Å; N456-G458 PolarHBondContact OD1-N 3.44Å
457	L	86.7	Confident	88	Confident	17 Å²	17	58.2 Å²	58.2	9%	0.089	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	-13.3	179.1	-59.8	179.6	0	0	0	112.6	I306 R442 R444 Q455	I306-L457 WeakPolarHBondContact CD1-O 3.42Å; I306-L457 WeakPolarHBondContact CG1-O 3.23Å; I306-L457 HydrophobicContact CG2-CB 4.3Å; R442-L457 HydrophobicContact CB-CB 4Å; R442-L457 HydrophobicContact CB-CD1 4.25Å; R442-L457 PolarHBondContact O-N 2.98Å; R444-L457 HydrophobicContact CB-CD1 4.2Å; R444-L457 HydrophobicContact CB-CD2 4.45Å; R444-L457 HydrophobicContact CB-CG 4.35Å; Q455-L457 HydrophobicContact CG-CD2 3.97Å; Q455-L457 PolarHBondContact O-N 3.24Å
458	G	91.3	Very high	87.3	Confident	2 Å²	2	53 Å²	53	2%	0.021	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	119.7	169	-178.1	0	0	0	0	0	113.9	V345 R442 N456	V345-G458 CarbonylContact O-C 3.57Å; V345-G458 VanDerWaalsContact O-CA 3.24Å; V345-G458 WeakPolarHBondContact O-CA 3.42Å; R442-G458 PolarHBondContact N-O 2.83Å; N456-G458 WeakPolarHBondContact OD1-CA 3.34Å; N456-G458 PolarHBondContact OD1-N 3.44Å
459	L	95.2	Very high	86.2	Confident	0 Å²	0	50.4 Å²	50.4	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	132.4	179.3	177	66	0	0	0	109.9	F343 I344 V345 I389 L390 R410 F412 L441	F343-L459 HydrophobicContact CE2-CD2 4.31Å; I344-L459 CarbonylContact C-O 3.54Å; I344-L459 VanDerWaalsContact CA-O 3.27Å; I344-L459 WeakPolarHBondContact CA-O 3.45Å; V345-L459 PolarHBondContact N-O 3.35Å; V345-L459 PolarHBondContact O-N 2.94Å; I389-L459 HydrophobicContact CG2-CD2 3.75Å; L390-L459 HydrophobicContact CD2-CB 3.68Å; L390-L459 HydrophobicContact CD2-CD2 4.05Å; R410-L459 HydrophobicContact CB-CD1 4.08Å; R410-L459 HydrophobicContact CG-CD1 4.1Å; F412-L459 HydrophobicContact CE1-CD2 4.11Å; F412-L459 HydrophobicContact CZ-CD2 3.81Å; L441-L459 HydrophobicContact CD1-CB 3.91Å
460	I	95	Very high	84.9	Confident	45 Å²	45	46.9 Å²	46.9	23%	0.231	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	117.4	173.8	-56.5	154.4	0	0	0	107	F307 I344 G439 H440 R442	F307-I460 HydrophobicContact CE1-CD1 4.25Å; F307-I460 HydrophobicContact CZ-CD1 3.6Å; F307-I460 HydrophobicContact CZ-CG1 4.16Å; I344-I460 HydrophobicContact CG1-CG1 4.39Å; I344-I460 HydrophobicContact CG1-CG2 4.38Å; I344-I460 HydrophobicContact CG2-CG1 4.25Å; G439-I460 CarbonylContact C-O 3.52Å; G439-I460 WeakPolarHBondContact CA-O 3.37Å; H440-I460 PolarHBondContact N-O 2.99Å; H440-I460 PolarHBondContact O-N 3.42Å; R442-I460 HydrophobicContact CG-CD1 4.18Å
461	S	95.9	Very high	83.5	Confident	3 Å²	3	45.2 Å²	45.2	2%	0.021	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	142.4	-173.8	-73.4	0	0	0	0	113.1	I342 F343 N438	I342-S461 CarbonylContact C-O 3.6Å; I342-S461 WeakPolarHBondContact CA-O 3.24Å; F343-S461 VanDerWaalsContact CZ-CB 3.44Å; F343-S461 PolarHBondContact N-O 2.99Å; F343-S461 PolarHBondContact O-N 2.9Å; N438-S461 WeakPolarHBondContact O-CA 3.4Å
462	F	96	Very high	81.9	Confident	63 Å²	63	43.1 Å²	43.1	28%	0.276	22%	0.217	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	138.9	157.9	175	-112.1	0	0	0	109.2	M338 F341 I342 C437 N438 Y464	M338-F462 HydrophobicContact CB-CE2 3.84Å; M338-F462 HydrophobicContact CB-CZ 4.24Å; M338-F462 HydrophobicContact CG-CE2 4.09Å; M338-F462 HydrophobicContact SD-CD2 3.82Å; M338-F462 HydrophobicContact SD-CE2 3.76Å; F341-F462 CarbonylContact O-C 3.47Å; F341-F462 WeakPolarHBondContact O-CD2 3.28Å; I342-F462 HydrophobicContact CG1-CD2 4.11Å; C437-F462 CarbonylContact C-O 3.54Å; C437-F462 WeakPolarHBondContact CA-O 3.39Å; N438-F462 PolarHBondContact N-O 3.02Å; N438-F462 PolarHBondContact O-N 3.16Å; F462-Y464 HydrophobicContact CD1-CD1 4.23Å; F462-Y464 AromaticContact CE1-CD1 3.81Å; F462-Y464 HydrophobicContact CE1-CD1 3.81Å; F462-Y464 HydrophobicContact CE1-CG 4.14Å
463	A	96.6	Very high	80.1	Confident	0 Å²	0	43.4 Å²	43.4	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	131	-176.8	0	0	0	0	0	110.3	G340 F341 F343 I435 H436	G340-A463 CarbonylContact C-O 3.49Å; G340-A463 WeakPolarHBondContact CA-O 3.44Å; F341-A463 HydrophobicContact CD1-CB 4.15Å; F341-A463 HydrophobicContact CD2-CB 3.98Å; F341-A463 HydrophobicContact CE1-CB 3.81Å; F341-A463 HydrophobicContact CE2-CB 3.63Å; F341-A463 HydrophobicContact CG-CB 4.24Å; F341-A463 HydrophobicContact CZ-CB 3.53Å; F341-A463 PolarHBondContact N-O 3.3Å; F341-A463 PolarHBondContact O-N 3.39Å; F343-A463 HydrophobicContact CD1-CB 4.02Å; F343-A463 HydrophobicContact CE1-CB 3.76Å; I435-A463 HydrophobicContact CG2-CB 3.45Å; I435-A463 VanDerWaalsContact CG2-CB 3.45Å; H436-A463 WeakPolarHBondContact O-CA 3.44Å
464	Y	93.4	Very high	78.1	Confident	39 Å²	39	44.4 Å²	44.4	15%	0.153	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	160	177.7	70	-76.5	0	0	0	111.4	D339 I435 H436 F462 Y561	D339-Y464 WeakPolarHBondContact O-CB 3.4Å; I435-Y464 CarbonylContact C-O 3.57Å; I435-Y464 WeakPolarHBondContact CA-O 3.22Å; H436-Y464 HydrophobicContact CB-CD1 4.24Å; H436-Y464 HydrophobicContact CB-CE1 3.77Å; H436-Y464 AromaticContact CG-CE1 3.8Å; H436-Y464 AromaticContact CG-CZ 3.99Å; H436-Y464 PolarHBondContact N-O 2.93Å; H436-Y464 AromaticContact ND1-CE1 3.56Å; H436-Y464 AromaticContact ND1-CZ 3.42Å; H436-Y464 PolarHBondContact ND1-OH 2.85Å; H436-Y464 WeakPolarHBondContact O-CD1 3.44Å; H436-Y464 PolarHBondContact O-N 2.87Å; F462-Y464 HydrophobicContact CD1-CD1 4.23Å; F462-Y464 AromaticContact CE1-CD1 3.81Å; F462-Y464 HydrophobicContact CE1-CD1 3.81Å; F462-Y464 HydrophobicContact CE1-CG 4.14Å; Y464-Y561 HydrophobicContact CE2-CE1 4.19Å
465	A	91	Very high	76.5	Confident	21 Å²	21	47.7 Å²	47.7	17%	0.174	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85	142.2	176.1	0	0	0	0	0	109.9	L361 I435 P467	L361-A465 HydrophobicContact CD1-CB 3.79Å; L361-A465 HydrophobicContact CD2-CB 4.11Å; L361-A465 HydrophobicContact CG-CB 4.2Å; I435-A465 HydrophobicContact CD1-CB 4.22Å; A465-P467 VanDerWaalsContact O-CD 3.27Å; A465-P467 WeakPolarHBondContact O-CD 3.48Å
466	I	88.7	Confident	75.2	Confident	7 Å²	7	45.8 Å²	45.8	4%	0.036	25%	0.248	C	C	.	.	P	Polyproline II helix	trans	-68.1	119.5	177.2	-65	169	0	0	0	108.6	F413 V434 H436 S468 Q540 Y561	F413-I466 HydrophobicContact CD1-CD1 3.88Å; F413-I466 HydrophobicContact CE1-CD1 3.88Å; V434-I466 HydrophobicContact CB-CD1 4.35Å; V434-I466 HydrophobicContact CG1-CD1 3.75Å; H436-I466 HydrophobicContact CB-CG1 4.34Å; I466-S468 PolarHBondContact O-N 2.87Å; I466-Q540 HydrophobicContact CB-CB 4.36Å; I466-Q540 HydrophobicContact CD1-CB 3.58Å; I466-Q540 HydrophobicContact CG2-CB 4.28Å; I466-Q540 PolarHBondContact O-NE2 3.31Å; I466-Y561 HydrophobicContact CG2-CD1 4.22Å
467	P	79.7	Confident	74.2	Confident	43 Å²	43	54.4 Å²	54.4	28%	0.279	28%	0.279	S	S	.	.	P	Polyproline II helix	trans	-53.8	130.1	175	-27.2	36.2	0	0	0	111	A465 Y561	A465-P467 VanDerWaalsContact O-CD 3.27Å; A465-P467 WeakPolarHBondContact O-CD 3.48Å; P467-Y561 HydrophobicContact CG-CD1 4.35Å
468	S	70	Confident	73.7	Confident	8 Å²	8	55.8 Å²	55.8	6%	0.056	29%	0.287	C	S	.	.			trans	-132.4	124.6	-173.1	179.4	0	0	0	0	110.2	I466 N470 T471	I466-S468 PolarHBondContact O-N 2.87Å; S468-N470 PolarHBondContact O-N 3.24Å; S468-T471 PolarHBondContact O-N 3.01Å; S468-T471 PolarHBondContact O-OG1 3.33Å
469	P	61.8	Low	73.2	Confident	38 Å²	38	58.3 Å²	58.3	25%	0.247	30%	0.304	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.8	5.9	-178.2	30.7	-35.9	0	0	0	113.8	I476 M484 V577 V579	P469-I476 HydrophobicContact CB-CD1 4.1Å; P469-M484 HydrophobicContact CB-CE 3.64Å; P469-M484 HydrophobicContact CG-CE 4.05Å; P469-V577 HydrophobicContact CG-CB 4.43Å; P469-V577 HydrophobicContact CG-CG1 3.7Å; P469-V579 HydrophobicContact CB-CG2 4.18Å; P469-V579 HydrophobicContact CG-CG2 3.89Å
470	N	56.8	Low	72.5	Confident	82 Å²	82	66 Å²	66	44%	0.439	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	-116.4	26.1	178.9	-162.6	21.7	0	0	0	112.6	S468 I565	S468-N470 PolarHBondContact O-N 3.24Å; N470-I565 HydrophobicContact CB-CD1 3.89Å
471	T	49.5	Very low	72.2	Confident	43 Å²	43	67.5 Å²	67.5	26%	0.264	35%	0.35	S	S	.	.			trans	-78.3	120.9	159	52.6	0	0	0	0	108.6	S468 N473	S468-T471 PolarHBondContact O-N 3.01Å; S468-T471 PolarHBondContact O-OG1 3.33Å; T471-N473 PolarHBondContact O-N 3.49Å; T471-N473 VanDerWaalsContact O-O 3.07Å; T471-N473 PolarHBondContact OG1-O 2.88Å; T471-N473 VanDerWaalsContact OG1-O 3.05Å
472	N	47.8	Very low	71.9	Confident	118 Å²	118	67.7 Å²	67.7	63%	0.631	35%	0.351	S	S	*	.	S	Bend	trans	-74.2	29.6	178.5	53.4	-28.4	0	0	0	113.8
473	N	43.5	Very low	71.7	Confident	106 Å²	106	64.8 Å²	64.8	57%	0.567	34%	0.338	S	S	*	.	S	Bend	trans	-147.7	143.5	163.3	-87.1	-48.8	0	0	0	106.5	T471	T471-N473 PolarHBondContact O-N 3.49Å; T471-N473 VanDerWaalsContact O-O 3.07Å; T471-N473 PolarHBondContact OG1-O 2.88Å; T471-N473 VanDerWaalsContact OG1-O 3.05Å
474	T	41.8	Very low	71.5	Confident	119 Å²	119	66.4 Å²	66.4	73%	0.73	35%	0.346	S	S	*	.	S	Bend	trans	60.1	113.3	-170.3	60.9	0	0	0	0	115.6	I476	T474-I476 PolarHBondContact O-N 3.33Å
475	E	51.5	Low	71.5	Confident	143 Å²	143	64.9 Å²	64.9	67%	0.668	34%	0.34	S	S	*	.			trans	-57.4	129.4	156.9	-51.8	165.3	127.3	0	0	108.5	R477	E475-R477 VanDerWaalsContact C-N 3.27Å; E475-R477 HydrophobicContact CB-CG 4.26Å; E475-R477 PolarHBondContact O-N 3.44Å; E475-R477 IonicContact OE2-CZ 3.54Å; E475-R477 IonicContact OE2-NE 3Å; E475-R477 PolarHBondContact OE2-NE 3.34Å; E475-R477 IonicContact OE2-NH2 2.7Å
476	I	59.9	Low	71.6	Confident	46 Å²	46	70 Å²	70	24%	0.236	36%	0.355	C	S	.	.			trans	-71.4	94.7	159.8	-59.9	-174.3	0	0	0	106.4	P469 T474 L478 M482 V579	P469-I476 HydrophobicContact CB-CD1 4.1Å; T474-I476 PolarHBondContact O-N 3.33Å; I476-L478 HydrophobicContact CG2-CD2 4.05Å; I476-L478 PolarHBondContact O-N 2.83Å; I476-M482 HydrophobicContact CG2-CE 3.69Å; I476-V579 HydrophobicContact CD1-CG2 4.32Å
477	R	66	Low	71.9	Confident	199 Å²	199	69.7 Å²	69.7	75%	0.751	35%	0.354	S	S	*	.			trans	-66.6	99.6	175.5	-69	-177.4	176.5	173.7	-0.9	108.8	E475 S479	E475-R477 VanDerWaalsContact C-N 3.27Å; E475-R477 HydrophobicContact CB-CG 4.26Å; E475-R477 PolarHBondContact O-N 3.44Å; E475-R477 IonicContact OE2-CZ 3.54Å; E475-R477 IonicContact OE2-NE 3Å; E475-R477 PolarHBondContact OE2-NE 3.34Å; E475-R477 IonicContact OE2-NH2 2.7Å; R477-S479 PolarHBondContact O-N 2.84Å
478	L	76.4	Confident	72.6	Confident	47 Å²	47	69.2 Å²	69.2	25%	0.246	35%	0.351	C	S	.	.			trans	-66	90.5	-177.9	-59.4	176.4	0	0	0	110.6	I476 M482 M484 E497 R499 V579	I476-L478 HydrophobicContact CG2-CD2 4.05Å; I476-L478 PolarHBondContact O-N 2.83Å; L478-M482 HydrophobicContact CB-CB 4.34Å; L478-M482 HydrophobicContact CD2-CB 4.15Å; L478-M482 HydrophobicContact CD2-CE 3.96Å; L478-M484 HydrophobicContact CD1-CB 4.22Å; L478-E497 WeakPolarHBondContact CD1-OE2 3.41Å; L478-R499 PolarHBondContact O-NH1 2.97Å; L478-V579 HydrophobicContact CD2-CG1 4.36Å
479	S	79.9	Confident	73.7	Confident	54 Å²	54	70.6 Å²	70.6	38%	0.378	36%	0.358	S	S	.	.			trans	-56.4	161.1	170.3	55.1	0	0	0	0	110.8	R477 D481 M482 R499	R477-S479 PolarHBondContact O-N 2.84Å; S479-D481 WeakPolarHBondContact CB-OD1 3.35Å; S479-D481 PolarHBondContact O-N 2.84Å; S479-D481 PolarHBondContact OG-OD1 2.87Å; S479-M482 WeakPolarHBondContact O-CB 3.49Å; S479-M482 PolarHBondContact O-N 2.92Å; S479-M482 WeakPolarHBondContact OG-CG 3.36Å; S479-M482 PolarHBondContact OG-SD 3.07Å; S479-M482 VanDerWaalsContact OG-SD 3.39Å; S479-R499 PolarHBondContact O-NH1 3.36Å
480	M	81.9	Confident	75.3	Confident	163 Å²	163	70.7 Å²	70.7	80%	0.803	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.6	-25.9	-169.3	-67.6	-64.6	-171.8	0	0	114.3	M482	M480-M482 VanDerWaalsContact C-N 3.33Å
481	D	87.6	Confident	77.2	Confident	76 Å²	76	67.1 Å²	67.1	41%	0.406	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.5	2.1	174.5	61.9	-42.6	0	0	0	114.1	S479 L582	S479-D481 WeakPolarHBondContact CB-OD1 3.35Å; S479-D481 PolarHBondContact O-N 2.84Å; S479-D481 PolarHBondContact OG-OD1 2.87Å; D481-L582 WeakPolarHBondContact O-CB 3.49Å; D481-L582 PolarHBondContact O-N 3.17Å
482	M	90.7	Very high	79.4	Confident	6 Å²	6	68.5 Å²	68.5	3%	0.03	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	153.9	175.3	-60.9	177.3	69.2	0	0	111.6	I476 L478 S479 M480 R499 V579 N580 Y581	I476-M482 HydrophobicContact CG2-CE 3.69Å; L478-M482 HydrophobicContact CB-CB 4.34Å; L478-M482 HydrophobicContact CD2-CB 4.15Å; L478-M482 HydrophobicContact CD2-CE 3.96Å; S479-M482 WeakPolarHBondContact O-CB 3.49Å; S479-M482 PolarHBondContact O-N 2.92Å; S479-M482 WeakPolarHBondContact OG-CG 3.36Å; S479-M482 PolarHBondContact OG-SD 3.07Å; S479-M482 VanDerWaalsContact OG-SD 3.39Å; M480-M482 VanDerWaalsContact C-N 3.33Å; M482-R499 WeakPolarHBondContact O-CD 3.39Å; M482-R499 PolarHBondContact O-NH1 3.42Å; M482-V579 HydrophobicContact CE-CG1 3.24Å; M482-N580 CarbonylContact C-O 3.58Å; M482-N580 VanDerWaalsContact CA-O 3.29Å; M482-N580 WeakPolarHBondContact CA-O 3.32Å; M482-Y581 HydrophobicContact CE-CD1 4.44Å; M482-Y581 HydrophobicContact CE-CE1 3.72Å; M482-Y581 HydrophobicContact CE-CE2 3.85Å; M482-Y581 WeakPolarHBondContact CE-OH 3.42Å; M482-Y581 HydrophobicContact CG-CD1 3.76Å; M482-Y581 HydrophobicContact CG-CE1 3.77Å; M482-Y581 HydrophobicContact CG-CG 4.36Å; M482-Y581 HydrophobicContact SD-CD1 4.21Å; M482-Y581 HydrophobicContact SD-CE1 3.57Å; M482-Y581 VanDerWaalsContact SD-CE1 3.57Å
483	F	91.3	Very high	81.7	Confident	3 Å²	3	63 Å²	63	1%	0.013	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151	156.9	162.7	70.6	-84.8	0	0	0	112.2	F485 E497 I500 I503 L548 I558 N580	F483-F485 HydrophobicContact CE2-CD1 4.22Å; F483-E497 WeakPolarHBondContact CA-OE2 3.46Å; F483-I500 HydrophobicContact CD2-CD1 4.12Å; F483-I500 HydrophobicContact CE1-CD1 4.44Å; F483-I500 HydrophobicContact CE2-CD1 3.62Å; F483-I500 HydrophobicContact CZ-CD1 3.8Å; F483-I503 HydrophobicContact CB-CD1 4.41Å; F483-I503 HydrophobicContact CD1-CD1 3.51Å; F483-I503 HydrophobicContact CE1-CD1 4.03Å; F483-I503 HydrophobicContact CG-CD1 4.16Å; F483-L548 HydrophobicContact CZ-CD2 4.44Å; F483-I558 HydrophobicContact CE1-CD1 3.79Å; F483-I558 HydrophobicContact CZ-CD1 3.87Å; F483-N580 HydrophobicContact CD1-CB 4.01Å; F483-N580 HydrophobicContact CD2-CB 4.33Å; F483-N580 HydrophobicContact CE1-CB 3.63Å; F483-N580 HydrophobicContact CE2-CB 3.96Å; F483-N580 HydrophobicContact CG-CB 4.35Å; F483-N580 HydrophobicContact CZ-CB 3.6Å; F483-N580 PolarHBondContact N-O 2.97Å; F483-N580 WeakPolarHBondContact O-CB 3.14Å; F483-N580 PolarHBondContact O-N 2.58Å; F483-N580 PolarHBondContact O-ND2 2.88Å
484	M	92.2	Very high	84.1	Confident	34 Å²	34	62.4 Å²	62.4	17%	0.167	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	146.5	176.9	-165.2	-179.1	-67.3	0	0	113.4	P469 L478 E497 V577 S578 V579	P469-M484 HydrophobicContact CB-CE 3.64Å; P469-M484 HydrophobicContact CG-CE 4.05Å; L478-M484 HydrophobicContact CD1-CB 4.22Å; M484-E497 PolarHBondContact N-OE2 2.95Å; M484-E497 WeakPolarHBondContact O-CB 3.38Å; M484-E497 PolarHBondContact O-N 3.08Å; M484-V577 HydrophobicContact CE-CG1 4.47Å; M484-V577 HydrophobicContact CG-CG1 3.96Å; M484-V577 HydrophobicContact SD-CG1 3.61Å; M484-S578 WeakPolarHBondContact CA-O 3.34Å; M484-S578 WeakPolarHBondContact CG-O 3.35Å; M484-V579 HydrophobicContact CE-CG2 4.25Å
485	F	93.1	Very high	86.5	Confident	6 Å²	6	61.4 Å²	61.4	3%	0.026	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	158.1	159.5	71.9	-108.2	0	0	0	112	F483 A487 L493 F495 L496 L516 S578 N580	F483-F485 HydrophobicContact CE2-CD1 4.22Å; F485-A487 HydrophobicContact CD2-CB 4.17Å; F485-A487 HydrophobicContact CE2-CB 4.05Å; F485-L493 HydrophobicContact CB-CD2 4.33Å; F485-L493 HydrophobicContact CD1-CD2 4.49Å; F485-L493 HydrophobicContact CD2-CD2 3.64Å; F485-L493 HydrophobicContact CE2-CD2 4.01Å; F485-L493 HydrophobicContact CG-CD2 3.93Å; F485-F495 CarbonylContact C-O 3.57Å; F485-F495 VanDerWaalsContact CA-O 3.27Å; F485-F495 WeakPolarHBondContact CA-O 3.21Å; F485-F495 WeakPolarHBondContact CB-O 3.38Å; F485-L496 HydrophobicContact CB-CG 4.08Å; F485-L516 HydrophobicContact CE1-CD2 4.35Å; F485-L516 HydrophobicContact CZ-CD2 3.83Å; F485-S578 VanDerWaalsContact CE2-CB 3.48Å; F485-S578 PolarHBondContact N-O 3.03Å; F485-S578 PolarHBondContact O-N 3.48Å; F485-N580 VanDerWaalsContact CD1-ND2 3.26Å; F485-N580 WeakPolarHBondContact CD1-ND2 3.42Å; F485-N580 WeakPolarHBondContact CE1-OD1 3.08Å
486	R	93.5	Very high	88.4	Confident	130 Å²	130	55.1 Å²	55.1	49%	0.491	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	141.3	166.2	-50.2	-176.6	175.4	158.6	-1.5	109.8	I494 F495 V576 V577	R486-I494 PolarHBondContact O-N 2.99Å; R486-F495 HydrophobicContact CB-CB 4.1Å; R486-F495 HydrophobicContact CG-CB 4.27Å; R486-F495 HydrophobicContact CG-CD1 4.19Å; R486-F495 PolarHBondContact N-O 2.91Å; R486-F495 PolarHBondContact O-N 2.92Å; R486-F495 VanDerWaalsContact O-N 3.11Å; R486-V576 CarbonylContact C-O 3.6Å; R486-V576 VanDerWaalsContact CA-O 3.29Å; R486-V576 WeakPolarHBondContact CA-O 3.19Å; R486-V577 HydrophobicContact CG-CG2 4.15Å
487	A	94.9	Very high	89.9	Confident	0 Å²	0	54.7 Å²	54.7	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	165	-179.6	0	0	0	0	0	111.4	F485 K492 L493 C575 V576	F485-A487 HydrophobicContact CD2-CB 4.17Å; F485-A487 HydrophobicContact CE2-CB 4.05Å; A487-K492 CarbonylContact C-O 3.6Å; A487-K492 WeakPolarHBondContact CA-O 3.33Å; A487-K492 VanDerWaalsContact CB-O 3.23Å; A487-K492 WeakPolarHBondContact CB-O 3.43Å; A487-L493 HydrophobicContact CB-CD2 4.49Å; A487-C575 CarbonylContact O-C 3.55Å; A487-C575 WeakPolarHBondContact O-CA 3.5Å; A487-V576 HydrophobicContact CB-CB 4.36Å; A487-V576 PolarHBondContact N-O 2.99Å; A487-V576 PolarHBondContact O-N 2.87Å
488	S	94.2	Very high	91	Very high	32 Å²	32	47.5 Å²	47.5	22%	0.224	25%	0.248	C	C	.	.			trans	-80.5	175.4	166.6	36.7	0	0	0	0	112	D490 L491 K492	S488-D490 VanDerWaalsContact CB-OD1 3.3Å; S488-D490 WeakPolarHBondContact CB-OD1 3.3Å; S488-D490 PolarHBondContact O-N 2.84Å; S488-D490 PolarHBondContact OG-OD1 3.32Å; S488-L491 PolarHBondContact O-N 3.06Å; S488-K492 PolarHBondContact N-O 3.48Å; S488-K492 PolarHBondContact OG-O 2.79Å
489	L	94.5	Very high	91.6	Very high	38 Å²	38	47.6 Å²	47.6	20%	0.199	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.5	8.5	-178.6	-57.5	-176.1	0	0	0	115.2	H532 L536 I564 N574 V576	L489-H532 PolarHBondContact O-NE2 2.87Å; L489-L536 HydrophobicContact CB-CD2 4.02Å; L489-L536 HydrophobicContact CD2-CD2 4.27Å; L489-I564 HydrophobicContact CD2-CD1 3.99Å; L489-I564 HydrophobicContact CD2-CG1 4.24Å; L489-I564 HydrophobicContact CD2-CG2 4.03Å; L489-N574 HydrophobicContact CD1-CB 4.12Å; L489-N574 HydrophobicContact CD2-CB 4.14Å; L489-N574 HydrophobicContact CG-CB 4.36Å; L489-V576 HydrophobicContact CD2-CG2 4.27Å
490	D	94.7	Very high	92	Very high	39 Å²	39	45.1 Å²	45.1	21%	0.209	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	-114.4	5.5	172.4	61.4	-12.3	0	0	0	112.1	S488 K492 L770 T774	S488-D490 VanDerWaalsContact CB-OD1 3.3Å; S488-D490 WeakPolarHBondContact CB-OD1 3.3Å; S488-D490 PolarHBondContact O-N 2.84Å; S488-D490 PolarHBondContact OG-OD1 3.32Å; D490-K492 PolarHBondContact O-N 2.89Å; D490-K492 WeakPolarHBondContact OD1-CB 3.31Å; D490-K492 PolarHBondContact OD1-N 2.89Å; D490-K492 WeakPolarHBondContact OD2-CB 3.46Å; D490-L770 HydrophobicContact CB-CD2 4.24Å; D490-T774 HydrophobicContact CB-CG2 3.97Å; D490-T774 WeakPolarHBondContact O-CG2 3.41Å
491	L	96.1	Very high	92.5	Very high	7 Å²	7	38.6 Å²	38.6	4%	0.037	20%	0.197	C	C	.	.			trans	58.3	24.5	-169.5	-59.3	174.4	0	0	0	114.3	S488 T515 L516 H532 V576	S488-L491 PolarHBondContact O-N 3.06Å; L491-T515 CarbonylContact O-C 3.55Å; L491-T515 WeakPolarHBondContact O-CA 3.42Å; L491-L516 HydrophobicContact CB-CB 4.06Å; L491-L516 HydrophobicContact CD1-CD2 4.37Å; L491-L516 PolarHBondContact O-N 3.05Å; L491-H532 HydrophobicContact CD1-CB 4.02Å; L491-H532 WeakPolarHBondContact CD1-ND1 3.49Å; L491-V576 HydrophobicContact CD2-CG1 4.24Å; L491-V576 HydrophobicContact CD2-CG2 4.39Å
492	K	96.2	Very high	92.5	Very high	72 Å²	72	42.7 Å²	42.7	31%	0.313	21%	0.214	S	C	.	.	B	Isolated β-bridge	trans	-71.8	124.9	163.4	-174.1	-171.6	169.9	-163.5	0	109.5	A487 S488 D490 D513 T515	A487-K492 CarbonylContact C-O 3.6Å; A487-K492 WeakPolarHBondContact CA-O 3.33Å; A487-K492 VanDerWaalsContact CB-O 3.23Å; A487-K492 WeakPolarHBondContact CB-O 3.43Å; S488-K492 PolarHBondContact N-O 3.48Å; S488-K492 PolarHBondContact OG-O 2.79Å; D490-K492 PolarHBondContact O-N 2.89Å; D490-K492 WeakPolarHBondContact OD1-CB 3.31Å; D490-K492 PolarHBondContact OD1-N 2.89Å; D490-K492 WeakPolarHBondContact OD2-CB 3.46Å; K492-D513 VanDerWaalsContact CE-CA 3.45Å; K492-D513 VanDerWaalsContact CE-O 3.28Å; K492-D513 WeakPolarHBondContact CE-O 3.29Å; K492-D513 WeakPolarHBondContact CE-OD1 3.47Å; K492-D513 WeakPolarHBondContact CG-O 3.47Å; K492-D513 IonicContact NZ-OD1 2.68Å; K492-D513 PolarHBondContact NZ-OD1 3.38Å; K492-T515 HydrophobicContact CB-CG2 4Å
493	L	95.3	Very high	92.2	Very high	2 Å²	2	43 Å²	43	1%	0.01	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	129.1	-171.1	-64	163.3	0	0	0	111	F485 A487 L496 L511 D513 K514 L519	F485-L493 HydrophobicContact CB-CD2 4.33Å; F485-L493 HydrophobicContact CD1-CD2 4.49Å; F485-L493 HydrophobicContact CD2-CD2 3.64Å; F485-L493 HydrophobicContact CE2-CD2 4.01Å; F485-L493 HydrophobicContact CG-CD2 3.93Å; A487-L493 HydrophobicContact CB-CD2 4.49Å; L493-L496 HydrophobicContact CB-CD1 4.06Å; L493-L496 HydrophobicContact CD1-CD1 4.45Å; L493-L496 HydrophobicContact CD1-CD2 4.29Å; L493-L511 WeakPolarHBondContact CB-O 3.45Å; L493-L511 HydrophobicContact CD1-CB 4.31Å; L493-L511 WeakPolarHBondContact CD1-O 3.27Å; L493-D513 PolarHBondContact O-N 3.31Å; L493-K514 WeakPolarHBondContact CB-O 3.44Å; L493-K514 WeakPolarHBondContact CG-O 3.43Å; L493-K514 PolarHBondContact N-O 3.24Å; L493-L519 HydrophobicContact CD1-CD1 3.73Å
494	I	93.6	Very high	92	Very high	95 Å²	95	43 Å²	43	49%	0.487	22%	0.216	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	-38.1	-178.4	-59.1	173.2	0	0	0	110.5	R486	R486-I494 PolarHBondContact O-N 2.99Å
495	F	93.2	Very high	91.9	Very high	98 Å²	98	42.7 Å²	42.7	43%	0.43	22%	0.222	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-147	140.2	-179.3	170.2	-87	0	0	0	109.7	F485 R486	F485-F495 CarbonylContact C-O 3.57Å; F485-F495 VanDerWaalsContact CA-O 3.27Å; F485-F495 WeakPolarHBondContact CA-O 3.21Å; F485-F495 WeakPolarHBondContact CB-O 3.38Å; R486-F495 HydrophobicContact CB-CB 4.1Å; R486-F495 HydrophobicContact CG-CB 4.27Å; R486-F495 HydrophobicContact CG-CD1 4.19Å; R486-F495 PolarHBondContact N-O 2.91Å; R486-F495 PolarHBondContact O-N 2.92Å; R486-F495 VanDerWaalsContact O-N 3.11Å
496	L	92.4	Very high	91.7	Very high	10 Å²	10	42.7 Å²	42.7	5%	0.052	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	140.6	169.9	-58.2	92.9	0	0	0	109.6	F485 L493 I500 P508 L511 V512	F485-L496 HydrophobicContact CB-CG 4.08Å; L493-L496 HydrophobicContact CB-CD1 4.06Å; L493-L496 HydrophobicContact CD1-CD1 4.45Å; L493-L496 HydrophobicContact CD1-CD2 4.29Å; L496-I500 HydrophobicContact CB-CG2 4.2Å; L496-I500 HydrophobicContact CD2-CD1 4.49Å; L496-I500 HydrophobicContact CD2-CG1 3.96Å; L496-P508 HydrophobicContact CB-CB 4.34Å; L496-L511 HydrophobicContact CD1-CB 3.87Å; L496-L511 HydrophobicContact CD2-CB 4.01Å; L496-L511 HydrophobicContact CD2-CD1 3.78Å; L496-V512 HydrophobicContact CD1-CG2 4.03Å
497	E	90.6	Very high	91.7	Very high	37 Å²	37	41 Å²	41	17%	0.173	22%	0.22	C	C	.	.			trans	-61.7	136.7	170.9	-174.9	-173.9	160.9	0	0	111.2	L478 F483 M484 R499 I500	L478-E497 WeakPolarHBondContact CD1-OE2 3.41Å; F483-E497 WeakPolarHBondContact CA-OE2 3.46Å; M484-E497 PolarHBondContact N-OE2 2.95Å; M484-E497 WeakPolarHBondContact O-CB 3.38Å; M484-E497 PolarHBondContact O-N 3.08Å; E497-R499 HydrophobicContact CG-CB 4.19Å; E497-R499 PolarHBondContact O-N 3.19Å; E497-R499 IonicContact OE1-CZ 3.27Å; E497-R499 IonicContact OE1-NE 2.79Å; E497-R499 PolarHBondContact OE1-NE 2.87Å; E497-R499 VanDerWaalsContact OE1-NE 3.13Å; E497-R499 IonicContact OE1-NH2 2.66Å; E497-R499 PolarHBondContact OE1-NH2 3.24Å; E497-R499 VanDerWaalsContact OE1-NH2 3.11Å; E497-I500 WeakPolarHBondContact O-CB 3.41Å; E497-I500 VanDerWaalsContact O-CG2 3.3Å; E497-I500 WeakPolarHBondContact O-CG2 3.47Å; E497-I500 PolarHBondContact O-N 3.07Å
498	G	89.6	Confident	91.6	Very high	49 Å²	49	41.9 Å²	41.9	51%	0.505	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.2	-13.5	-177.2	0	0	0	0	0	115.8	I500 S501	G498-I500 PolarHBondContact O-N 3.49Å; G498-S501 PolarHBondContact O-N 3.48Å; G498-S501 PolarHBondContact O-OG 3.01Å
499	R	87.4	Confident	91.5	Very high	48 Å²	48	47.6 Å²	47.6	18%	0.181	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.1	-24.2	170.7	-162.2	176.7	-57.9	178.8	0.5	112.9	L478 S479 M482 E497 S501 Q502 I503	L478-R499 PolarHBondContact O-NH1 2.97Å; S479-R499 PolarHBondContact O-NH1 3.36Å; M482-R499 WeakPolarHBondContact O-CD 3.39Å; M482-R499 PolarHBondContact O-NH1 3.42Å; E497-R499 HydrophobicContact CG-CB 4.19Å; E497-R499 PolarHBondContact O-N 3.19Å; E497-R499 IonicContact OE1-CZ 3.27Å; E497-R499 IonicContact OE1-NE 2.79Å; E497-R499 PolarHBondContact OE1-NE 2.87Å; E497-R499 VanDerWaalsContact OE1-NE 3.13Å; E497-R499 IonicContact OE1-NH2 2.66Å; E497-R499 PolarHBondContact OE1-NH2 3.24Å; E497-R499 VanDerWaalsContact OE1-NH2 3.11Å; R499-S501 PolarHBondContact O-N 3.18Å; R499-S501 VanDerWaalsContact O-N 3.11Å; R499-Q502 WeakPolarHBondContact O-CB 3.36Å; R499-Q502 PolarHBondContact O-N 2.81Å; R499-I503 HydrophobicContact CG-CD1 4.26Å; R499-I503 PolarHBondContact O-N 3.05Å
500	I	89.9	Confident	91.4	Very high	3 Å²	3	48.7 Å²	48.7	2%	0.015	25%	0.252	C	S	.	.	H	α-helix	trans	-55.1	-31.4	179.8	-163.7	63.6	0	0	0	113.1	F483 L496 E497 G498 Q502 I503 T504 P508 L511 L548	F483-I500 HydrophobicContact CD2-CD1 4.12Å; F483-I500 HydrophobicContact CE1-CD1 4.44Å; F483-I500 HydrophobicContact CE2-CD1 3.62Å; F483-I500 HydrophobicContact CZ-CD1 3.8Å; L496-I500 HydrophobicContact CB-CG2 4.2Å; L496-I500 HydrophobicContact CD2-CD1 4.49Å; L496-I500 HydrophobicContact CD2-CG1 3.96Å; E497-I500 WeakPolarHBondContact O-CB 3.41Å; E497-I500 VanDerWaalsContact O-CG2 3.3Å; E497-I500 WeakPolarHBondContact O-CG2 3.47Å; E497-I500 PolarHBondContact O-N 3.07Å; G498-I500 PolarHBondContact O-N 3.49Å; I500-Q502 VanDerWaalsContact C-N 3.3Å; I500-Q502 PolarHBondContact O-N 3.34Å; I500-I503 PolarHBondContact O-N 3.24Å; I500-T504 HydrophobicContact CD1-CG2 3.6Å; I500-T504 HydrophobicContact CG1-CG2 4.13Å; I500-T504 PolarHBondContact O-N 3.2Å; I500-T504 PolarHBondContact O-OG1 3.21Å; I500-P508 HydrophobicContact CG2-CB 4.47Å; I500-P508 HydrophobicContact CG2-CG 3.8Å; I500-L511 HydrophobicContact CG1-CD1 3.79Å; I500-L548 HydrophobicContact CD1-CD2 4.3Å
501	S	91.7	Very high	91.3	Very high	25 Å²	25	46.9 Å²	46.9	18%	0.175	24%	0.242	C	C	.	.	H	α-helix	trans	-64.2	-32.8	177	-42.9	0	0	0	0	113.2	G498 R499 G505 F506 Q507	G498-S501 PolarHBondContact O-N 3.48Å; G498-S501 PolarHBondContact O-OG 3.01Å; R499-S501 PolarHBondContact O-N 3.18Å; R499-S501 VanDerWaalsContact O-N 3.11Å; S501-G505 VanDerWaalsContact O-CA 3.25Å; S501-G505 WeakPolarHBondContact O-CA 3.28Å; S501-G505 PolarHBondContact O-N 3.33Å; S501-G505 VanDerWaalsContact O-N 3.08Å; S501-F506 WeakPolarHBondContact CA-O 3.49Å; S501-F506 PolarHBondContact N-O 3.44Å; S501-F506 PolarHBondContact OG-O 3.22Å; S501-Q507 PolarHBondContact OG-OE1 3.33Å
502	Q	87	Confident	91.1	Very high	163 Å²	163	48.9 Å²	48.9	76%	0.762	26%	0.255	S	S	*	.	H	α-helix	trans	-78	-33.2	178.9	-57.8	179.1	3.1	0	0	111.4	R499 I500	R499-Q502 WeakPolarHBondContact O-CB 3.36Å; R499-Q502 PolarHBondContact O-N 2.81Å; I500-Q502 VanDerWaalsContact C-N 3.3Å; I500-Q502 PolarHBondContact O-N 3.34Å
503	I	86	Confident	90.9	Very high	13 Å²	13	50.6 Å²	50.6	7%	0.067	27%	0.268	C	S	.	.	H	α-helix	trans	-81.3	-45	-177.4	-59.4	173.7	0	0	0	111.3	F483 R499 I500 N550 V556 L582	F483-I503 HydrophobicContact CB-CD1 4.41Å; F483-I503 HydrophobicContact CD1-CD1 3.51Å; F483-I503 HydrophobicContact CE1-CD1 4.03Å; F483-I503 HydrophobicContact CG-CD1 4.16Å; R499-I503 HydrophobicContact CG-CD1 4.26Å; R499-I503 PolarHBondContact O-N 3.05Å; I500-I503 PolarHBondContact O-N 3.24Å; I503-N550 PolarHBondContact O-ND2 3.46Å; I503-V556 HydrophobicContact CG2-CG1 4.36Å; I503-V556 HydrophobicContact CG2-CG2 3.85Å; I503-L582 HydrophobicContact CD1-CD2 4.3Å; I503-L582 HydrophobicContact CG1-CD2 4.15Å; I503-L582 HydrophobicContact CG2-CD1 3.76Å; I503-L582 HydrophobicContact CG2-CD2 4.22Å
504	T	86.5	Confident	90.8	Very high	2 Å²	2	53 Å²	53	1%	0.012	28%	0.278	C	S	.	.	H	α-helix	trans	-114.4	-10.8	-168.7	68.4	0	0	0	0	114.5	I500 F506 L548 N550 K551	I500-T504 HydrophobicContact CD1-CG2 3.6Å; I500-T504 HydrophobicContact CG1-CG2 4.13Å; I500-T504 PolarHBondContact O-N 3.2Å; I500-T504 PolarHBondContact O-OG1 3.21Å; T504-F506 PolarHBondContact O-N 3.38Å; T504-F506 PolarHBondContact OG1-N 3.23Å; T504-L548 HydrophobicContact CG2-CD2 3.58Å; T504-L548 HydrophobicContact CG2-CG 4.35Å; T504-N550 WeakPolarHBondContact CA-ND2 3.28Å; T504-N550 CarbonylContact O-C 3.59Å; T504-N550 WeakPolarHBondContact O-CA 3.26Å; T504-N550 VanDerWaalsContact O-CG 3.28Å; T504-N550 PolarHBondContact O-ND2 3.39Å; T504-N550 PolarHBondContact O-OD1 3.33Å; T504-K551 WeakPolarHBondContact O-CB 3.48Å; T504-K551 PolarHBondContact O-N 2.82Å
505	G	88.9	Confident	90.9	Very high	28 Å²	28	49.6 Å²	49.6	29%	0.289	26%	0.262	S	S	.	.	S	Bend	trans	75.6	-9.4	-173.8	0	0	0	0	0	115.4	S501 K551	S501-G505 VanDerWaalsContact O-CA 3.25Å; S501-G505 WeakPolarHBondContact O-CA 3.28Å; S501-G505 PolarHBondContact O-N 3.33Å; S501-G505 VanDerWaalsContact O-N 3.08Å; G505-K551 VanDerWaalsContact O-CD 3.3Å; G505-K551 WeakPolarHBondContact O-CD 3.45Å
506	F	89.8	Confident	91	Very high	6 Å²	6	45.3 Å²	45.3	3%	0.026	24%	0.243	C	C	.	.			trans	-89.4	134.5	174.3	-65.4	-78.7	0	0	0	111.6	S501 T504 E510 L511 L519 K551 L594	S501-F506 WeakPolarHBondContact CA-O 3.49Å; S501-F506 PolarHBondContact N-O 3.44Å; S501-F506 PolarHBondContact OG-O 3.22Å; T504-F506 PolarHBondContact O-N 3.38Å; T504-F506 PolarHBondContact OG1-N 3.23Å; F506-E510 HydrophobicContact CB-CB 4.43Å; F506-E510 HydrophobicContact CD1-CB 4.25Å; F506-L511 HydrophobicContact CB-CD1 3.75Å; F506-L511 HydrophobicContact CB-CD2 3.75Å; F506-L511 HydrophobicContact CB-CG 3.66Å; F506-L511 HydrophobicContact CD1-CD2 3.95Å; F506-L511 HydrophobicContact CD2-CD1 4.4Å; F506-L511 HydrophobicContact CD2-CD2 3.88Å; F506-L511 HydrophobicContact CE1-CD2 4.45Å; F506-L511 HydrophobicContact CE2-CD2 4.38Å; F506-L511 HydrophobicContact CG-CD1 4.33Å; F506-L511 HydrophobicContact CG-CD2 3.63Å; F506-L511 HydrophobicContact CG-CG 4.13Å; F506-L519 HydrophobicContact CE2-CD2 4.43Å; F506-K551 HydrophobicContact CD1-CB 3.95Å; F506-K551 HydrophobicContact CD1-CD 3.73Å; F506-K551 HydrophobicContact CD1-CG 3.91Å; F506-K551 HydrophobicContact CD2-CB 3.93Å; F506-K551 HydrophobicContact CE1-CB 3.9Å; F506-K551 HydrophobicContact CE1-CD 4.08Å; F506-K551 HydrophobicContact CE1-CG 3.78Å; F506-K551 HydrophobicContact CE2-CB 3.89Å; F506-K551 HydrophobicContact CG-CB 3.98Å; F506-K551 HydrophobicContact CG-CD 4.24Å; F506-K551 HydrophobicContact CG-CG 4.41Å; F506-K551 HydrophobicContact CZ-CB 3.89Å; F506-K551 HydrophobicContact CZ-CG 4.19Å; F506-L594 HydrophobicContact CE2-CD1 3.99Å; F506-L594 HydrophobicContact CZ-CD1 3.56Å; F506-L594 HydrophobicContact CZ-CD2 4.06Å; F506-L594 HydrophobicContact CZ-CG 4.45Å
507	Q	92.6	Very high	91.1	Very high	95 Å²	95	45.5 Å²	45.5	44%	0.444	24%	0.243	S	C	.	.			trans	-69.5	151.2	167	-53.9	-60.4	-19	0	0	110.8	S501 Q509 E510	S501-Q507 PolarHBondContact OG-OE1 3.33Å; Q507-Q509 PolarHBondContact O-N 3.32Å; Q507-Q509 VanDerWaalsContact O-N 3.12Å; Q507-E510 HydrophobicContact CB-CG 4.22Å; Q507-E510 PolarHBondContact N-OE1 3.02Å; Q507-E510 WeakPolarHBondContact O-CB 3.48Å; Q507-E510 PolarHBondContact O-N 3.14Å
508	P	93.3	Very high	91.2	Very high	17 Å²	17	48.1 Å²	48.1	11%	0.11	26%	0.256	C	S	.	.	G	3₁₀ helix	trans	-49.8	-40.2	178	-28.8	33.8	0	0	0	113.6	L496 I500 E510 L511 V512	L496-P508 HydrophobicContact CB-CB 4.34Å; I500-P508 HydrophobicContact CG2-CB 4.47Å; I500-P508 HydrophobicContact CG2-CG 3.8Å; P508-E510 PolarHBondContact O-N 3.3Å; P508-L511 PolarHBondContact O-N 3.01Å; P508-V512 WeakPolarHBondContact O-CG2 3.26Å; P508-V512 PolarHBondContact O-N 3.15Å
509	Q	92.9	Very high	91.3	Very high	153 Å²	153	46.2 Å²	46.2	72%	0.715	23%	0.234	S	C	*	.	G	3₁₀ helix	trans	-66.9	-18.7	-179.8	-57.3	81.6	-0.9	0	0	113.3	Q507 L511	Q507-Q509 PolarHBondContact O-N 3.32Å; Q507-Q509 VanDerWaalsContact O-N 3.12Å; Q509-L511 VanDerWaalsContact C-N 3.34Å
510	E	91.8	Very high	91.7	Very high	60 Å²	60	44 Å²	44	28%	0.28	23%	0.226	S	C	.	.	G	3₁₀ helix	trans	-83.4	-12.7	172.7	-56.8	-177.3	-113.3	0	0	112.9	F506 Q507 P508 K514 K551	F506-E510 HydrophobicContact CB-CB 4.43Å; F506-E510 HydrophobicContact CD1-CB 4.25Å; Q507-E510 HydrophobicContact CB-CG 4.22Å; Q507-E510 PolarHBondContact N-OE1 3.02Å; Q507-E510 WeakPolarHBondContact O-CB 3.48Å; Q507-E510 PolarHBondContact O-N 3.14Å; P508-E510 PolarHBondContact O-N 3.3Å; E510-K514 WeakPolarHBondContact O-CD 3.43Å; E510-K514 WeakPolarHBondContact O-CE 3.33Å; E510-K514 PolarHBondContact O-NZ 2.66Å; E510-K551 IonicContact OE1-NZ 3.94Å; E510-K551 PolarHBondContact OE1-NZ 2.93Å; E510-K551 WeakPolarHBondContact OE2-CE 3.13Å; E510-K551 IonicContact OE2-NZ 2.95Å; E510-K551 PolarHBondContact OE2-NZ 3.38Å
511	L	92.1	Very high	91.9	Very high	1 Å²	1	45.1 Å²	45.1	1%	0.005	23%	0.231	C	C	.	.	T	Hydrogen-bonded Turn	trans	-114.8	-25.6	-173.9	-61.2	-172.1	0	0	0	113.4	L493 L496 I500 F506 P508 Q509 K514 L519	L493-L511 WeakPolarHBondContact CB-O 3.45Å; L493-L511 HydrophobicContact CD1-CB 4.31Å; L493-L511 WeakPolarHBondContact CD1-O 3.27Å; L496-L511 HydrophobicContact CD1-CB 3.87Å; L496-L511 HydrophobicContact CD2-CB 4.01Å; L496-L511 HydrophobicContact CD2-CD1 3.78Å; I500-L511 HydrophobicContact CG1-CD1 3.79Å; F506-L511 HydrophobicContact CB-CD1 3.75Å; F506-L511 HydrophobicContact CB-CD2 3.75Å; F506-L511 HydrophobicContact CB-CG 3.66Å; F506-L511 HydrophobicContact CD1-CD2 3.95Å; F506-L511 HydrophobicContact CD2-CD1 4.4Å; F506-L511 HydrophobicContact CD2-CD2 3.88Å; F506-L511 HydrophobicContact CE1-CD2 4.45Å; F506-L511 HydrophobicContact CE2-CD2 4.38Å; F506-L511 HydrophobicContact CG-CD1 4.33Å; F506-L511 HydrophobicContact CG-CD2 3.63Å; F506-L511 HydrophobicContact CG-CG 4.13Å; P508-L511 PolarHBondContact O-N 3.01Å; Q509-L511 VanDerWaalsContact C-N 3.34Å; L511-K514 WeakPolarHBondContact O-CB 3.26Å; L511-K514 PolarHBondContact O-N 3.47Å; L511-L519 HydrophobicContact CD1-CD1 4.07Å; L511-L519 HydrophobicContact CD2-CD1 3.76Å; L511-L519 HydrophobicContact CD2-CD2 3.6Å; L511-L519 HydrophobicContact CD2-CG 4.33Å; L511-L519 HydrophobicContact CG-CD1 4.35Å
512	V	93.4	Very high	91.9	Very high	50 Å²	50	47.9 Å²	47.9	30%	0.303	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.9	145.7	166.4	170.9	0	0	0	0	109.8	L496 P508 K514	L496-V512 HydrophobicContact CD1-CG2 4.03Å; P508-V512 WeakPolarHBondContact O-CG2 3.26Å; P508-V512 PolarHBondContact O-N 3.15Å; V512-K514 PolarHBondContact O-N 2.84Å
513	D	91.4	Very high	92.2	Very high	108 Å²	108	43.3 Å²	43.3	58%	0.578	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	63.6	-8.6	-172.3	-71.7	-56.4	0	0	0	117	K492 L493	K492-D513 VanDerWaalsContact CE-CA 3.45Å; K492-D513 VanDerWaalsContact CE-O 3.28Å; K492-D513 WeakPolarHBondContact CE-O 3.29Å; K492-D513 WeakPolarHBondContact CE-OD1 3.47Å; K492-D513 WeakPolarHBondContact CG-O 3.47Å; K492-D513 IonicContact NZ-OD1 2.68Å; K492-D513 PolarHBondContact NZ-OD1 3.38Å; L493-D513 PolarHBondContact O-N 3.31Å
514	K	93	Very high	92.7	Very high	52 Å²	52	43.5 Å²	43.5	23%	0.226	24%	0.238	C	C	.	.	S	Bend	trans	-81.4	151.5	168.9	-64.1	-177.6	178.4	160.5	0	111.1	L493 E510 L511 V512	L493-K514 WeakPolarHBondContact CB-O 3.44Å; L493-K514 WeakPolarHBondContact CG-O 3.43Å; L493-K514 PolarHBondContact N-O 3.24Å; E510-K514 WeakPolarHBondContact O-CD 3.43Å; E510-K514 WeakPolarHBondContact O-CE 3.33Å; E510-K514 PolarHBondContact O-NZ 2.66Å; L511-K514 WeakPolarHBondContact O-CB 3.26Å; L511-K514 PolarHBondContact O-N 3.47Å; V512-K514 PolarHBondContact O-N 2.84Å
515	T	95	Very high	93.1	Very high	24 Å²	24	45 Å²	45	15%	0.147	25%	0.247	C	C	.	.	B	Isolated β-bridge	trans	-84	143.1	170.6	52.6	0	0	0	0	110.7	L491 K492 Y517 Q518	L491-T515 CarbonylContact O-C 3.55Å; L491-T515 WeakPolarHBondContact O-CA 3.42Å; K492-T515 HydrophobicContact CB-CG2 4Å; T515-Y517 PolarHBondContact O-N 3.49Å; T515-Y517 VanDerWaalsContact O-N 3.09Å; T515-Q518 WeakPolarHBondContact O-CB 3.47Å; T515-Q518 PolarHBondContact O-N 2.8Å; T515-Q518 PolarHBondContact OG1-NE2 3.32Å
516	L	95.3	Very high	93.4	Very high	7 Å²	7	47.2 Å²	47.2	4%	0.037	26%	0.262	C	S	.	.	G	3₁₀ helix	trans	-53.2	-34.2	178.7	-177.8	61.3	0	0	0	112.2	F485 L491 Q518 L519 V520 L528 L548	F485-L516 HydrophobicContact CE1-CD2 4.35Å; F485-L516 HydrophobicContact CZ-CD2 3.83Å; L491-L516 HydrophobicContact CB-CB 4.06Å; L491-L516 HydrophobicContact CD1-CD2 4.37Å; L491-L516 PolarHBondContact O-N 3.05Å; L516-Q518 PolarHBondContact O-N 2.92Å; L516-Q518 VanDerWaalsContact O-N 3.14Å; L516-L519 PolarHBondContact O-N 3.07Å; L516-V520 HydrophobicContact CD1-CG2 4.3Å; L516-V520 HydrophobicContact CG-CG2 4Å; L516-V520 WeakPolarHBondContact O-CG2 3.37Å; L516-V520 PolarHBondContact O-N 3.18Å; L516-L528 HydrophobicContact CD2-CD1 4.36Å; L516-L528 HydrophobicContact CD2-CD2 4.11Å; L516-L528 HydrophobicContact CG-CD2 4.17Å; L516-L548 HydrophobicContact CD1-CD1 3.94Å
517	Y	95.6	Very high	93.7	Very high	14 Å²	14	49.6 Å²	49.6	6%	0.055	28%	0.28	C	S	.	.	G	3₁₀ helix	trans	-55.5	-25.4	173.9	-64.7	-67.2	0	0	0	114.8	T515 L519 V525 L528 R529 H532 T774	T515-Y517 PolarHBondContact O-N 3.49Å; T515-Y517 VanDerWaalsContact O-N 3.09Å; Y517-L519 VanDerWaalsContact C-N 3.28Å; Y517-V525 HydrophobicContact CD1-CG1 4.04Å; Y517-V525 HydrophobicContact CE1-CG1 4.41Å; Y517-L528 HydrophobicContact CD1-CD2 3.91Å; Y517-L528 HydrophobicContact CD1-CG 4.44Å; Y517-L528 HydrophobicContact CE1-CB 4.47Å; Y517-L528 HydrophobicContact CE1-CD2 4.08Å; Y517-L528 HydrophobicContact CE1-CG 4.11Å; Y517-R529 HydrophobicContact CE1-CB 4.37Å; Y517-H532 AromaticContact CE2-ND1 3.89Å; Y517-H532 AromaticContact CZ-ND1 3.75Å; Y517-H532 PolarHBondContact OH-ND1 3.34Å; Y517-T774 HydrophobicContact CD2-CG2 4.46Å; Y517-T774 HydrophobicContact CE2-CG2 4.22Å
518	Q	92	Very high	93.9	Very high	93 Å²	93	45.4 Å²	45.4	44%	0.435	26%	0.261	S	S	.	.	G	3₁₀ helix	trans	-75.3	-18.7	176	-62.8	170.9	34	0	0	112.8	T515 L516	T515-Q518 WeakPolarHBondContact O-CB 3.47Å; T515-Q518 PolarHBondContact O-N 2.8Å; T515-Q518 PolarHBondContact OG1-NE2 3.32Å; L516-Q518 PolarHBondContact O-N 2.92Å; L516-Q518 VanDerWaalsContact O-N 3.14Å
519	L	92.8	Very high	94.1	Very high	8 Å²	8	48 Å²	48	4%	0.042	27%	0.268	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104.9	-6.1	-177.1	-49.7	178.9	0	0	0	112.2	L493 F506 L511 L516 Y517 L548 L549	L493-L519 HydrophobicContact CD1-CD1 3.73Å; F506-L519 HydrophobicContact CE2-CD2 4.43Å; L511-L519 HydrophobicContact CD1-CD1 4.07Å; L511-L519 HydrophobicContact CD2-CD1 3.76Å; L511-L519 HydrophobicContact CD2-CD2 3.6Å; L511-L519 HydrophobicContact CD2-CG 4.33Å; L511-L519 HydrophobicContact CG-CD1 4.35Å; L516-L519 PolarHBondContact O-N 3.07Å; Y517-L519 VanDerWaalsContact C-N 3.28Å; L519-L548 HydrophobicContact CB-CD1 3.57Å; L519-L548 HydrophobicContact CB-CG 4.44Å; L519-L548 CarbonylContact O-C 3.46Å; L519-L548 WeakPolarHBondContact O-CA 3.39Å; L519-L548 WeakPolarHBondContact O-CD1 3.48Å; L519-L549 WeakPolarHBondContact O-CG 3.17Å; L519-L549 PolarHBondContact O-N 3.21Å
520	V	94.2	Very high	94.3	Very high	3 Å²	3	46 Å²	46	2%	0.018	26%	0.258	C	S	.	.	B	Isolated β-bridge	trans	-96.2	136.6	-175	171	0	0	0	0	109.5	L516 T522 D524 V525 L528 Y546 R547	L516-V520 HydrophobicContact CD1-CG2 4.3Å; L516-V520 HydrophobicContact CG-CG2 4Å; L516-V520 WeakPolarHBondContact O-CG2 3.37Å; L516-V520 PolarHBondContact O-N 3.18Å; V520-T522 PolarHBondContact O-N 3.19Å; V520-D524 HydrophobicContact CG1-CB 4.01Å; V520-V525 HydrophobicContact CG1-CG2 4.17Å; V520-L528 HydrophobicContact CB-CD2 4.18Å; V520-L528 HydrophobicContact CG1-CD2 4.12Å; V520-L528 HydrophobicContact CG2-CD2 3.48Å; V520-L528 VanDerWaalsContact CG2-CD2 3.48Å; V520-Y546 HydrophobicContact CG1-CD2 4.17Å; V520-Y546 HydrophobicContact CG2-CD2 3.94Å; V520-Y546 HydrophobicContact CG2-CE2 3.83Å; V520-R547 WeakPolarHBondContact CA-O 3.19Å
521	H	94	Very high	94.6	Very high	26 Å²	26	43.4 Å²	43.4	12%	0.12	25%	0.247	C	C	.	.			trans	-57.3	132.1	176.2	-177.7	-75.4	0	0	0	110.6	A523 D524 R547 L549 L593	H521-A523 VanDerWaalsContact C-N 3.29Å; H521-A523 PolarHBondContact ND1-N 3.28Å; H521-A523 PolarHBondContact O-N 2.8Å; H521-A523 VanDerWaalsContact O-N 3.09Å; H521-D524 WeakPolarHBondContact O-CB 3.49Å; H521-D524 PolarHBondContact O-N 2.85Å; H521-R547 HydrophobicContact CB-CB 3.65Å; H521-R547 PolarHBondContact CE1-NH1 3.29Å; H521-R547 PolarHBondContact N-O 3.16Å; H521-R547 PolarHBondContact ND1-NH2 3.38Å; H521-L549 HydrophobicContact CB-CD2 4.18Å; H521-L593 VanDerWaalsContact CD2-CD1 3.5Å; H521-L593 WeakPolarHBondContact CD2-CD1 3.28Å
522	T	91.9	Very high	94.9	Very high	83 Å²	83	43.4 Å²	43.4	51%	0.509	25%	0.247	S	C	.	.	G	3₁₀ helix	trans	-51.7	-41.4	-168.6	54.9	0	0	0	0	114.4	V520 D524 V525 Y778	V520-T522 PolarHBondContact O-N 3.19Å; T522-D524 PolarHBondContact O-N 2.89Å; T522-V525 WeakPolarHBondContact O-CB 3.47Å; T522-V525 WeakPolarHBondContact O-CG2 3.49Å; T522-V525 PolarHBondContact O-N 3.39Å; T522-Y778 HydrophobicContact CG2-CE1 3.83Å
523	A	94.4	Very high	95.1	Very high	67 Å²	67	43.4 Å²	43.4	55%	0.554	24%	0.244	S	C	*	.	G	3₁₀ helix	trans	-63.5	-20.4	177.4	0	0	0	0	0	114.8	H521	H521-A523 VanDerWaalsContact C-N 3.29Å; H521-A523 PolarHBondContact ND1-N 3.28Å; H521-A523 PolarHBondContact O-N 2.8Å; H521-A523 VanDerWaalsContact O-N 3.09Å
524	D	96.5	Very high	95.3	Very high	16 Å²	16	39.3 Å²	39.3	9%	0.086	22%	0.222	C	C	.	.	G	3₁₀ helix	trans	-96.1	-8.8	-177.9	-54.6	-20.1	0	0	0	112.2	V520 H521 T522 A526 S527 L528 R547	V520-D524 HydrophobicContact CG1-CB 4.01Å; H521-D524 WeakPolarHBondContact O-CB 3.49Å; H521-D524 PolarHBondContact O-N 2.85Å; T522-D524 PolarHBondContact O-N 2.89Å; D524-A526 VanDerWaalsContact C-N 3.31Å; D524-A526 PolarHBondContact O-N 3.05Å; D524-S527 WeakPolarHBondContact O-CB 3.17Å; D524-S527 PolarHBondContact O-N 2.82Å; D524-S527 VanDerWaalsContact O-N 3.14Å; D524-L528 PolarHBondContact O-N 3.08Å; D524-R547 IonicContact OD1-CZ 3.6Å; D524-R547 IonicContact OD1-NE 2.68Å; D524-R547 IonicContact OD1-NH2 3.51Å; D524-R547 PolarHBondContact OD1-NH2 3.42Å; D524-R547 WeakPolarHBondContact OD2-CB 2.85Å; D524-R547 IonicContact OD2-CZ 3.53Å; D524-R547 PolarHBondContact OD2-N 2.99Å; D524-R547 IonicContact OD2-NE 2.64Å; D524-R547 PolarHBondContact OD2-NE 3.45Å; D524-R547 IonicContact OD2-NH2 3.92Å
525	V	94.8	Very high	95.5	Very high	33 Å²	33	37 Å²	37	20%	0.2	21%	0.212	C	C	.	.	H	α-helix	trans	-60.3	-36.3	-175.7	170.9	0	0	0	0	112.6	Y517 V520 T522 R529	Y517-V525 HydrophobicContact CD1-CG1 4.04Å; Y517-V525 HydrophobicContact CE1-CG1 4.41Å; V520-V525 HydrophobicContact CG1-CG2 4.17Å; T522-V525 WeakPolarHBondContact O-CB 3.47Å; T522-V525 WeakPolarHBondContact O-CG2 3.49Å; T522-V525 PolarHBondContact O-N 3.39Å; V525-R529 WeakPolarHBondContact O-CB 3.48Å; V525-R529 PolarHBondContact O-N 2.86Å
526	A	95.6	Very high	95.5	Very high	75 Å²	75	36.7 Å²	36.7	62%	0.62	21%	0.209	S	C	*	.	H	α-helix	trans	-66	-42.4	176.8	0	0	0	0	0	111.9	D524 R529 H530	D524-A526 VanDerWaalsContact C-N 3.31Å; D524-A526 PolarHBondContact O-N 3.05Å; A526-R529 PolarHBondContact O-N 3.25Å; A526-H530 PolarHBondContact O-N 2.93Å; A526-H530 VanDerWaalsContact O-N 3.08Å
527	S	96.1	Very high	95.4	Very high	57 Å²	57	40.3 Å²	40.3	40%	0.399	23%	0.228	S	C	.	.	H	α-helix	trans	-65.5	-43.5	176.8	-53.6	0	0	0	0	111.5	D524 H530 S531	D524-S527 WeakPolarHBondContact O-CB 3.17Å; D524-S527 PolarHBondContact O-N 2.82Å; D524-S527 VanDerWaalsContact O-N 3.14Å; S527-H530 PolarHBondContact O-N 3.4Å; S527-S531 PolarHBondContact O-N 3.34Å; S527-S531 PolarHBondContact O-OG 3.04Å
528	L	96.6	Very high	95.3	Very high	7 Å²	7	40.5 Å²	40.5	4%	0.037	23%	0.229	C	C	.	.	H	α-helix	trans	-64.7	-40	175.3	-179.1	63	0	0	0	112	L516 Y517 V520 D524 H530 S531 H532 T543	L516-L528 HydrophobicContact CD2-CD1 4.36Å; L516-L528 HydrophobicContact CD2-CD2 4.11Å; L516-L528 HydrophobicContact CG-CD2 4.17Å; Y517-L528 HydrophobicContact CD1-CD2 3.91Å; Y517-L528 HydrophobicContact CD1-CG 4.44Å; Y517-L528 HydrophobicContact CE1-CB 4.47Å; Y517-L528 HydrophobicContact CE1-CD2 4.08Å; Y517-L528 HydrophobicContact CE1-CG 4.11Å; V520-L528 HydrophobicContact CB-CD2 4.18Å; V520-L528 HydrophobicContact CG1-CD2 4.12Å; V520-L528 HydrophobicContact CG2-CD2 3.48Å; V520-L528 VanDerWaalsContact CG2-CD2 3.48Å; D524-L528 PolarHBondContact O-N 3.08Å; L528-H530 VanDerWaalsContact C-N 3.3Å; L528-H530 PolarHBondContact O-N 3.12Å; L528-S531 PolarHBondContact O-N 2.99Å; L528-H532 WeakPolarHBondContact O-CB 3.31Å; L528-H532 PolarHBondContact O-N 3.35Å; L528-T543 HydrophobicContact CD1-CG2 4.24Å
529	R	97.6	Very high	95.4	Very high	72 Å²	72	36.8 Å²	36.8	27%	0.272	22%	0.216	S	C	.	.	H	α-helix	trans	-57.3	-44.3	173.7	179	-173.3	170.6	131.9	7.4	111	Y517 V525 A526 H532 E533 L771 N772 S775	Y517-R529 HydrophobicContact CE1-CB 4.37Å; V525-R529 WeakPolarHBondContact O-CB 3.48Å; V525-R529 PolarHBondContact O-N 2.86Å; A526-R529 PolarHBondContact O-N 3.25Å; R529-H532 WeakPolarHBondContact O-CB 3.3Å; R529-H532 PolarHBondContact O-N 2.98Å; R529-E533 IonicContact CZ-OE1 3.88Å; R529-E533 IonicContact NE-OE1 3.88Å; R529-E533 PolarHBondContact NE-OE1 3.49Å; R529-E533 IonicContact NH2-OE1 3.38Å; R529-E533 PolarHBondContact NH2-OE1 2.64Å; R529-E533 WeakPolarHBondContact O-CG 3.37Å; R529-E533 PolarHBondContact O-N 3.19Å; R529-L771 HydrophobicContact CG-CD2 4.26Å; R529-N772 PolarHBondContact NH2-OD1 3.08Å; R529-S775 PolarHBondContact NH1-OG 3.04Å
530	H	96.9	Very high	95.5	Very high	109 Å²	109	36.8 Å²	36.8	51%	0.505	22%	0.216	S	C	.	.	H	α-helix	trans	-65.6	-40.7	177.8	-173	53.5	0	0	0	112.4	A526 S527 L528 H532 E533 I534	A526-H530 PolarHBondContact O-N 2.93Å; A526-H530 VanDerWaalsContact O-N 3.08Å; S527-H530 PolarHBondContact O-N 3.4Å; L528-H530 VanDerWaalsContact C-N 3.3Å; L528-H530 PolarHBondContact O-N 3.12Å; H530-H532 VanDerWaalsContact C-N 3.3Å; H530-H532 PolarHBondContact O-N 3.21Å; H530-E533 IonicContact ND1-OE2 3.19Å; H530-E533 WeakPolarHBondContact O-CB 3.43Å; H530-E533 PolarHBondContact O-N 2.64Å; H530-I534 WeakPolarHBondContact O-CG1 3.36Å; H530-I534 PolarHBondContact O-N 2.58Å
531	S	97.9	Very high	95.6	Very high	6 Å²	6	36.8 Å²	36.8	4%	0.042	22%	0.216	C	C	.	.	H	α-helix	trans	-62.1	-37	171.2	-63	0	0	0	0	112.7	S527 L528 I534 L535 V541 P544	S527-S531 PolarHBondContact O-N 3.34Å; S527-S531 PolarHBondContact O-OG 3.04Å; L528-S531 PolarHBondContact O-N 2.99Å; S531-I534 PolarHBondContact O-N 2.86Å; S531-L535 WeakPolarHBondContact O-CB 3.23Å; S531-L535 PolarHBondContact O-N 3.11Å; S531-V541 WeakPolarHBondContact O-CG1 3.14Å; S531-P544 WeakPolarHBondContact OG-CD 3.49Å
532	H	97.9	Very high	95.7	Very high	2 Å²	2	35.7 Å²	35.7	1%	0.009	21%	0.211	C	C	.	.	H	α-helix	trans	-68.4	-38.8	176	-170.7	-171.8	0	0	0	112	L489 L491 Y517 L528 R529 H530 I534 L535 L536 L771	L489-H532 PolarHBondContact O-NE2 2.87Å; L491-H532 HydrophobicContact CD1-CB 4.02Å; L491-H532 WeakPolarHBondContact CD1-ND1 3.49Å; Y517-H532 AromaticContact CE2-ND1 3.89Å; Y517-H532 AromaticContact CZ-ND1 3.75Å; Y517-H532 PolarHBondContact OH-ND1 3.34Å; L528-H532 WeakPolarHBondContact O-CB 3.31Å; L528-H532 PolarHBondContact O-N 3.35Å; R529-H532 WeakPolarHBondContact O-CB 3.3Å; R529-H532 PolarHBondContact O-N 2.98Å; H530-H532 VanDerWaalsContact C-N 3.3Å; H530-H532 PolarHBondContact O-N 3.21Å; H532-I534 VanDerWaalsContact C-N 3.35Å; H532-I534 PolarHBondContact O-N 2.86Å; H532-L535 PolarHBondContact O-N 2.81Å; H532-L536 WeakPolarHBondContact O-CG 3.34Å; H532-L536 PolarHBondContact O-N 2.95Å; H532-L771 HydrophobicContact CB-CD2 4.4Å
533	E	96.9	Very high	95.9	Very high	50 Å²	50	32.1 Å²	32.1	23%	0.234	19%	0.189	C	C	.	.	H	α-helix	trans	-58.3	-44	169.8	-78.6	161	-174.2	0	0	111.5	R529 H530 N537 L771	R529-E533 IonicContact CZ-OE1 3.88Å; R529-E533 IonicContact NE-OE1 3.88Å; R529-E533 PolarHBondContact NE-OE1 3.49Å; R529-E533 IonicContact NH2-OE1 3.38Å; R529-E533 PolarHBondContact NH2-OE1 2.64Å; R529-E533 WeakPolarHBondContact O-CG 3.37Å; R529-E533 PolarHBondContact O-N 3.19Å; H530-E533 IonicContact ND1-OE2 3.19Å; H530-E533 WeakPolarHBondContact O-CB 3.43Å; H530-E533 PolarHBondContact O-N 2.64Å; E533-N537 WeakPolarHBondContact O-CB 3.4Å; E533-N537 PolarHBondContact O-N 2.84Å; E533-N537 PolarHBondContact O-ND2 2.79Å; E533-L771 HydrophobicContact CG-CD1 3.27Å; E533-L771 HydrophobicContact CG-CD2 4.02Å; E533-L771 HydrophobicContact CG-CG 4.28Å
534	I	96.7	Very high	96	Very high	21 Å²	21	31.7 Å²	31.7	11%	0.108	18%	0.181	C	C	.	.	H	α-helix	trans	-64.9	-46.6	175.4	-67.8	161	0	0	0	111.2	F413 H530 S531 H532 L536 N537 K538 V541	F413-I534 HydrophobicContact CB-CG2 4.25Å; F413-I534 HydrophobicContact CD2-CD1 3.93Å; F413-I534 HydrophobicContact CD2-CG2 3.82Å; F413-I534 HydrophobicContact CE2-CD1 4.05Å; F413-I534 HydrophobicContact CE2-CG2 4.4Å; F413-I534 HydrophobicContact CG-CG2 4.03Å; H530-I534 WeakPolarHBondContact O-CG1 3.36Å; H530-I534 PolarHBondContact O-N 2.58Å; S531-I534 PolarHBondContact O-N 2.86Å; H532-I534 VanDerWaalsContact C-N 3.35Å; H532-I534 PolarHBondContact O-N 2.86Å; I534-L536 VanDerWaalsContact C-N 3.33Å; I534-L536 PolarHBondContact O-N 2.94Å; I534-N537 PolarHBondContact O-N 2.97Å; I534-K538 HydrophobicContact CG2-CD 4.33Å; I534-K538 PolarHBondContact O-N 2.83Å; I534-V541 HydrophobicContact CB-CB 4.47Å; I534-V541 HydrophobicContact CB-CG2 3.87Å; I534-V541 HydrophobicContact CD1-CG2 4.46Å; I534-V541 HydrophobicContact CG2-CB 4.07Å; I534-V541 HydrophobicContact CG2-CG2 3.62Å
535	L	96.1	Very high	96	Very high	3 Å²	3	34.5 Å²	34.5	2%	0.016	19%	0.191	C	C	.	.	H	α-helix	trans	-55.6	-46.5	179.5	179.4	60.9	0	0	0	111.9	S531 H532 G539 V541 A562 I564 V576	S531-L535 WeakPolarHBondContact O-CB 3.23Å; S531-L535 PolarHBondContact O-N 3.11Å; H532-L535 PolarHBondContact O-N 2.81Å; L535-G539 WeakPolarHBondContact O-CA 3.48Å; L535-G539 PolarHBondContact O-N 2.83Å; L535-V541 HydrophobicContact CB-CB 4.16Å; L535-V541 HydrophobicContact CB-CG1 3.8Å; L535-V541 HydrophobicContact CD1-CG1 4.25Å; L535-V541 HydrophobicContact CG-CG1 4.41Å; L535-A562 HydrophobicContact CD1-CB 4.19Å; L535-A562 WeakPolarHBondContact CD1-O 3.14Å; L535-A562 HydrophobicContact CD2-CB 3.96Å; L535-I564 HydrophobicContact CD1-CD1 4.49Å; L535-I564 HydrophobicContact CD1-CG1 3.88Å; L535-I564 HydrophobicContact CG-CD1 4.26Å; L535-I564 HydrophobicContact CG-CG1 4.02Å; L535-I564 VanDerWaalsContact O-CD1 3.28Å; L535-I564 WeakPolarHBondContact O-CD1 3.48Å; L535-V576 HydrophobicContact CD2-CG1 3.81Å; L535-V576 HydrophobicContact CD2-CG2 3.88Å
536	L	94.9	Very high	96.2	Very high	19 Å²	19	33.1 Å²	33.1	10%	0.099	18%	0.182	C	C	.	.	H	α-helix	trans	-70.7	-29.9	-180	-66.8	171.1	0	0	0	113.3	L489 H532 I534 I564 I767	L489-L536 HydrophobicContact CB-CD2 4.02Å; L489-L536 HydrophobicContact CD2-CD2 4.27Å; H532-L536 WeakPolarHBondContact O-CG 3.34Å; H532-L536 PolarHBondContact O-N 2.95Å; I534-L536 VanDerWaalsContact C-N 3.33Å; I534-L536 PolarHBondContact O-N 2.94Å; L536-I564 HydrophobicContact CD2-CD1 4.22Å; L536-I767 HydrophobicContact CB-CD1 3.65Å; L536-I767 HydrophobicContact CB-CG1 3.84Å; L536-I767 HydrophobicContact CD1-CG1 4.17Å; L536-I767 HydrophobicContact CD1-CG2 4.17Å
537	N	93.8	Very high	96.2	Very high	82 Å²	82	31.4 Å²	31.4	44%	0.439	16%	0.159	S	C	.	.	H	α-helix	trans	-86.2	-29.2	-179.7	-77.1	-57.6	0	0	0	114.3	R415 E533 I534 I767	R415-N537 PolarHBondContact NH1-O 2.72Å; E533-N537 WeakPolarHBondContact O-CB 3.4Å; E533-N537 PolarHBondContact O-N 2.84Å; E533-N537 PolarHBondContact O-ND2 2.79Å; I534-N537 PolarHBondContact O-N 2.97Å; N537-I767 WeakPolarHBondContact OD1-CD1 3.45Å
538	K	94.5	Very high	96.2	Very high	18 Å²	18	28.9 Å²	28.9	8%	0.078	14%	0.142	C	C	.	.	H	α-helix	trans	-119.3	-13.4	-173.3	-63.7	179.6	-174.5	162.3	0	114.4	D382 E385 F413 R415 V434 I534 Q540	D382-K538 WeakPolarHBondContact OD1-CE 3.45Å; E385-K538 IonicContact OE1-NZ 2.79Å; E385-K538 PolarHBondContact OE1-NZ 3.25Å; E385-K538 WeakPolarHBondContact OE2-CE 3.28Å; E385-K538 IonicContact OE2-NZ 3.72Å; E385-K538 PolarHBondContact OE2-NZ 3.09Å; F413-K538 HydrophobicContact CB-CD 4.09Å; F413-K538 PolarHBondContact O-NZ 3.07Å; R415-K538 HydrophobicContact CG-CB 4.5Å; R415-K538 HydrophobicContact CG-CG 4.49Å; V434-K538 HydrophobicContact CG2-CB 4.42Å; V434-K538 WeakPolarHBondContact CG2-O 3.49Å; I534-K538 HydrophobicContact CG2-CD 4.33Å; I534-K538 PolarHBondContact O-N 2.83Å; K538-Q540 VanDerWaalsContact C-N 3.34Å
539	G	92.8	Very high	96	Very high	15 Å²	15	29.1 Å²	29.1	16%	0.155	14%	0.143	C	C	.	.	S	Bend	trans	89	-14.2	177.3	0	0	0	0	0	115.2	L535 I564	L535-G539 WeakPolarHBondContact O-CA 3.48Å; L535-G539 PolarHBondContact O-N 2.83Å; G539-I564 PolarHBondContact O-N 3.49Å
540	Q	94.7	Very high	95.8	Very high	9 Å²	9	26 Å²	26	4%	0.042	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.3	151.3	175.1	-57.6	-171.2	-92	0	0	110.6	L427 V434 I466 K538 A562 T563	L427-Q540 HydrophobicContact CD2-CG 4.12Å; V434-Q540 HydrophobicContact CB-CB 4.04Å; V434-Q540 HydrophobicContact CB-CG 4.42Å; V434-Q540 HydrophobicContact CG1-CB 4.22Å; V434-Q540 HydrophobicContact CG2-CB 4.05Å; V434-Q540 HydrophobicContact CG2-CG 4.19Å; I466-Q540 HydrophobicContact CB-CB 4.36Å; I466-Q540 HydrophobicContact CD1-CB 3.58Å; I466-Q540 HydrophobicContact CG2-CB 4.28Å; I466-Q540 PolarHBondContact O-NE2 3.31Å; K538-Q540 VanDerWaalsContact C-N 3.34Å; Q540-A562 CarbonylContact C-O 3.59Å; Q540-A562 VanDerWaalsContact CA-O 3.31Å; Q540-A562 WeakPolarHBondContact CA-O 3.39Å; Q540-T563 HydrophobicContact CG-CG2 4.09Å; Q540-T563 PolarHBondContact NE2-OG1 2.91Å
541	V	96.4	Very high	95.4	Very high	2 Å²	2	23.2 Å²	23.2	1%	0.012	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.6	152.5	171.9	75.9	0	0	0	0	112	F413 S531 I534 L535 A562	F413-V541 HydrophobicContact CE1-CG2 4.3Å; F413-V541 HydrophobicContact CE2-CG2 3.99Å; F413-V541 HydrophobicContact CZ-CG2 3.85Å; S531-V541 WeakPolarHBondContact O-CG1 3.14Å; I534-V541 HydrophobicContact CB-CB 4.47Å; I534-V541 HydrophobicContact CB-CG2 3.87Å; I534-V541 HydrophobicContact CD1-CG2 4.46Å; I534-V541 HydrophobicContact CG2-CB 4.07Å; I534-V541 HydrophobicContact CG2-CG2 3.62Å; L535-V541 HydrophobicContact CB-CB 4.16Å; L535-V541 HydrophobicContact CB-CG1 3.8Å; L535-V541 HydrophobicContact CD1-CG1 4.25Å; L535-V541 HydrophobicContact CG-CG1 4.41Å; V541-A562 HydrophobicContact CG1-CB 4.12Å; V541-A562 PolarHBondContact N-O 2.96Å; V541-A562 PolarHBondContact O-N 2.94Å
542	T	96.4	Very high	94.8	Very high	3 Å²	3	26.3 Å²	26.3	2%	0.018	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	125.8	160.2	-54.9	0	0	0	0	108.3	F413 Q559 S560 Y561	F413-T542 WeakPolarHBondContact CZ-O 3.36Å; T542-Q559 HydrophobicContact CG2-CG 4.09Å; T542-S560 WeakPolarHBondContact CA-O 3.44Å; T542-Y561 HydrophobicContact CG2-CD1 3.76Å; T542-Y561 HydrophobicContact CG2-CE1 3.33Å; T542-Y561 HydrophobicContact CG2-CE2 4.4Å; T542-Y561 HydrophobicContact CG2-CG 4.49Å; T542-Y561 VanDerWaalsContact OG1-CD1 3.3Å; T542-Y561 WeakPolarHBondContact OG1-CD1 3.48Å; T542-Y561 WeakPolarHBondContact OG1-CE1 3.41Å
543	T	97.2	Very high	94.3	Very high	8 Å²	8	26.2 Å²	26.2	5%	0.049	14%	0.14	C	C	.	.	P	Polyproline II helix	trans	-72	156.5	176.1	68.6	0	0	0	0	111.4	L528 Y546 Q559 S560	L528-T543 HydrophobicContact CD1-CG2 4.24Å; T543-Y546 HydrophobicContact CG2-CE1 4.45Å; T543-Q559 WeakPolarHBondContact O-CG 3.22Å; T543-Q559 PolarHBondContact O-NE2 2.98Å; T543-S560 PolarHBondContact N-O 3.09Å; T543-S560 PolarHBondContact OG1-N 3.05Å
544	P	96	Very high	94.1	Very high	59 Å²	59	24 Å²	24	38%	0.383	13%	0.129	S	C	.	.	P	Polyproline II helix	trans	-61.8	170.2	153.3	29.8	-33.1	0	0	0	110.1	S531 Y546	S531-P544 WeakPolarHBondContact OG-CD 3.49Å; P544-Y546 PolarHBondContact O-N 3.28Å
545	Y	97.3	Very high	94	Very high	74 Å²	74	24.4 Å²	24.4	29%	0.29	13%	0.13	S	C	.	.	P	Polyproline II helix	trans	-65.8	125.6	171.9	-49.9	-36	0	0	0	109.5	I558 Q559 L583 I669	Y545-I558 WeakPolarHBondContact CA-O 3.46Å; Y545-Q559 HydrophobicContact CD1-CB 4.06Å; Y545-Q559 HydrophobicContact CD1-CG 4.43Å; Y545-Q559 HydrophobicContact CE1-CB 4.34Å; Y545-L583 HydrophobicContact CD1-CD1 3.42Å; Y545-L583 VanDerWaalsContact CD1-CD1 3.42Å; Y545-L583 HydrophobicContact CE1-CD1 3.87Å; Y545-L583 HydrophobicContact CG-CD1 3.89Å; Y545-I669 HydrophobicContact CE2-CG2 4.48Å
546	Y	97.5	Very high	93.9	Very high	4 Å²	4	24.4 Å²	24.4	2%	0.016	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	162.1	178.7	75.2	-87.2	0	0	0	110.7	V520 T543 P544 L548 I558 S560	V520-Y546 HydrophobicContact CG1-CD2 4.17Å; V520-Y546 HydrophobicContact CG2-CD2 3.94Å; V520-Y546 HydrophobicContact CG2-CE2 3.83Å; T543-Y546 HydrophobicContact CG2-CE1 4.45Å; P544-Y546 PolarHBondContact O-N 3.28Å; Y546-L548 HydrophobicContact CE2-CB 4.36Å; Y546-L548 HydrophobicContact CE2-CD1 4.23Å; Y546-I558 HydrophobicContact CE1-CB 4.13Å; Y546-I558 HydrophobicContact CE1-CG2 3.8Å; Y546-I558 HydrophobicContact CE2-CB 4.48Å; Y546-I558 PolarHBondContact N-O 3.35Å; Y546-I558 PolarHBondContact O-N 3.49Å; Y546-S560 WeakPolarHBondContact CE1-OG 3.43Å; Y546-S560 PolarHBondContact OH-OG 3.35Å
547	R	96.5	Very high	94	Very high	39 Å²	39	24.8 Å²	24.8	15%	0.147	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	125.9	-179.5	-68.1	163.5	-74.8	-174	-10.3	111.3	V520 H521 D524 W555 V556 W557	V520-R547 WeakPolarHBondContact CA-O 3.19Å; H521-R547 HydrophobicContact CB-CB 3.65Å; H521-R547 PolarHBondContact CE1-NH1 3.29Å; H521-R547 PolarHBondContact N-O 3.16Å; H521-R547 PolarHBondContact ND1-NH2 3.38Å; D524-R547 IonicContact OD1-CZ 3.6Å; D524-R547 IonicContact OD1-NE 2.68Å; D524-R547 IonicContact OD1-NH2 3.51Å; D524-R547 PolarHBondContact OD1-NH2 3.42Å; D524-R547 WeakPolarHBondContact OD2-CB 2.85Å; D524-R547 IonicContact OD2-CZ 3.53Å; D524-R547 PolarHBondContact OD2-N 2.99Å; D524-R547 IonicContact OD2-NE 2.64Å; D524-R547 PolarHBondContact OD2-NE 3.45Å; D524-R547 IonicContact OD2-NH2 3.92Å; R547-W555 HydrophobicContact CB-CB 3.95Å; R547-W555 HydrophobicContact CB-CG 3.88Å; R547-W555 HydrophobicContact CG-CB 4.46Å; R547-W555 VanDerWaalsContact CG-CD1 3.49Å; R547-W555 HydrophobicContact CG-CD2 4.49Å; R547-W555 HydrophobicContact CG-CG 3.89Å; R547-V556 WeakPolarHBondContact CA-O 3.5Å; R547-W557 HydrophobicContact CG-CD2 3.7Å; R547-W557 HydrophobicContact CG-CE3 3.72Å; R547-W557 HydrophobicContact CG-CG 4.42Å; R547-W557 HydrophobicContact CG-CH2 3.77Å; R547-W557 HydrophobicContact CG-CZ2 3.73Å; R547-W557 HydrophobicContact CG-CZ3 3.76Å
548	L	94.7	Very high	94.2	Very high	5 Å²	5	20.9 Å²	20.9	3%	0.026	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	125.4	170.7	-166.2	76.8	0	0	0	108.9	F483 I500 T504 L516 L519 Y546 W555 V556 I558	F483-L548 HydrophobicContact CZ-CD2 4.44Å; I500-L548 HydrophobicContact CD1-CD2 4.3Å; T504-L548 HydrophobicContact CG2-CD2 3.58Å; T504-L548 HydrophobicContact CG2-CG 4.35Å; L516-L548 HydrophobicContact CD1-CD1 3.94Å; L519-L548 HydrophobicContact CB-CD1 3.57Å; L519-L548 HydrophobicContact CB-CG 4.44Å; L519-L548 CarbonylContact O-C 3.46Å; L519-L548 WeakPolarHBondContact O-CA 3.39Å; L519-L548 WeakPolarHBondContact O-CD1 3.48Å; Y546-L548 HydrophobicContact CE2-CB 4.36Å; Y546-L548 HydrophobicContact CE2-CD1 4.23Å; L548-W555 CarbonylContact O-C 3.57Å; L548-W555 VanDerWaalsContact O-CA 3.23Å; L548-W555 WeakPolarHBondContact O-CA 3.45Å; L548-W555 WeakPolarHBondContact O-CB 3.44Å; L548-V556 HydrophobicContact CB-CG2 4.1Å; L548-V556 PolarHBondContact N-O 3.19Å; L548-V556 PolarHBondContact O-N 2.96Å; L548-I558 HydrophobicContact CB-CD1 3.64Å; L548-I558 HydrophobicContact CB-CG1 4.4Å; L548-I558 HydrophobicContact CD2-CD1 3.55Å; L548-I558 HydrophobicContact CG-CD1 4.2Å
549	L	94.1	Very high	94.3	Very high	11 Å²	11	21.3 Å²	21.3	6%	0.058	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.6	139.8	-175	-60.8	178.1	0	0	0	111.4	L519 H521 W555 L593 L594	L519-L549 WeakPolarHBondContact O-CG 3.17Å; L519-L549 PolarHBondContact O-N 3.21Å; H521-L549 HydrophobicContact CB-CD2 4.18Å; L549-W555 HydrophobicContact CD2-CB 4.4Å; L549-L593 HydrophobicContact CD1-CB 4.37Å; L549-L593 HydrophobicContact CD2-CB 4.08Å; L549-L593 HydrophobicContact CD2-CD1 4.04Å; L549-L594 HydrophobicContact CB-CD1 4.33Å; L549-L594 HydrophobicContact CB-CD2 4.01Å; L549-L594 HydrophobicContact CB-CG 4.09Å; L549-L594 HydrophobicContact CD1-CD2 3.83Å; L549-L594 HydrophobicContact CD1-CG 4.1Å
550	N	91.8	Very high	94.4	Very high	8 Å²	8	20.7 Å²	20.7	4%	0.043	11%	0.105	C	C	.	.	P	Polyproline II helix	trans	-97.6	138.1	175.3	-175.1	-70.2	0	0	0	110.5	I503 T504 S552 G553 G554 I586 L594	I503-N550 PolarHBondContact O-ND2 3.46Å; T504-N550 WeakPolarHBondContact CA-ND2 3.28Å; T504-N550 CarbonylContact O-C 3.59Å; T504-N550 WeakPolarHBondContact O-CA 3.26Å; T504-N550 VanDerWaalsContact O-CG 3.28Å; T504-N550 PolarHBondContact O-ND2 3.39Å; T504-N550 PolarHBondContact O-OD1 3.33Å; N550-S552 PolarHBondContact O-N 3.47Å; N550-S552 VanDerWaalsContact O-N 3.15Å; N550-S552 PolarHBondContact OD1-N 2.94Å; N550-G553 PolarHBondContact O-N 3.24Å; N550-G554 PolarHBondContact N-O 3.27Å; N550-I586 HydrophobicContact CB-CG2 3.86Å; N550-I586 WeakPolarHBondContact ND2-CD1 3.33Å; N550-L594 VanDerWaalsContact O-CD1 3.29Å; N550-L594 WeakPolarHBondContact O-CD1 3.45Å
551	K	89.7	Confident	94.4	Very high	49 Å²	49	21.6 Å²	21.6	21%	0.213	11%	0.108	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.1	-33.9	-179	-173.1	177.9	179.6	172.6	0	113.4	T504 G505 F506 E510 G553 V599	T504-K551 WeakPolarHBondContact O-CB 3.48Å; T504-K551 PolarHBondContact O-N 2.82Å; G505-K551 VanDerWaalsContact O-CD 3.3Å; G505-K551 WeakPolarHBondContact O-CD 3.45Å; F506-K551 HydrophobicContact CD1-CB 3.95Å; F506-K551 HydrophobicContact CD1-CD 3.73Å; F506-K551 HydrophobicContact CD1-CG 3.91Å; F506-K551 HydrophobicContact CD2-CB 3.93Å; F506-K551 HydrophobicContact CE1-CB 3.9Å; F506-K551 HydrophobicContact CE1-CD 4.08Å; F506-K551 HydrophobicContact CE1-CG 3.78Å; F506-K551 HydrophobicContact CE2-CB 3.89Å; F506-K551 HydrophobicContact CG-CB 3.98Å; F506-K551 HydrophobicContact CG-CD 4.24Å; F506-K551 HydrophobicContact CG-CG 4.41Å; F506-K551 HydrophobicContact CZ-CB 3.89Å; F506-K551 HydrophobicContact CZ-CG 4.19Å; E510-K551 IonicContact OE1-NZ 3.94Å; E510-K551 PolarHBondContact OE1-NZ 2.93Å; E510-K551 WeakPolarHBondContact OE2-CE 3.13Å; E510-K551 IonicContact OE2-NZ 2.95Å; E510-K551 PolarHBondContact OE2-NZ 3.38Å; K551-G553 VanDerWaalsContact C-N 3.3Å; K551-V599 HydrophobicContact CG-CG2 4.34Å; K551-V599 WeakPolarHBondContact O-CG1 3.5Å
552	S	85.1	Confident	94.3	Very high	71 Å²	71	21.8 Å²	21.8	50%	0.497	11%	0.11	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.5	4.7	-179.4	-58.3	0	0	0	0	113.9	N550	N550-S552 PolarHBondContact O-N 3.47Å; N550-S552 VanDerWaalsContact O-N 3.15Å; N550-S552 PolarHBondContact OD1-N 2.94Å
553	G	87.9	Confident	94.2	Very high	1 Å²	1	21.7 Å²	21.7	1%	0.01	11%	0.109	C	C	.	.	S	Bend	trans	100.1	156.4	-170.5	0	0	0	0	0	112.9	N550 K551 Y591	N550-G553 PolarHBondContact O-N 3.24Å; K551-G553 VanDerWaalsContact C-N 3.3Å; G553-Y591 WeakPolarHBondContact CA-O 3.41Å
554	G	92.4	Very high	93.9	Very high	2 Å²	2	21.9 Å²	21.9	2%	0.021	11%	0.11	C	C	.	.	S	Bend	trans	78.8	-165.5	-173.8	0	0	0	0	0	114.2	N550 E587 C588 Y591	N550-G554 PolarHBondContact N-O 3.27Å; G554-E587 CarbonylContact C-O 3.56Å; G554-E587 WeakPolarHBondContact CA-O 3.26Å; G554-C588 WeakPolarHBondContact CA-O 3.22Å; G554-C588 PolarHBondContact N-O 2.75Å; G554-Y591 PolarHBondContact N-O 3.29Å
555	W	94.2	Very high	93.4	Very high	30 Å²	30	20.9 Å²	20.9	11%	0.114	10%	0.101	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152	164.8	-177	57.5	74.7	0	0	0	112.6	R547 L548 L549 W557 I586 E587 C588 L593	R547-W555 HydrophobicContact CB-CB 3.95Å; R547-W555 HydrophobicContact CB-CG 3.88Å; R547-W555 HydrophobicContact CG-CB 4.46Å; R547-W555 VanDerWaalsContact CG-CD1 3.49Å; R547-W555 HydrophobicContact CG-CD2 4.49Å; R547-W555 HydrophobicContact CG-CG 3.89Å; L548-W555 CarbonylContact O-C 3.57Å; L548-W555 VanDerWaalsContact O-CA 3.23Å; L548-W555 WeakPolarHBondContact O-CA 3.45Å; L548-W555 WeakPolarHBondContact O-CB 3.44Å; L549-W555 HydrophobicContact CD2-CB 4.4Å; W555-W557 AromaticContact NE1-NE1 3.83Å; W555-I586 CarbonylContact O-C 3.55Å; W555-I586 WeakPolarHBondContact O-CA 3.27Å; W555-E587 PolarHBondContact N-O 3.43Å; W555-E587 VanDerWaalsContact N-O 3.09Å; W555-E587 PolarHBondContact NE1-OE2 3.3Å; W555-E587 PolarHBondContact O-N 3.14Å; W555-C588 HydrophobicContact CE3-CB 4.38Å; W555-C588 HydrophobicContact CH2-CB 3.46Å; W555-C588 VanDerWaalsContact CH2-CB 3.46Å; W555-C588 HydrophobicContact CZ2-CB 3.76Å; W555-C588 HydrophobicContact CZ3-CB 3.81Å; W555-L593 HydrophobicContact CE3-CD1 3.99Å; W555-L593 HydrophobicContact CZ3-CD1 3.91Å
556	V	94.5	Very high	92.5	Very high	3 Å²	3	21.1 Å²	21.1	2%	0.018	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	145.6	165.7	-65.7	0	0	0	0	110.4	I503 R547 L548 I558 L582 I586	I503-V556 HydrophobicContact CG2-CG1 4.36Å; I503-V556 HydrophobicContact CG2-CG2 3.85Å; R547-V556 WeakPolarHBondContact CA-O 3.5Å; L548-V556 HydrophobicContact CB-CG2 4.1Å; L548-V556 PolarHBondContact N-O 3.19Å; L548-V556 PolarHBondContact O-N 2.96Å; V556-I558 HydrophobicContact CG2-CD1 4.03Å; V556-I558 HydrophobicContact CG2-CG1 4.12Å; V556-L582 HydrophobicContact CB-CD1 3.62Å; V556-L582 HydrophobicContact CG1-CD1 4.05Å; V556-L582 HydrophobicContact CG2-CD1 3.8Å; V556-I586 HydrophobicContact CG1-CB 4.29Å; V556-I586 HydrophobicContact CG1-CG1 3.78Å
557	W	97.1	Very high	91.2	Very high	27 Å²	27	24.2 Å²	24.2	10%	0.102	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	135.8	171.7	-72.3	95.5	0	0	0	111	R547 W555 L583 S584 E587 I669	R547-W557 HydrophobicContact CG-CD2 3.7Å; R547-W557 HydrophobicContact CG-CE3 3.72Å; R547-W557 HydrophobicContact CG-CG 4.42Å; R547-W557 HydrophobicContact CG-CH2 3.77Å; R547-W557 HydrophobicContact CG-CZ2 3.73Å; R547-W557 HydrophobicContact CG-CZ3 3.76Å; W555-W557 AromaticContact NE1-NE1 3.83Å; W557-L583 HydrophobicContact CB-CB 3.9Å; W557-L583 PolarHBondContact O-N 3.33Å; W557-S584 PolarHBondContact N-OG 3.09Å; W557-E587 PolarHBondContact NE1-OE2 3.19Å; W557-I669 HydrophobicContact CG-CD1 4.4Å
558	I	96.4	Very high	89.7	Confident	0 Å²	0	27.6 Å²	27.6	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	148.2	-177.8	-65.8	-176.4	0	0	0	110.9	F483 Y545 Y546 L548 V556 N580 Y581 L582	F483-I558 HydrophobicContact CE1-CD1 3.79Å; F483-I558 HydrophobicContact CZ-CD1 3.87Å; Y545-I558 WeakPolarHBondContact CA-O 3.46Å; Y546-I558 HydrophobicContact CE1-CB 4.13Å; Y546-I558 HydrophobicContact CE1-CG2 3.8Å; Y546-I558 HydrophobicContact CE2-CB 4.48Å; Y546-I558 PolarHBondContact N-O 3.35Å; Y546-I558 PolarHBondContact O-N 3.49Å; L548-I558 HydrophobicContact CB-CD1 3.64Å; L548-I558 HydrophobicContact CB-CG1 4.4Å; L548-I558 HydrophobicContact CD2-CD1 3.55Å; L548-I558 HydrophobicContact CG-CD1 4.2Å; V556-I558 HydrophobicContact CG2-CD1 4.03Å; V556-I558 HydrophobicContact CG2-CG1 4.12Å; I558-N580 HydrophobicContact CG2-CB 4.03Å; I558-Y581 VanDerWaalsContact CA-O 3.26Å; I558-Y581 WeakPolarHBondContact CA-O 3.48Å; I558-L582 HydrophobicContact CG1-CD1 4.39Å
559	Q	96.7	Very high	88.4	Confident	27 Å²	27	39.1 Å²	39.1	13%	0.126	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	134.3	157.3	-173.5	165.5	47.5	0	0	110.5	T542 T543 Y545 Y561 N580 Y581 L583	T542-Q559 HydrophobicContact CG2-CG 4.09Å; T543-Q559 WeakPolarHBondContact O-CG 3.22Å; T543-Q559 PolarHBondContact O-NE2 2.98Å; Y545-Q559 HydrophobicContact CD1-CB 4.06Å; Y545-Q559 HydrophobicContact CD1-CG 4.43Å; Y545-Q559 HydrophobicContact CE1-CB 4.34Å; Q559-Y561 HydrophobicContact CG-CE2 3.89Å; Q559-Y561 PolarHBondContact OE1-OH 2.92Å; Q559-N580 WeakPolarHBondContact O-CA 3.44Å; Q559-Y581 PolarHBondContact N-O 2.74Å; Q559-Y581 PolarHBondContact O-N 3.4Å; Q559-L583 HydrophobicContact CB-CD1 4.2Å
560	S	95.8	Very high	86.9	Confident	2 Å²	2	40.5 Å²	40.5	1%	0.014	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	133.1	-179.5	-66.2	0	0	0	0	111.8	T542 T543 Y546 S578 V579 N580	T542-S560 WeakPolarHBondContact CA-O 3.44Å; T543-S560 PolarHBondContact N-O 3.09Å; T543-S560 PolarHBondContact OG1-N 3.05Å; Y546-S560 WeakPolarHBondContact CE1-OG 3.43Å; Y546-S560 PolarHBondContact OH-OG 3.35Å; S560-S578 WeakPolarHBondContact CB-OG 3.29Å; S560-V579 WeakPolarHBondContact CA-O 3.4Å; S560-N580 WeakPolarHBondContact CB-OD1 3.43Å; S560-N580 PolarHBondContact OG-OD1 3.37Å
561	Y	94.8	Very high	85.2	Confident	28 Å²	28	46.4 Å²	46.4	11%	0.11	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	100.7	170.5	-63.3	-95.6	0	0	0	106.9	Y464 I466 P467 T542 Q559 V579 Y581	Y464-Y561 HydrophobicContact CE2-CE1 4.19Å; I466-Y561 HydrophobicContact CG2-CD1 4.22Å; P467-Y561 HydrophobicContact CG-CD1 4.35Å; T542-Y561 HydrophobicContact CG2-CD1 3.76Å; T542-Y561 HydrophobicContact CG2-CE1 3.33Å; T542-Y561 HydrophobicContact CG2-CE2 4.4Å; T542-Y561 HydrophobicContact CG2-CG 4.49Å; T542-Y561 VanDerWaalsContact OG1-CD1 3.3Å; T542-Y561 WeakPolarHBondContact OG1-CD1 3.48Å; T542-Y561 WeakPolarHBondContact OG1-CE1 3.41Å; Q559-Y561 HydrophobicContact CG-CE2 3.89Å; Q559-Y561 PolarHBondContact OE1-OH 2.92Å; Y561-V579 PolarHBondContact N-O 3.39Å; Y561-V579 PolarHBondContact O-N 2.95Å; Y561-Y581 AromaticContact CD2-CD2 3.57Å; Y561-Y581 HydrophobicContact CD2-CD2 3.57Å; Y561-Y581 AromaticContact CD2-CE2 3.48Å; Y561-Y581 HydrophobicContact CD2-CE2 3.48Å; Y561-Y581 VanDerWaalsContact CD2-CE2 3.48Å; Y561-Y581 AromaticContact CE2-CD2 3.5Å; Y561-Y581 HydrophobicContact CE2-CD2 3.5Å; Y561-Y581 VanDerWaalsContact CE2-CD2 3.5Å; Y561-Y581 AromaticContact CE2-CE2 3.54Å; Y561-Y581 HydrophobicContact CE2-CE2 3.54Å
562	A	94.6	Very high	83.8	Confident	6 Å²	6	52.9 Å²	52.9	5%	0.05	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	140.6	-171.3	0	0	0	0	0	111.2	L535 Q540 V541 V576 V577	L535-A562 HydrophobicContact CD1-CB 4.19Å; L535-A562 WeakPolarHBondContact CD1-O 3.14Å; L535-A562 HydrophobicContact CD2-CB 3.96Å; Q540-A562 CarbonylContact C-O 3.59Å; Q540-A562 VanDerWaalsContact CA-O 3.31Å; Q540-A562 WeakPolarHBondContact CA-O 3.39Å; V541-A562 HydrophobicContact CG1-CB 4.12Å; V541-A562 PolarHBondContact N-O 2.96Å; V541-A562 PolarHBondContact O-N 2.94Å; A562-V576 HydrophobicContact CB-CG1 4.06Å; A562-V577 WeakPolarHBondContact CA-O 3.47Å
563	T	93.2	Very high	82.6	Confident	1 Å²	1	54.9 Å²	54.9	1%	0.006	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	133.2	-174.5	-72.4	0	0	0	0	110.3	L427 Q540 I565 V576 V577	L427-T563 HydrophobicContact CD2-CG2 3.31Å; Q540-T563 HydrophobicContact CG-CG2 4.09Å; Q540-T563 PolarHBondContact NE2-OG1 2.91Å; T563-I565 HydrophobicContact CG2-CG1 4.39Å; T563-I565 PolarHBondContact O-N 2.84Å; T563-V576 WeakPolarHBondContact O-CA 3.34Å; T563-V577 PolarHBondContact N-O 2.83Å; T563-V577 PolarHBondContact O-N 2.94Å
564	I	91.7	Very high	82.3	Confident	12 Å²	12	56.7 Å²	56.7	6%	0.062	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	112.9	171.7	-58.4	-179.2	0	0	0	109.1	L489 L535 L536 G539 N574 C575 V576	L489-I564 HydrophobicContact CD2-CD1 3.99Å; L489-I564 HydrophobicContact CD2-CG1 4.24Å; L489-I564 HydrophobicContact CD2-CG2 4.03Å; L535-I564 HydrophobicContact CD1-CD1 4.49Å; L535-I564 HydrophobicContact CD1-CG1 3.88Å; L535-I564 HydrophobicContact CG-CD1 4.26Å; L535-I564 HydrophobicContact CG-CG1 4.02Å; L535-I564 VanDerWaalsContact O-CD1 3.28Å; L535-I564 WeakPolarHBondContact O-CD1 3.48Å; L536-I564 HydrophobicContact CD2-CD1 4.22Å; G539-I564 PolarHBondContact O-N 3.49Å; I564-N574 HydrophobicContact CG2-CB 4.07Å; I564-C575 CarbonylContact C-O 3.5Å; I564-C575 WeakPolarHBondContact CA-O 3.43Å; I564-V576 HydrophobicContact CG1-CG2 4.39Å
565	I	85.7	Confident	82.3	Confident	39 Å²	39	58.1 Å²	58.1	20%	0.2	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	123.1	171.3	-58.2	-172.3	0	0	0	108.8	N470 T563 N574 C575 V577	N470-I565 HydrophobicContact CB-CD1 3.89Å; T563-I565 HydrophobicContact CG2-CG1 4.39Å; T563-I565 PolarHBondContact O-N 2.84Å; I565-N574 WeakPolarHBondContact O-CA 3.45Å; I565-C575 PolarHBondContact N-O 3.18Å; I565-C575 PolarHBondContact O-N 2.91Å; I565-V577 HydrophobicContact CD1-CB 4.11Å; I565-V577 HydrophobicContact CD1-CG2 3.49Å; I565-V577 VanDerWaalsContact CD1-CG2 3.49Å; I565-V577 HydrophobicContact CG1-CG2 3.99Å
566	H	78.5	Confident	82.2	Confident	79 Å²	79	56.7 Å²	56.7	37%	0.366	30%	0.295	S	S	.	.			trans	-91.5	124.7	172.9	-68.6	73.7	0	0	0	109	S568 N574	H566-S568 PolarHBondContact O-N 2.93Å; H566-N574 PolarHBondContact CD2-ND2 3.03Å; H566-N574 PolarHBondContact CD2-OD1 3.28Å; H566-N574 PolarHBondContact NE2-ND2 2.88Å; H566-N574 VanDerWaalsContact NE2-ND2 3.11Å
567	N	69.7	Low	82.1	Confident	69 Å²	69	56.9 Å²	56.9	37%	0.369	30%	0.296	S	S	.	.			trans	-90.6	96.9	174.9	-161.1	-47.5	0	0	0	109.5	R569 S570	N567-R569 VanDerWaalsContact C-N 3.33Å; N567-R569 PolarHBondContact OD1-N 2.69Å; N567-S570 PolarHBondContact ND2-OG 3.15Å; N567-S570 VanDerWaalsContact ND2-OG 3.13Å; N567-S570 PolarHBondContact OD1-N 2.95Å; N567-S570 PolarHBondContact OD1-OG 3.02Å
568	S	64.9	Low	81.9	Confident	110 Å²	110	55.6 Å²	55.6	77%	0.769	29%	0.291	S	S	*	.	S	Bend	trans	-85.3	-0.9	-176	70.7	0	0	0	0	114.5	H566	H566-S568 PolarHBondContact O-N 2.93Å
569	R	66.6	Low	81.8	Confident	246 Å²	246	55.6 Å²	55.6	93%	0.928	29%	0.291	S	S	*	.	S	Bend	trans	-119	-12.3	-175.6	-79.3	-175.2	169.8	177.1	-7.5	114.2	N567	N567-R569 VanDerWaalsContact C-N 3.33Å; N567-R569 PolarHBondContact OD1-N 2.69Å
570	S	63.3	Low	81.7	Confident	41 Å²	41	54.3 Å²	54.3	29%	0.287	29%	0.285	S	S	.	.	S	Bend	trans	-137.3	156.3	174.4	66.8	0	0	0	0	110.2	N567 R572	N567-S570 PolarHBondContact ND2-OG 3.15Å; N567-S570 VanDerWaalsContact ND2-OG 3.13Å; N567-S570 PolarHBondContact OD1-N 2.95Å; N567-S570 PolarHBondContact OD1-OG 3.02Å; S570-R572 PolarHBondContact O-N 2.92Å
571	S	57.1	Low	81.6	Confident	132 Å²	132	57.3 Å²	57.3	92%	0.923	30%	0.297	S	S	*	.	S	Bend	trans	-66.3	4.7	177.7	53.1	0	0	0	0	114.8
572	R	60.1	Low	81.6	Confident	184 Å²	184	58 Å²	58	69%	0.694	30%	0.302	S	S	*	.	P	Polyproline II helix	trans	-66.1	134.8	-179.9	-69.9	177.9	169	136.3	-6.2	110.2	S570	S570-R572 PolarHBondContact O-N 2.92Å
573	P	59.8	Low	81.6	Confident	114 Å²	114	60.6 Å²	60.6	74%	0.74	32%	0.315	S	S	*	.	P	Polyproline II helix	trans	-65.4	152.9	-175.6	27.8	-35.7	0	0	0	112.2	C575	P573-C575 PolarHBondContact O-N 2.87Å
574	N	82	Confident	81.6	Confident	38 Å²	38	61.7 Å²	61.7	20%	0.203	32%	0.322	C	S	.	.	P	Polyproline II helix	trans	-50.5	131.4	169.5	-72.8	-2.6	0	0	0	110.8	L489 I564 I565 H566	L489-N574 HydrophobicContact CD1-CB 4.12Å; L489-N574 HydrophobicContact CD2-CB 4.14Å; L489-N574 HydrophobicContact CG-CB 4.36Å; I564-N574 HydrophobicContact CG2-CB 4.07Å; I565-N574 WeakPolarHBondContact O-CA 3.45Å; H566-N574 PolarHBondContact CD2-ND2 3.03Å; H566-N574 PolarHBondContact CD2-OD1 3.28Å; H566-N574 PolarHBondContact NE2-ND2 2.88Å; H566-N574 VanDerWaalsContact NE2-ND2 3.11Å
575	C	90.7	Very high	81.6	Confident	33 Å²	33	68.7 Å²	68.7	22%	0.223	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	150.5	176.5	66.3	0	0	0	0	111.4	A487 I564 I565 P573	A487-C575 CarbonylContact O-C 3.55Å; A487-C575 WeakPolarHBondContact O-CA 3.5Å; I564-C575 CarbonylContact C-O 3.5Å; I564-C575 WeakPolarHBondContact CA-O 3.43Å; I565-C575 PolarHBondContact N-O 3.18Å; I565-C575 PolarHBondContact O-N 2.91Å; P573-C575 PolarHBondContact O-N 2.87Å
576	V	93.3	Very high	81.9	Confident	0 Å²	0	68.8 Å²	68.8	0%	0	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	128.1	165.3	178.9	0	0	0	0	107.7	R486 A487 L489 L491 L535 A562 T563 I564	R486-V576 CarbonylContact C-O 3.6Å; R486-V576 VanDerWaalsContact CA-O 3.29Å; R486-V576 WeakPolarHBondContact CA-O 3.19Å; A487-V576 HydrophobicContact CB-CB 4.36Å; A487-V576 PolarHBondContact N-O 2.99Å; A487-V576 PolarHBondContact O-N 2.87Å; L489-V576 HydrophobicContact CD2-CG2 4.27Å; L491-V576 HydrophobicContact CD2-CG1 4.24Å; L491-V576 HydrophobicContact CD2-CG2 4.39Å; L535-V576 HydrophobicContact CD2-CG1 3.81Å; L535-V576 HydrophobicContact CD2-CG2 3.88Å; A562-V576 HydrophobicContact CB-CG1 4.06Å; T563-V576 WeakPolarHBondContact O-CA 3.34Å; I564-V576 HydrophobicContact CG1-CG2 4.39Å
577	V	92.4	Very high	82.6	Confident	6 Å²	6	68.8 Å²	68.8	4%	0.036	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	130.3	163.7	-175.2	0	0	0	0	107.9	P469 M484 R486 A562 T563 I565	P469-V577 HydrophobicContact CG-CB 4.43Å; P469-V577 HydrophobicContact CG-CG1 3.7Å; M484-V577 HydrophobicContact CE-CG1 4.47Å; M484-V577 HydrophobicContact CG-CG1 3.96Å; M484-V577 HydrophobicContact SD-CG1 3.61Å; R486-V577 HydrophobicContact CG-CG2 4.15Å; A562-V577 WeakPolarHBondContact CA-O 3.47Å; T563-V577 PolarHBondContact N-O 2.83Å; T563-V577 PolarHBondContact O-N 2.94Å; I565-V577 HydrophobicContact CD1-CB 4.11Å; I565-V577 HydrophobicContact CD1-CG2 3.49Å; I565-V577 VanDerWaalsContact CD1-CG2 3.49Å; I565-V577 HydrophobicContact CG1-CG2 3.99Å
578	S	93.7	Very high	83.5	Confident	1 Å²	1	67.7 Å²	67.7	1%	0.007	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	125.7	-177.7	-168.5	0	0	0	0	110.8	M484 F485 S560 N580	M484-S578 WeakPolarHBondContact CA-O 3.34Å; M484-S578 WeakPolarHBondContact CG-O 3.35Å; F485-S578 VanDerWaalsContact CE2-CB 3.48Å; F485-S578 PolarHBondContact N-O 3.03Å; F485-S578 PolarHBondContact O-N 3.48Å; S560-S578 WeakPolarHBondContact CB-OG 3.29Å; S578-N580 PolarHBondContact O-ND2 3.32Å; S578-N580 PolarHBondContact OG-OD1 3Å
579	V	92.6	Very high	84.4	Confident	0 Å²	0	68.9 Å²	68.9	0%	0	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	122.6	169.3	178	0	0	0	0	107.6	P469 I476 L478 M482 M484 S560 Y561 Y581	P469-V579 HydrophobicContact CB-CG2 4.18Å; P469-V579 HydrophobicContact CG-CG2 3.89Å; I476-V579 HydrophobicContact CD1-CG2 4.32Å; L478-V579 HydrophobicContact CD2-CG1 4.36Å; M482-V579 HydrophobicContact CE-CG1 3.24Å; M484-V579 HydrophobicContact CE-CG2 4.25Å; S560-V579 WeakPolarHBondContact CA-O 3.4Å; Y561-V579 PolarHBondContact N-O 3.39Å; Y561-V579 PolarHBondContact O-N 2.95Å; V579-Y581 HydrophobicContact CG1-CE2 4.14Å
580	N	94.4	Very high	85.1	Confident	0 Å²	0	63.5 Å²	63.5	0%	0	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	122.6	-166.5	-43.4	-78.8	0	0	0	109.4	M482 F483 F485 I558 Q559 S560 S578	M482-N580 CarbonylContact C-O 3.58Å; M482-N580 VanDerWaalsContact CA-O 3.29Å; M482-N580 WeakPolarHBondContact CA-O 3.32Å; F483-N580 HydrophobicContact CD1-CB 4.01Å; F483-N580 HydrophobicContact CD2-CB 4.33Å; F483-N580 HydrophobicContact CE1-CB 3.63Å; F483-N580 HydrophobicContact CE2-CB 3.96Å; F483-N580 HydrophobicContact CG-CB 4.35Å; F483-N580 HydrophobicContact CZ-CB 3.6Å; F483-N580 PolarHBondContact N-O 2.97Å; F483-N580 WeakPolarHBondContact O-CB 3.14Å; F483-N580 PolarHBondContact O-N 2.58Å; F483-N580 PolarHBondContact O-ND2 2.88Å; F485-N580 VanDerWaalsContact CD1-ND2 3.26Å; F485-N580 WeakPolarHBondContact CD1-ND2 3.42Å; F485-N580 WeakPolarHBondContact CE1-OD1 3.08Å; I558-N580 HydrophobicContact CG2-CB 4.03Å; Q559-N580 WeakPolarHBondContact O-CA 3.44Å; S560-N580 WeakPolarHBondContact CB-OD1 3.43Å; S560-N580 PolarHBondContact OG-OD1 3.37Å; S578-N580 PolarHBondContact O-ND2 3.32Å; S578-N580 PolarHBondContact OG-OD1 3Å
581	Y	93.9	Very high	85.8	Confident	65 Å²	65	66.2 Å²	66.2	26%	0.255	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	128	177	-69.4	-100	0	0	0	109.7	M482 I558 Q559 Y561 V579	M482-Y581 HydrophobicContact CE-CD1 4.44Å; M482-Y581 HydrophobicContact CE-CE1 3.72Å; M482-Y581 HydrophobicContact CE-CE2 3.85Å; M482-Y581 WeakPolarHBondContact CE-OH 3.42Å; M482-Y581 HydrophobicContact CG-CD1 3.76Å; M482-Y581 HydrophobicContact CG-CE1 3.77Å; M482-Y581 HydrophobicContact CG-CG 4.36Å; M482-Y581 HydrophobicContact SD-CD1 4.21Å; M482-Y581 HydrophobicContact SD-CE1 3.57Å; M482-Y581 VanDerWaalsContact SD-CE1 3.57Å; I558-Y581 VanDerWaalsContact CA-O 3.26Å; I558-Y581 WeakPolarHBondContact CA-O 3.48Å; Q559-Y581 PolarHBondContact N-O 2.74Å; Q559-Y581 PolarHBondContact O-N 3.4Å; Y561-Y581 AromaticContact CD2-CD2 3.57Å; Y561-Y581 HydrophobicContact CD2-CD2 3.57Å; Y561-Y581 AromaticContact CD2-CE2 3.48Å; Y561-Y581 HydrophobicContact CD2-CE2 3.48Å; Y561-Y581 VanDerWaalsContact CD2-CE2 3.48Å; Y561-Y581 AromaticContact CE2-CD2 3.5Å; Y561-Y581 HydrophobicContact CE2-CD2 3.5Å; Y561-Y581 VanDerWaalsContact CE2-CD2 3.5Å; Y561-Y581 AromaticContact CE2-CE2 3.54Å; Y561-Y581 HydrophobicContact CE2-CE2 3.54Å; V579-Y581 HydrophobicContact CG1-CE2 4.14Å
582	L	94.5	Very high	86.6	Confident	42 Å²	42	62 Å²	62	22%	0.22	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	118.1	176.4	-176.6	64.7	0	0	0	109.6	D481 I503 V556 I558 S584	D481-L582 WeakPolarHBondContact O-CB 3.49Å; D481-L582 PolarHBondContact O-N 3.17Å; I503-L582 HydrophobicContact CD1-CD2 4.3Å; I503-L582 HydrophobicContact CG1-CD2 4.15Å; I503-L582 HydrophobicContact CG2-CD1 3.76Å; I503-L582 HydrophobicContact CG2-CD2 4.22Å; V556-L582 HydrophobicContact CB-CD1 3.62Å; V556-L582 HydrophobicContact CG1-CD1 4.05Å; V556-L582 HydrophobicContact CG2-CD1 3.8Å; I558-L582 HydrophobicContact CG1-CD1 4.39Å; L582-S584 WeakPolarHBondContact CD1-O 3.44Å
583	L	94.8	Very high	87.1	Confident	61 Å²	61	56.4 Å²	56.4	32%	0.319	28%	0.284	S	S	.	.			trans	-102.3	-10.5	-172.6	-51.1	177.8	0	0	0	113.2	Y545 W557 Q559	Y545-L583 HydrophobicContact CD1-CD1 3.42Å; Y545-L583 VanDerWaalsContact CD1-CD1 3.42Å; Y545-L583 HydrophobicContact CE1-CD1 3.87Å; Y545-L583 HydrophobicContact CG-CD1 3.89Å; W557-L583 HydrophobicContact CB-CB 3.9Å; W557-L583 PolarHBondContact O-N 3.33Å; Q559-L583 HydrophobicContact CB-CD1 4.2Å
584	S	93.8	Very high	87.5	Confident	24 Å²	24	52 Å²	52	17%	0.168	25%	0.254	C	S	.	.	S	Bend	trans	-150.9	161.2	-179.5	77.4	0	0	0	0	112.9	W557 L582	W557-S584 PolarHBondContact N-OG 3.09Å; L582-S584 WeakPolarHBondContact CD1-O 3.44Å
585	E	91.3	Very high	86.2	Confident	159 Å²	159	56.6 Å²	56.6	74%	0.743	28%	0.278	S	S	*	.	S	Bend	trans	-67.7	176.3	155.2	-67.1	-172.3	-156.7	0	0	111.2	E587	E585-E587 PolarHBondContact O-N 2.88Å; E585-E587 VanDerWaalsContact O-N 3.16Å
586	I	92.1	Very high	84.5	Confident	40 Å²	40	57.5 Å²	57.5	21%	0.205	28%	0.281	C	S	.	.			trans	-71.4	107.3	178.6	-47.6	155.6	0	0	0	110.4	N550 W555 V556 R589	N550-I586 HydrophobicContact CB-CG2 3.86Å; N550-I586 WeakPolarHBondContact ND2-CD1 3.33Å; W555-I586 CarbonylContact O-C 3.55Å; W555-I586 WeakPolarHBondContact O-CA 3.27Å; V556-I586 HydrophobicContact CG1-CB 4.29Å; V556-I586 HydrophobicContact CG1-CG1 3.78Å; I586-R589 HydrophobicContact CB-CG 4.3Å; I586-R589 HydrophobicContact CG2-CG 3.77Å; I586-R589 PolarHBondContact O-NE 3.18Å; I586-R589 VanDerWaalsContact O-NE 3.16Å
587	E	92.7	Very high	82.4	Confident	79 Å²	79	62.2 Å²	62.2	37%	0.369	31%	0.311	S	S	.	.	B	Isolated β-bridge	trans	-81.2	155.2	173.7	-60.2	-173.5	154.1	0	0	111.6	G554 W555 W557 E585 R589	G554-E587 CarbonylContact C-O 3.56Å; G554-E587 WeakPolarHBondContact CA-O 3.26Å; W555-E587 PolarHBondContact N-O 3.43Å; W555-E587 VanDerWaalsContact N-O 3.09Å; W555-E587 PolarHBondContact NE1-OE2 3.3Å; W555-E587 PolarHBondContact O-N 3.14Å; W557-E587 PolarHBondContact NE1-OE2 3.19Å; E585-E587 PolarHBondContact O-N 2.88Å; E585-E587 VanDerWaalsContact O-N 3.16Å; E587-R589 VanDerWaalsContact C-N 3.32Å; E587-R589 PolarHBondContact O-N 3.03Å; E587-R589 VanDerWaalsContact O-N 3.16Å
588	C	89.4	Confident	80.3	Confident	46 Å²	46	68 Å²	68	31%	0.311	34%	0.342	S	S	.	.			trans	51.7	40.3	166.1	-79.8	0	0	0	0	116.1	G554 W555 E590 Y591	G554-C588 WeakPolarHBondContact CA-O 3.22Å; G554-C588 PolarHBondContact N-O 2.75Å; W555-C588 HydrophobicContact CE3-CB 4.38Å; W555-C588 HydrophobicContact CH2-CB 3.46Å; W555-C588 VanDerWaalsContact CH2-CB 3.46Å; W555-C588 HydrophobicContact CZ2-CB 3.76Å; W555-C588 HydrophobicContact CZ3-CB 3.81Å; C588-E590 VanDerWaalsContact C-OE2 3.23Å; C588-E590 WeakPolarHBondContact CA-OE2 3.3Å; C588-E590 PolarHBondContact O-N 2.85Å; C588-Y591 HydrophobicContact CB-CD2 4Å; C588-Y591 PolarHBondContact O-N 3.19Å
589	R	84.6	Confident	78.4	Confident	136 Å²	136	68.4 Å²	68.4	51%	0.513	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.3	-26.2	-177.5	-60.5	-178.6	-166.4	-165.2	3.1	114	I586 E587 Y591	I586-R589 HydrophobicContact CB-CG 4.3Å; I586-R589 HydrophobicContact CG2-CG 3.77Å; I586-R589 PolarHBondContact O-NE 3.18Å; I586-R589 VanDerWaalsContact O-NE 3.16Å; E587-R589 VanDerWaalsContact C-N 3.32Å; E587-R589 PolarHBondContact O-N 3.03Å; E587-R589 VanDerWaalsContact O-N 3.16Å; R589-Y591 PolarHBondContact O-N 3.3Å
590	E	80.5	Confident	76.4	Confident	132 Å²	132	75.8 Å²	75.8	62%	0.617	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.1	-11.6	177	67.3	-75	175.9	0	0	114.7	C588	C588-E590 VanDerWaalsContact C-OE2 3.23Å; C588-E590 WeakPolarHBondContact CA-OE2 3.3Å; C588-E590 PolarHBondContact O-N 2.85Å
591	Y	77.3	Confident	74.3	Confident	99 Å²	99	81.7 Å²	81.7	39%	0.388	40%	0.4	S	S	.	.			trans	-108.4	103.9	176.8	-61.5	-83	0	0	0	111.8	G553 G554 C588 R589 L593 M654	G553-Y591 WeakPolarHBondContact CA-O 3.41Å; G554-Y591 PolarHBondContact N-O 3.29Å; C588-Y591 HydrophobicContact CB-CD2 4Å; C588-Y591 PolarHBondContact O-N 3.19Å; R589-Y591 PolarHBondContact O-N 3.3Å; Y591-L593 PolarHBondContact O-N 3Å; Y591-M654 HydrophobicContact CE1-CE 4.34Å
592	C	75	Confident	72.6	Confident	43 Å²	43	82.7 Å²	82.7	29%	0.291	41%	0.41	S	S	.	.			trans	-77.4	115.7	163.7	-172	0	0	0	0	109.9	I603	C592-I603 HydrophobicContact CB-CD1 3.85Å; C592-I603 VanDerWaalsContact SG-CD1 3.6Å
593	L	71.4	Confident	70.8	Confident	67 Å²	67	81.9 Å²	81.9	35%	0.351	41%	0.406	S	S	.	.			trans	-107.4	-0.2	178	-58.9	178.7	0	0	0	112.9	H521 L549 W555 Y591 N595	H521-L593 VanDerWaalsContact CD2-CD1 3.5Å; H521-L593 WeakPolarHBondContact CD2-CD1 3.28Å; L549-L593 HydrophobicContact CD1-CB 4.37Å; L549-L593 HydrophobicContact CD2-CB 4.08Å; L549-L593 HydrophobicContact CD2-CD1 4.04Å; W555-L593 HydrophobicContact CE3-CD1 3.99Å; W555-L593 HydrophobicContact CZ3-CD1 3.91Å; Y591-L593 PolarHBondContact O-N 3Å; L593-N595 PolarHBondContact O-N 2.82Å
594	L	67.4	Low	69.1	Low	20 Å²	20	81.3 Å²	81.3	11%	0.105	41%	0.405	C	S	.	.			trans	-87.2	107.9	179.1	-71.3	157.1	0	0	0	109.1	F506 L549 N550 D596	F506-L594 HydrophobicContact CE2-CD1 3.99Å; F506-L594 HydrophobicContact CZ-CD1 3.56Å; F506-L594 HydrophobicContact CZ-CD2 4.06Å; F506-L594 HydrophobicContact CZ-CG 4.45Å; L549-L594 HydrophobicContact CB-CD1 4.33Å; L549-L594 HydrophobicContact CB-CD2 4.01Å; L549-L594 HydrophobicContact CB-CG 4.09Å; L549-L594 HydrophobicContact CD1-CD2 3.83Å; L549-L594 HydrophobicContact CD1-CG 4.1Å; N550-L594 VanDerWaalsContact O-CD1 3.29Å; N550-L594 WeakPolarHBondContact O-CD1 3.45Å; L594-D596 PolarHBondContact O-N 3.28Å
595	N	54.6	Low	67.4	Low	136 Å²	136	83 Å²	83	73%	0.727	41%	0.412	S	S	*	.			trans	-75.1	46.5	175	-71.4	-22.4	0	0	0	112.5	L593	L593-N595 PolarHBondContact O-N 2.82Å
596	D	55.6	Low	65.8	Low	52 Å²	52	80.5 Å²	80.5	28%	0.278	40%	0.4	S	S	.	.			trans	-97.5	115.3	169.6	-171.7	-37.1	0	0	0	108.5	L594 L598 V599 Y600	L594-D596 PolarHBondContact O-N 3.28Å; D596-L598 PolarHBondContact O-N 3.23Å; D596-L598 VanDerWaalsContact O-N 3.16Å; D596-L598 WeakPolarHBondContact OD1-CB 3.17Å; D596-L598 PolarHBondContact OD1-N 3.31Å; D596-V599 HydrophobicContact CB-CB 4.05Å; D596-V599 HydrophobicContact CB-CG2 3.84Å; D596-V599 PolarHBondContact O-N 2.83Å; D596-V599 VanDerWaalsContact O-N 3.14Å; D596-Y600 PolarHBondContact O-N 3.09Å
597	P	47.6	Very low	64	Low	98 Å²	98	83.5 Å²	83.5	64%	0.636	41%	0.413	S	S	*	.	H	α-helix	trans	-57.1	-29.5	-178.6	-26.4	35.4	0	0	0	114.1	E601	P597-E601 PolarHBondContact O-N 2.7Å; P597-E601 VanDerWaalsContact O-N 3.08Å
598	L	48.3	Very low	61.9	Low	128 Å²	128	85.1 Å²	85.1	67%	0.67	42%	0.421	S	S	*	.	H	α-helix	trans	-73.4	-40.7	179.7	-56.5	176.1	0	0	0	110.8	D596 Y600 E601 D602	D596-L598 PolarHBondContact O-N 3.23Å; D596-L598 VanDerWaalsContact O-N 3.16Å; D596-L598 WeakPolarHBondContact OD1-CB 3.17Å; D596-L598 PolarHBondContact OD1-N 3.31Å; L598-Y600 VanDerWaalsContact C-N 3.33Å; L598-E601 PolarHBondContact O-N 3.14Å; L598-D602 PolarHBondContact O-N 2.95Å
599	V	54.3	Low	59.9	Low	9 Å²	9	88.7 Å²	88.7	6%	0.055	43%	0.433	C	S	.	.	H	α-helix	trans	-66.3	-37	175	176.9	0	0	0	0	110.9	K551 D596 D602 I603	K551-V599 HydrophobicContact CG-CG2 4.34Å; K551-V599 WeakPolarHBondContact O-CG1 3.5Å; D596-V599 HydrophobicContact CB-CB 4.05Å; D596-V599 HydrophobicContact CB-CG2 3.84Å; D596-V599 PolarHBondContact O-N 2.83Å; D596-V599 VanDerWaalsContact O-N 3.14Å; V599-D602 PolarHBondContact O-N 3.3Å; V599-I603 HydrophobicContact CG1-CD1 3.7Å; V599-I603 HydrophobicContact CG1-CG1 4.33Å; V599-I603 WeakPolarHBondContact O-CB 3.38Å; V599-I603 VanDerWaalsContact O-CG1 3.28Å; V599-I603 WeakPolarHBondContact O-CG1 3.44Å; V599-I603 PolarHBondContact O-N 2.84Å
600	Y	50	Low	58.1	Low	156 Å²	156	86.5 Å²	86.5	61%	0.612	44%	0.435	S	S	*	.	H	α-helix	trans	-65	-46.6	175.2	-170.8	-94.1	0	0	0	112.3	D596 L598 I603 V604	D596-Y600 PolarHBondContact O-N 3.09Å; L598-Y600 VanDerWaalsContact C-N 3.33Å; Y600-I603 PolarHBondContact O-N 2.86Å; Y600-V604 HydrophobicContact CD1-CG2 4.04Å; Y600-V604 HydrophobicContact CE1-CG2 3.68Å; Y600-V604 HydrophobicContact CE2-CG2 4.43Å; Y600-V604 WeakPolarHBondContact O-CB 3.23Å; Y600-V604 VanDerWaalsContact O-CG2 3.28Å; Y600-V604 WeakPolarHBondContact O-CG2 3.35Å; Y600-V604 PolarHBondContact O-N 2.88Å
601	E	52.3	Low	56.2	Low	123 Å²	123	87.7 Å²	87.7	58%	0.575	44%	0.438	S	S	*	.	H	α-helix	trans	-54.6	-52	171.8	-81.6	-85.3	153.9	0	0	111.3	P597 L598 I603 V604 N605	P597-E601 PolarHBondContact O-N 2.7Å; P597-E601 VanDerWaalsContact O-N 3.08Å; L598-E601 PolarHBondContact O-N 3.14Å; E601-I603 PolarHBondContact O-N 3.01Å; E601-V604 PolarHBondContact O-N 3.36Å; E601-N605 WeakPolarHBondContact O-CB 3.35Å; E601-N605 VanDerWaalsContact O-CG 3.25Å; E601-N605 PolarHBondContact O-N 2.9Å; E601-N605 PolarHBondContact O-ND2 2.85Å
602	D	57	Low	54.6	Low	86 Å²	86	87 Å²	87	46%	0.46	44%	0.444	S	S	.	.	H	α-helix	trans	-59.9	-45.5	-179.6	-89	-17.6	0	0	0	112.8	L598 V599 N605 Q606	L598-D602 PolarHBondContact O-N 2.95Å; V599-D602 PolarHBondContact O-N 3.3Å; D602-N605 PolarHBondContact O-N 2.84Å; D602-Q606 VanDerWaalsContact O-CG 3.32Å; D602-Q606 WeakPolarHBondContact O-CG 3.32Å; D602-Q606 PolarHBondContact O-N 2.91Å
603	I	56.3	Low	53.1	Low	25 Å²	25	90.4 Å²	90.4	13%	0.128	46%	0.459	C	S	.	.	H	α-helix	trans	-66.2	-40	179.1	-70.4	173.2	0	0	0	111	C592 V599 Y600 E601 Q606 H607	C592-I603 HydrophobicContact CB-CD1 3.85Å; C592-I603 VanDerWaalsContact SG-CD1 3.6Å; V599-I603 HydrophobicContact CG1-CD1 3.7Å; V599-I603 HydrophobicContact CG1-CG1 4.33Å; V599-I603 WeakPolarHBondContact O-CB 3.38Å; V599-I603 VanDerWaalsContact O-CG1 3.28Å; V599-I603 WeakPolarHBondContact O-CG1 3.44Å; V599-I603 PolarHBondContact O-N 2.84Å; Y600-I603 PolarHBondContact O-N 2.86Å; E601-I603 PolarHBondContact O-N 3.01Å; I603-Q606 PolarHBondContact O-N 3.29Å; I603-H607 WeakPolarHBondContact O-CB 3.38Å; I603-H607 PolarHBondContact O-N 2.99Å; I603-H607 PolarHBondContact O-ND1 2.76Å
604	V	59.1	Low	51.7	Low	49 Å²	49	95.4 Å²	95.4	30%	0.297	48%	0.481	S	S	.	.	H	α-helix	trans	-64.6	-42.3	175.1	165.7	0	0	0	0	110.9	Y600 E601 H607 Q608	Y600-V604 HydrophobicContact CD1-CG2 4.04Å; Y600-V604 HydrophobicContact CE1-CG2 3.68Å; Y600-V604 HydrophobicContact CE2-CG2 4.43Å; Y600-V604 WeakPolarHBondContact O-CB 3.23Å; Y600-V604 VanDerWaalsContact O-CG2 3.28Å; Y600-V604 WeakPolarHBondContact O-CG2 3.35Å; Y600-V604 PolarHBondContact O-N 2.88Å; E601-V604 PolarHBondContact O-N 3.36Å; V604-H607 PolarHBondContact O-N 2.95Å; V604-Q608 VanDerWaalsContact CG1-NE2 3.31Å; V604-Q608 WeakPolarHBondContact O-CG 3.41Å; V604-Q608 PolarHBondContact O-N 2.79Å
605	N	59.5	Low	50.3	Low	60 Å²	60	101.9 Å²	101.9	32%	0.321	52%	0.515	S	S	.	.	H	α-helix	trans	-64.5	-42	177.4	-75.2	-44.9	0	0	0	111.8	E601 D602 Q608 Q609	E601-N605 WeakPolarHBondContact O-CB 3.35Å; E601-N605 VanDerWaalsContact O-CG 3.25Å; E601-N605 PolarHBondContact O-N 2.9Å; E601-N605 PolarHBondContact O-ND2 2.85Å; D602-N605 PolarHBondContact O-N 2.84Å; N605-Q608 PolarHBondContact O-N 3.25Å; N605-Q609 WeakPolarHBondContact O-CG 3.13Å; N605-Q609 PolarHBondContact O-N 2.77Å
606	Q	56.4	Low	49.2	Very low	107 Å²	107	102.1 Å²	102.1	50%	0.5	52%	0.515	S	S	.	.	H	α-helix	trans	-65.5	-39.2	174.2	-70.1	176.3	40.6	0	0	112.6	D602 I603 Q608 Q609 T610	D602-Q606 VanDerWaalsContact O-CG 3.32Å; D602-Q606 WeakPolarHBondContact O-CG 3.32Å; D602-Q606 PolarHBondContact O-N 2.91Å; I603-Q606 PolarHBondContact O-N 3.29Å; Q606-Q608 VanDerWaalsContact C-N 3.3Å; Q606-Q608 PolarHBondContact O-N 2.89Å; Q606-Q609 PolarHBondContact O-N 2.81Å; Q606-T610 WeakPolarHBondContact O-CG2 3.29Å; Q606-T610 PolarHBondContact O-N 3.13Å; Q606-T610 PolarHBondContact O-OG1 3.05Å
607	H	55.2	Low	48.3	Very low	103 Å²	103	105.7 Å²	105.7	48%	0.477	54%	0.539	S	S	.	.	H	α-helix	trans	-69.9	-22.8	174.8	-81.7	89	0	0	0	113.9	I603 V604 T610 K611	I603-H607 WeakPolarHBondContact O-CB 3.38Å; I603-H607 PolarHBondContact O-N 2.99Å; I603-H607 PolarHBondContact O-ND1 2.76Å; V604-H607 PolarHBondContact O-N 2.95Å; H607-T610 WeakPolarHBondContact CA-OG1 3.41Å; H607-T610 PolarHBondContact O-OG1 2.82Å; H607-K611 WeakPolarHBondContact O-CD 3.47Å; H607-K611 WeakPolarHBondContact O-CG 3.19Å
608	Q	48.7	Very low	47.6	Very low	113 Å²	113	107.4 Å²	107.4	53%	0.528	55%	0.548	S	S	.	.	H	α-helix	trans	-78.3	-47.7	169.7	-73.2	-177.1	55.8	0	0	111.1	V604 N605 Q606 T610 K611 T612	V604-Q608 VanDerWaalsContact CG1-NE2 3.31Å; V604-Q608 WeakPolarHBondContact O-CG 3.41Å; V604-Q608 PolarHBondContact O-N 2.79Å; N605-Q608 PolarHBondContact O-N 3.25Å; Q606-Q608 VanDerWaalsContact C-N 3.3Å; Q606-Q608 PolarHBondContact O-N 2.89Å; Q608-T610 VanDerWaalsContact C-N 3.35Å; Q608-T610 PolarHBondContact O-N 3.12Å; Q608-K611 WeakPolarHBondContact O-CA 3.36Å; Q608-K611 PolarHBondContact O-N 2.97Å; Q608-T612 PolarHBondContact O-N 3.28Å; Q608-T612 PolarHBondContact O-OG1 2.92Å
609	Q	46.5	Very low	47.1	Very low	120 Å²	120	107.9 Å²	107.9	56%	0.561	56%	0.556	S	S	*	*	H	α-helix	trans	-61	-39.9	-179.7	-71	177.9	27.6	0	0	113	N605 Q606 K611 T612 N613	N605-Q609 WeakPolarHBondContact O-CG 3.13Å; N605-Q609 PolarHBondContact O-N 2.77Å; Q606-Q609 PolarHBondContact O-N 2.81Å; Q609-K611 VanDerWaalsContact C-N 3.26Å; Q609-K611 PolarHBondContact O-N 2.9Å; Q609-T612 WeakPolarHBondContact CA-OG1 3.46Å; Q609-T612 PolarHBondContact O-N 3.32Å; Q609-T612 PolarHBondContact O-OG1 3.19Å; Q609-N613 WeakPolarHBondContact O-CB 3.37Å; Q609-N613 PolarHBondContact O-N 2.97Å; Q609-N613 VanDerWaalsContact O-N 3.11Å; Q609-N613 PolarHBondContact O-ND2 3.11Å; Q609-N613 PolarHBondContact O-OD1 2.7Å
610	T	46.4	Very low	46.4	Very low	90 Å²	90	113 Å²	113	55%	0.552	59%	0.59	S	S	*	*	H	α-helix	trans	-66.1	-25.7	174.5	46.3	0	0	0	0	113.3	Q606 H607 Q608	Q606-T610 WeakPolarHBondContact O-CG2 3.29Å; Q606-T610 PolarHBondContact O-N 3.13Å; Q606-T610 PolarHBondContact O-OG1 3.05Å; H607-T610 WeakPolarHBondContact CA-OG1 3.41Å; H607-T610 PolarHBondContact O-OG1 2.82Å; Q608-T610 VanDerWaalsContact C-N 3.35Å; Q608-T610 PolarHBondContact O-N 3.12Å
611	K	41.7	Very low	46	Very low	158 Å²	158	111.4 Å²	111.4	69%	0.687	60%	0.598	S	S	*	*	H	α-helix	trans	-85.2	-32.8	174.2	-72.7	175.5	-177.4	170.2	0	113.2	H607 Q608 Q609	H607-K611 WeakPolarHBondContact O-CD 3.47Å; H607-K611 WeakPolarHBondContact O-CG 3.19Å; Q608-K611 WeakPolarHBondContact O-CA 3.36Å; Q608-K611 PolarHBondContact O-N 2.97Å; Q609-K611 VanDerWaalsContact C-N 3.26Å; Q609-K611 PolarHBondContact O-N 2.9Å
612	T	44.2	Very low	45.4	Very low	84 Å²	84	111.1 Å²	111.1	52%	0.515	61%	0.607	S	S	.	*	H	α-helix	trans	-72	-34	176	52.6	0	0	0	0	112.7	Q608 Q609 H614 L615	Q608-T612 PolarHBondContact O-N 3.28Å; Q608-T612 PolarHBondContact O-OG1 2.92Å; Q609-T612 WeakPolarHBondContact CA-OG1 3.46Å; Q609-T612 PolarHBondContact O-N 3.32Å; Q609-T612 PolarHBondContact O-OG1 3.19Å; T612-H614 PolarHBondContact O-N 3.38Å; T612-L615 PolarHBondContact O-N 2.99Å
613	N	41.7	Very low	44.9	Very low	115 Å²	115	113 Å²	113	62%	0.615	62%	0.624	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.8	-7.6	-174.4	-68.1	-8.2	0	0	0	114.5	Q609	Q609-N613 WeakPolarHBondContact O-CB 3.37Å; Q609-N613 PolarHBondContact O-N 2.97Å; Q609-N613 VanDerWaalsContact O-N 3.11Å; Q609-N613 PolarHBondContact O-ND2 3.11Å; Q609-N613 PolarHBondContact O-OD1 2.7Å
614	H	43.3	Very low	44	Very low	172 Å²	172	117.3 Å²	117.3	80%	0.796	65%	0.653	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.8	6.8	177.6	-108.3	-65	0	0	0	114.9	T612	T612-H614 PolarHBondContact O-N 3.38Å
615	L	38.4	Very low	43	Very low	156 Å²	156	119.6 Å²	119.6	82%	0.817	67%	0.672	S	S	*	*			trans	-125.4	40.5	-178	-152.1	78.2	0	0	0	113.6	T612	T612-L615 PolarHBondContact O-N 2.99Å
616	L	30.9	Very low	41.8	Very low	141 Å²	141	121.6 Å²	121.6	74%	0.738	69%	0.69	S	S	*	*			trans	-123.2	67.4	-176.2	-79.4	168.9	0	0	0	113.4
617	T	35.5	Very low	40.7	Very low	127 Å²	127	121 Å²	121	78%	0.779	69%	0.688	S	S	*	*			trans	-144.4	134.2	166.6	-16	0	0	0	0	112.6
618	T	33.2	Very low	39.6	Very low	133 Å²	133	122.5 Å²	122.5	82%	0.816	70%	0.699	S	S	*	*			trans	59	77.3	166.4	56.6	0	0	0	0	119.6
619	T	39.3	Very low	38.8	Very low	139 Å²	139	118.7 Å²	118.7	85%	0.853	68%	0.684	S	S	*	*			trans	-146.3	145.8	141.5	39.1	0	0	0	0	110.9
620	P	39.7	Very low	38.2	Very low	116 Å²	116	119.3 Å²	119.3	75%	0.753	69%	0.692	S	S	*	*	P	Polyproline II helix	trans	-80.3	159.5	179.5	33.3	-35.5	0	0	0	113.3
621	P	39.6	Very low	37.6	Very low	122 Å²	122	123.6 Å²	123.6	79%	0.792	70%	0.703	S	S	*	*	P	Polyproline II helix	trans	-81.3	151.3	-168.8	32	-36.7	0	0	0	115
622	P	41.3	Very low	37.1	Very low	117 Å²	117	123.1 Å²	123.1	76%	0.76	71%	0.713	S	S	*	*	P	Polyproline II helix	trans	-87.4	157.6	175.5	35.8	-35.6	0	0	0	113.6
623	P	44.9	Very low	36.4	Very low	127 Å²	127	124.4 Å²	124.4	83%	0.825	72%	0.721	S	S	*	*	P	Polyproline II helix	trans	-77.8	151.9	172.4	32.6	-34.7	0	0	0	112.7
624	P	39.2	Very low	36	Very low	114 Å²	114	123.4 Å²	123.4	74%	0.74	73%	0.728	S	S	*	*			trans	-105.8	164.8	-163.6	39.5	-37.3	0	0	0	117.4
625	S	36.4	Very low	35.4	Very low	98 Å²	98	121.4 Å²	121.4	69%	0.685	72%	0.724	S	S	*	*			trans	75.8	124.6	147.2	70.8	0	0	0	0	122
626	S	36.1	Very low	34.9	Very low	101 Å²	101	125.6 Å²	125.6	71%	0.706	73%	0.73	S	S	*	*				-176.9	161.7	116.4	39.8	0	0	0	0	111
627	Q	32.7	Very low	35	Very low	96 Å²	96	124.1 Å²	124.1	45%	0.449	73%	0.727	S	S	.	*			trans	-148.3	151.9	-163.7	-46	91.5	-33.8	0	0	114.5	L823 F824	Q627-L823 HydrophobicContact CB-CB 4.14Å; Q627-L823 HydrophobicContact CB-CD1 4.12Å; Q627-L823 HydrophobicContact CG-CD1 3.66Å; Q627-F824 HydrophobicContact CB-CB 4.06Å; Q627-F824 HydrophobicContact CB-CD1 3.6Å; Q627-F824 HydrophobicContact CB-CD2 3.47Å; Q627-F824 VanDerWaalsContact CB-CD2 3.47Å; Q627-F824 HydrophobicContact CB-CE1 3.8Å; Q627-F824 HydrophobicContact CB-CE2 3.67Å; Q627-F824 HydrophobicContact CB-CG 3.44Å; Q627-F824 VanDerWaalsContact CB-CG 3.44Å; Q627-F824 HydrophobicContact CB-CZ 3.82Å; Q627-F824 HydrophobicContact CG-CD1 3.76Å; Q627-F824 HydrophobicContact CG-CD2 4.41Å; Q627-F824 HydrophobicContact CG-CE1 3.67Å; Q627-F824 HydrophobicContact CG-CE2 4.33Å; Q627-F824 HydrophobicContact CG-CG 4.15Å; Q627-F824 HydrophobicContact CG-CZ 3.96Å
628	L	32.2	Very low	34.6	Very low	134 Å²	134	125 Å²	125	70%	0.702	73%	0.727	S	S	*	*			trans	-155.6	171.4	162.4	-151	71.2	0	0	0	110.4	L823 F824	L628-L823 CarbonylContact O-C 2.92Å; L628-L823 WeakPolarHBondContact O-CA 3.43Å; L628-L823 PolarHBondContact O-N 3.28Å; L628-F824 WeakPolarHBondContact O-CB 3.43Å; L628-F824 PolarHBondContact O-N 3.4Å
629	S	32.3	Very low	34.3	Very low	33 Å²	33	126.6 Å²	126.6	23%	0.231	73%	0.731	C	S	.	*			trans	-135.1	164.6	-175.9	52.9	0	0	0	0	111	N825	S629-N825 PolarHBondContact OG-ND2 2.96Å
630	N	33.7	Very low	34	Very low	133 Å²	133	124.7 Å²	124.7	71%	0.711	72%	0.723	S	S	*	*				-176.3	170.6	70.3	-112.6	-47.9	0	0	0	116.5
631	K	33.5	Very low	33.6	Very low	180 Å²	180	129.3 Å²	129.3	78%	0.783	73%	0.731	S	S	*	*			trans	-54.3	161.8	173	-52.8	160.1	-178.6	173.8	0	115.1
632	T	31.5	Very low	33.2	Very low	148 Å²	148	131.8 Å²	131.8	91%	0.908	73%	0.732	S	S	*	*			trans	-155.8	151.7	131.6	-74.3	0	0	0	0	110
633	T	29.8	Very low	32.7	Very low	110 Å²	110	133.6 Å²	133.6	68%	0.675	73%	0.727	S	S	*	*			trans	-115.1	140.5	-162.9	-48.5	0	0	0	0	113.6
634	A	32.2	Very low	31.9	Very low	94 Å²	94	134.5 Å²	134.5	78%	0.777	72%	0.723	S	S	*	*			trans	-157.7	102.5	150.2	0	0	0	0	0	108.7
635	N	30.1	Very low	31.6	Very low	131 Å²	131	133.1 Å²	133.1	70%	0.701	72%	0.716	S	S	*	*				58.3	94.3	82.1	-71.6	2.8	0	0	0	114.5
636	Y	29.2	Very low	31.3	Very low	243 Å²	243	134.5 Å²	134.5	95%	0.953	71%	0.711	S	S	*	*			trans	-142.3	155.3	130.9	-108.7	-80.4	0	0	0	109
637	V	31.8	Very low	31	Very low	110 Å²	110	138.9 Å²	138.9	67%	0.667	71%	0.714	S	S	*	*			trans	-127.6	140.8	-155.8	169.9	0	0	0	0	111.7
638	N	28	Very low	31	Very low	145 Å²	145	141.9 Å²	141.9	78%	0.775	73%	0.726	S	S	*	*			trans	46.6	110.1	165.1	-62.6	-11.8	0	0	0	118.9
639	D	28	Very low	31	Very low	168 Å²	168	140.6 Å²	140.6	90%	0.898	72%	0.719	S	S	*	*				-168	86.9	126	-114	-18.9	0	0	0	112.7
640	S	31	Very low	30.9	Very low	98 Å²	98	145.9 Å²	145.9	69%	0.685	74%	0.744	S	S	*	*			trans	-163.7	26.2	179.1	47.5	0	0	0	0	116.2	H642	S640-H642 VanDerWaalsContact C-N 3.26Å; S640-H642 PolarHBondContact O-N 3.49Å
641	K	31.3	Very low	30.8	Very low	213 Å²	213	147.9 Å²	147.9	93%	0.926	75%	0.749	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.8	7.9	178.9	-103.7	-167.6	176.7	-169.5	0	116.2
642	H	31.6	Very low	30.7	Very low	174 Å²	174	148.7 Å²	148.7	81%	0.806	75%	0.749	S	S	*	*	T	Hydrogen-bonded Turn	trans	-136.3	17.2	-170.5	-105.3	-65.9	0	0	0	116	S640	S640-H642 VanDerWaalsContact C-N 3.26Å; S640-H642 PolarHBondContact O-N 3.49Å
643	K	31.4	Very low	30.6	Very low	155 Å²	155	145.4 Å²	145.4	67%	0.674	74%	0.737	S	S	*	*	S	Bend	trans	-132.4	10.6	-175.8	-83.4	-163.1	168.4	-168.7	0	117.1
644	M	28.6	Very low	30.7	Very low	147 Å²	147	146.2 Å²	146.2	72%	0.724	73%	0.734	S	S	*	*	S	Bend	trans	-96	-11.8	-178.5	-148	169.7	-69.1	0	0	113.8
645	S	31.4	Very low	30.3	Very low	85 Å²	85	153.3 Å²	153.3	59%	0.594	74%	0.741	S	S	*	*	S	Bend	trans	-81.5	-31.5	179.6	46.8	0	0	0	0	114.1
646	E	30.1	Very low	30.4	Very low	126 Å²	126	152.7 Å²	152.7	59%	0.589	74%	0.736	S	S	*	*	S	Bend	trans	-76.4	-28.3	-175.2	-65.3	177.6	121.3	0	0	113.3
647	Y	29.7	Very low	30.2	Very low	194 Å²	194	146.4 Å²	146.4	76%	0.761	73%	0.725	S	S	*	*	S	Bend	trans	-82.6	-17.2	-173.5	-87.3	-83	0	0	0	115
648	F	33.2	Very low	29.9	Very low	159 Å²	159	152.5 Å²	152.5	70%	0.697	74%	0.738	S	S	*	*	S	Bend	trans	-86.9	-14.3	178.6	-84.4	-84	0	0	0	114.2
649	L	32.7	Very low	29.9	Very low	107 Å²	107	155.1 Å²	155.1	56%	0.56	74%	0.737	S	S	*	*	S	Bend	trans	-78.3	-26.5	-177.9	-97.7	68.9	0	0	0	114.4
650	N	30.3	Very low	29.7	Very low	143 Å²	143	155.9 Å²	155.9	77%	0.765	74%	0.735	S	S	*	*	S	Bend	trans	-103.2	-15.9	-161.2	-85.7	-28.5	0	0	0	117.3
651	E	32.6	Very low	29.7	Very low	175 Å²	175	157.1 Å²	157.1	82%	0.818	73%	0.73	S	S	*	*	S	Bend	trans	-115.1	-13.4	-179.1	-72.2	-165.9	122.3	0	0	115.1
652	Y	31.2	Very low	29.6	Very low	198 Å²	198	149.7 Å²	149.7	78%	0.776	71%	0.713	S	S	*	*			trans	-115.4	19.7	177	-83.9	-85.6	0	0	0	114.4	M654	Y652-M654 PolarHBondContact O-N 3.2Å
653	A	29.4	Very low	29.7	Very low	79 Å²	79	146.5 Å²	146.5	65%	0.653	70%	0.702	S	S	*	*	S	Bend	trans	-64.9	82.4	156	0	0	0	0	0	109	R655	A653-R655 PolarHBondContact O-N 3.13Å; A653-R655 VanDerWaalsContact O-N 3.17Å
654	M	30.2	Very low	29.6	Very low	126 Å²	126	145.2 Å²	145.2	62%	0.621	70%	0.698	S	S	*	*			trans	-51.3	118.8	-172.4	-90.6	-87.4	-79.1	0	0	111.6	Y591 Y652 I656	Y591-M654 HydrophobicContact CE1-CE 4.34Å; Y652-M654 PolarHBondContact O-N 3.2Å; M654-I656 PolarHBondContact O-N 3.25Å
655	R	25.4	Very low	29.6	Very low	244 Å²	244	141.1 Å²	141.1	92%	0.921	69%	0.688	S	S	*	*			trans	-68.8	73.6	167.9	-69.5	-175	177.8	-168.4	-0.3	110.3	A653 P657	A653-R655 PolarHBondContact O-N 3.13Å; A653-R655 VanDerWaalsContact O-N 3.17Å; R655-P657 WeakPolarHBondContact O-CD 3.08Å
656	I	30.6	Very low	29.8	Very low	117 Å²	117	142.8 Å²	142.8	60%	0.6	69%	0.686	S	S	*	*			trans	-59.7	124.8	160.5	-59	178.5	0	0	0	106.2	M654 Y658	M654-I656 PolarHBondContact O-N 3.25Å; I656-Y658 PolarHBondContact O-N 2.74Å; I656-Y658 VanDerWaalsContact O-N 3.12Å
657	P	26.6	Very low	29.9	Very low	111 Å²	111	142 Å²	142	72%	0.721	68%	0.681	S	S	*	*			trans	-60.6	119.4	177.6	-23.3	34.1	0	0	0	110	R655 R659	R655-P657 WeakPolarHBondContact O-CD 3.08Å; P657-R659 VanDerWaalsContact C-N 3.25Å; P657-R659 PolarHBondContact O-N 3.37Å
658	Y	25.3	Very low	29.9	Very low	239 Å²	239	142.5 Å²	142.5	94%	0.937	68%	0.682	S	S	*	*			trans	-64.8	90.1	168.6	-117.4	-98.1	0	0	0	108.2	I656	I656-Y658 PolarHBondContact O-N 2.74Å; I656-Y658 VanDerWaalsContact O-N 3.12Å
659	R	26.3	Very low	30	Very low	200 Å²	200	138.5 Å²	138.5	76%	0.755	67%	0.667	S	S	*	*			trans	-96	119	168.8	-163.1	176.3	-160.7	167.6	5.8	107.2	P657 H661	P657-R659 VanDerWaalsContact C-N 3.25Å; P657-R659 PolarHBondContact O-N 3.37Å; R659-H661 PolarHBondContact O-N 3.44Å
660	E	25.4	Very low	30	Very low	184 Å²	184	140.2 Å²	140.2	86%	0.86	67%	0.666	S	S	*	*			trans	-63.5	96.2	-177.1	-65.1	177.3	132.5	0	0	110.9
661	H	31.1	Very low	29.8	Very low	124 Å²	124	142.1 Å²	142.1	57%	0.574	66%	0.662	S	S	*	*			trans	-125.1	52.9	174.1	-76.3	-19.7	0	0	0	110.2	R659	R659-H661 PolarHBondContact O-N 3.44Å
662	G	27.5	Very low	29.5	Very low	56 Å²	56	139.5 Å²	139.5	58%	0.577	66%	0.662	S	S	*	*	S	Bend	trans	-55	143.3	160.4	0	0	0	0	0	110.5	H664	G662-H664 PolarHBondContact O-CD2 3.33Å; G662-H664 PolarHBondContact O-N 3.48Å
663	D	33.8	Very low	29.3	Very low	107 Å²	107	137.7 Å²	137.7	57%	0.572	67%	0.665	S	S	*	*	S	Bend	trans	55	-20.7	174.8	-72.7	9.1	0	0	0	120.5	A665 K667	D663-A665 VanDerWaalsContact C-N 3.34Å; D663-A665 PolarHBondContact O-N 2.93Å; D663-K667 HydrophobicContact CB-CD 4.1Å; D663-K667 WeakPolarHBondContact O-CG 3.3Å; D663-K667 PolarHBondContact O-N 3.23Å; D663-K667 IonicContact OD2-NZ 3.13Å; D663-K667 PolarHBondContact OD2-NZ 2.79Å
664	H	29.5	Very low	29.3	Very low	128 Å²	128	140 Å²	140	59%	0.593	67%	0.671	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75	-19.6	-166.1	-76	-69.5	0	0	0	114.4	G662	G662-H664 PolarHBondContact O-CD2 3.33Å; G662-H664 PolarHBondContact O-N 3.48Å
665	A	29.9	Very low	29.2	Very low	62 Å²	62	142.3 Å²	142.3	51%	0.512	69%	0.687	S	S	.	*	T	Hydrogen-bonded Turn	trans	-73.9	-50.6	174	0	0	0	0	0	112.2	D663 K667 R668	D663-A665 VanDerWaalsContact C-N 3.34Å; D663-A665 PolarHBondContact O-N 2.93Å; A665-K667 PolarHBondContact O-N 3.31Å; A665-R668 WeakPolarHBondContact O-CB 3.34Å; A665-R668 PolarHBondContact O-N 3.25Å
666	H	35.6	Very low	29.5	Very low	119 Å²	119	134.7 Å²	134.7	55%	0.551	67%	0.671	S	S	*	*	H	α-helix	trans	-62.6	-32.1	176.7	-66.7	-23.2	0	0	0	112.3	R668 R670	H666-R668 PolarHBondContact O-N 3.15Å; H666-R670 PolarHBondContact O-N 2.78Å
667	K	31	Very low	29.4	Very low	109 Å²	109	137 Å²	137	47%	0.474	69%	0.685	S	S	.	*	H	α-helix	trans	-72	-3.7	171.9	-69.3	170	-173.5	161.9	0	114.3	D663 A665	D663-K667 HydrophobicContact CB-CD 4.1Å; D663-K667 WeakPolarHBondContact O-CG 3.3Å; D663-K667 PolarHBondContact O-N 3.23Å; D663-K667 IonicContact OD2-NZ 3.13Å; D663-K667 PolarHBondContact OD2-NZ 2.79Å; A665-K667 PolarHBondContact O-N 3.31Å
668	R	30.1	Very low	29.6	Very low	206 Å²	206	139.7 Å²	139.7	78%	0.777	69%	0.687	S	S	*	*	H	α-helix	trans	-96.3	-30.7	-179.9	-137.8	177.3	-164.2	-177	4.9	113.9	A665 H666	A665-R668 WeakPolarHBondContact O-CB 3.34Å; A665-R668 PolarHBondContact O-N 3.25Å; H666-R668 PolarHBondContact O-N 3.15Å
669	I	35.5	Very low	29.9	Very low	75 Å²	75	137.4 Å²	137.4	39%	0.385	68%	0.684	S	S	.	*	H	α-helix	trans	-90.3	-32.2	175.4	-62.1	175.8	0	0	0	111	Y545 W557 R671	Y545-I669 HydrophobicContact CE2-CG2 4.48Å; W557-I669 HydrophobicContact CG-CD1 4.4Å; I669-R671 PolarHBondContact O-N 2.97Å
670	R	31.9	Very low	29.9	Very low	143 Å²	143	136.5 Å²	136.5	54%	0.54	69%	0.689	S	S	.	*	S	Bend	trans	-72.7	61.7	165.6	-71.7	-174.2	173.8	-180	-2.6	111.5	E409 H666	E409-R670 IonicContact OE1-CZ 2.86Å; E409-R670 VanDerWaalsContact OE1-CZ 3.31Å; E409-R670 IonicContact OE1-NH1 3.11Å; E409-R670 PolarHBondContact OE1-NH1 2.66Å; E409-R670 IonicContact OE1-NH2 3.21Å; E409-R670 PolarHBondContact OE1-NH2 2.79Å; E409-R670 IonicContact OE2-NH1 3.56Å; E409-R670 PolarHBondContact OE2-NH1 2.91Å; H666-R670 PolarHBondContact O-N 2.78Å
671	R	27.1	Very low	29.9	Very low	183 Å²	183	135 Å²	135	69%	0.691	68%	0.682	S	S	*	*			trans	-134.7	58.7	176.1	-85.8	-166.3	172.1	-152.4	-6.6	113.9	I669	I669-R671 PolarHBondContact O-N 2.97Å
672	C	26.9	Very low	29.7	Very low	120 Å²	120	135.4 Å²	135.4	81%	0.811	69%	0.693	S	S	*	*	S	Bend	trans	-116.3	131.1	149.7	-60.9	0	0	0	0	107.1
673	N	26.2	Very low	29.6	Very low	159 Å²	159	139.1 Å²	139.1	85%	0.85	70%	0.697	S	S	*	*	S	Bend	trans	56.4	80.8	-176.5	-65.1	-5	0	0	0	116.6
674	T	30.1	Very low	29.1	Very low	127 Å²	127	139.4 Å²	139.4	78%	0.779	71%	0.707	S	S	*	*			trans	-170.8	105	132.9	16	0	0	0	0	109.9	S676	T674-S676 PolarHBondContact O-N 2.91Å; T674-S676 VanDerWaalsContact O-N 3.15Å
675	D	27.1	Very low	28.9	Very low	176 Å²	176	140.2 Å²	140.2	94%	0.941	71%	0.714	S	S	*	*			trans	-80.5	90.6	171.2	-80.1	-43.2	0	0	0	110.3	N677	D675-N677 PolarHBondContact O-N 2.96Å
676	S	31.5	Very low	28.7	Very low	84 Å²	84	140.6 Å²	140.6	59%	0.587	72%	0.724	S	S	*	*			trans	-85.4	86	175.4	65.7	0	0	0	0	111.2	T674 H678	T674-S676 PolarHBondContact O-N 2.91Å; T674-S676 VanDerWaalsContact O-N 3.15Å; S676-H678 PolarHBondContact O-N 2.68Å
677	N	29.6	Very low	28.2	Very low	166 Å²	166	140.2 Å²	140.2	89%	0.888	73%	0.73	S	S	*	*			trans	-60	132.6	161.1	-90.6	-35.5	0	0	0	109.4	D675	D675-N677 PolarHBondContact O-N 2.96Å
678	H	31	Very low	28	Very low	167 Å²	167	141.7 Å²	141.7	77%	0.773	75%	0.748	S	S	*	*			trans	-135	85	-171.9	-145	70.3	0	0	0	112	S676	S676-H678 PolarHBondContact O-N 2.68Å
679	H	30.4	Very low	27.9	Very low	190 Å²	190	137 Å²	137	88%	0.88	74%	0.742	S	S	*	*			trans	-157.2	148.1	156.3	-76.4	-50.8	0	0	0	105.9
680	Q	27.7	Very low	27.6	Very low	181 Å²	181	140.8 Å²	140.8	85%	0.846	76%	0.763	S	S	*	*			cis	-147.2	150.3	19.3	-157.3	165.6	12.6	0	0	110.6
681	E	25	Very low	27.4	Very low	153 Å²	153	141 Å²	141	72%	0.715	78%	0.775	S	S	*	*			trans	-71.5	137.6	172.2	-65.6	173.2	97.9	0	0	111.5	M683	E681-M683 WeakPolarHBondContact OE1-CE 3.42Å
682	V	26.6	Very low	27.4	Very low	133 Å²	133	136.9 Å²	136.9	81%	0.806	77%	0.774	S	S	*	*			trans	-131.9	98.3	145.9	-179.6	0	0	0	0	107.5
683	M	24.8	Very low	27.4	Very low	134 Å²	134	137.5 Å²	137.5	66%	0.66	77%	0.77	S	S	*	*			trans	-66.2	142.3	166	-63.7	-169.2	-166.2	0	0	109.6	E681	E681-M683 WeakPolarHBondContact OE1-CE 3.42Å
684	S	24.5	Very low	27.5	Very low	112 Å²	112	136.3 Å²	136.3	78%	0.783	76%	0.762	S	S	*	*			trans	-139.7	86.4	162.8	-77	0	0	0	0	108.5	G686	S684-G686 PolarHBondContact O-N 3.25Å
685	I	24.1	Very low	27.4	Very low	145 Å²	145	138.1 Å²	138.1	74%	0.744	76%	0.761	S	S	*	*			trans	-70.8	112.7	180	-63.9	172.5	0	0	0	108.3	V687	I685-V687 HydrophobicContact CG2-CG2 4.42Å
686	G	26	Very low	27.4	Very low	71 Å²	71	135.8 Å²	135.8	73%	0.732	75%	0.749	S	S	*	*			trans	-116.7	29.4	-179.9	0	0	0	0	0	113.8	S684 V688	S684-G686 PolarHBondContact O-N 3.25Å; G686-V688 PolarHBondContact O-N 3.36Å
687	V	25.7	Very low	27.3	Very low	110 Å²	110	137.5 Å²	137.5	67%	0.667	76%	0.756	S	S	*	*			trans	-76.4	112.6	179.8	-179.9	0	0	0	0	109.9	I685 T689	I685-V687 HydrophobicContact CG2-CG2 4.42Å; V687-T689 HydrophobicContact CG1-CG2 3.94Å
688	V	27.1	Very low	27.1	Very low	141 Å²	141	136.2 Å²	136.2	86%	0.855	75%	0.749	S	S	*	*			trans	-114.7	84.8	166	-176.3	0	0	0	0	108.7	G686	G686-V688 PolarHBondContact O-N 3.36Å
689	T	26.1	Very low	27.1	Very low	106 Å²	106	136.4 Å²	136.4	65%	0.65	75%	0.75	S	S	*	*			trans	-86.7	136.4	161.4	47.5	0	0	0	0	109.6	V687	V687-T689 HydrophobicContact CG1-CG2 3.94Å
690	N	30.9	Very low	26.9	Very low	156 Å²	156	134.3 Å²	134.3	83%	0.834	75%	0.745	S	S	*	*			trans	-160.6	131.5	148.2	-100.3	-29.9	0	0	0	109.7
691	D	26.8	Very low	27	Very low	148 Å²	148	130.2 Å²	130.2	79%	0.791	74%	0.737	S	S	*	*			trans	-71.2	159.1	-179.8	-49.9	-88.5	0	0	0	111.3
692	S	28.2	Very low	27.1	Very low	96 Å²	96	130 Å²	130	67%	0.671	74%	0.74	S	S	*	*				169.2	162.6	71.8	46.7	0	0	0	0	113.4
693	N	27.2	Very low	27.1	Very low	133 Å²	133	129.8 Å²	129.8	71%	0.711	73%	0.734	S	S	*	*			trans	70.2	93.9	150.5	-61.1	-21	0	0	0	121.7
694	I	26.5	Very low	27.2	Very low	134 Å²	134	132.6 Å²	132.6	69%	0.687	74%	0.742	S	S	*	*				48.4	109.2	109.8	-53.9	156.5	0	0	0	117.8
695	H	29.6	Very low	27.4	Very low	164 Å²	164	131.7 Å²	131.7	76%	0.759	74%	0.735	S	S	*	*				-168.3	155.2	106.3	-109.9	-72.1	0	0	0	113.1
696	D	26.8	Very low	27.5	Very low	127 Å²	127	132.2 Å²	132.2	68%	0.679	74%	0.74	S	S	*	*			trans	-14.1	154.5	162.2	-50.5	-47.3	0	0	0	118.9
697	T	28.8	Very low	27.6	Very low	121 Å²	121	136 Å²	136	74%	0.742	74%	0.742	S	S	*	*			cis	-162.5	152.1	40.8	-34.5	0	0	0	0	114.2
698	N	26.3	Very low	27.7	Very low	139 Å²	139	138 Å²	138	74%	0.743	75%	0.754	S	S	*	*			trans	-14	136.2	161.4	-54.9	-54.2	0	0	0	118.8
699	Q	30.5	Very low	27.8	Very low	171 Å²	171	134.6 Å²	134.6	80%	0.799	74%	0.737	S	S	*	*				-175.7	132.9	94.9	-96.2	179.2	41.6	0	0	113.9
700	N	26.6	Very low	27.9	Very low	145 Å²	145	135 Å²	135	78%	0.775	74%	0.739	S	S	*	*			trans	30.3	129.7	130.8	-62.4	-16.4	0	0	0	118.7
701	S	28.8	Very low	27.8	Very low	96 Å²	96	134.5 Å²	134.5	67%	0.671	73%	0.731	S	S	*	*			cis	178.8	159.2	23.7	43.8	0	0	0	0	115.5
702	L	27.3	Very low	27.8	Very low	147 Å²	147	132.8 Å²	132.8	77%	0.77	73%	0.731	S	S	*	*			trans	69.4	110.1	140.6	-74.3	165	0	0	0	122.3
703	L	26.8	Very low	27.9	Very low	130 Å²	130	133.2 Å²	133.2	68%	0.681	73%	0.73	S	S	*	*				104.5	115.2	126.7	-67.8	163.8	0	0	0	121.7
704	K	26.7	Very low	27.8	Very low	193 Å²	193	134.6 Å²	134.6	84%	0.839	74%	0.737	S	S	*	*			trans	73.3	148.6	140.8	-71.2	178.4	177.1	-175.7	0	117.3
705	S	28.6	Very low	28	Very low	92 Å²	92	133.7 Å²	133.7	64%	0.643	74%	0.743	S	S	*	*			cis	-151.2	165.2	8	42.1	0	0	0	0	113.6
706	D	26.4	Very low	27.7	Very low	156 Å²	156	133.3 Å²	133.3	83%	0.834	74%	0.744	S	S	*	*			trans	57.9	90.6	152.7	-49.5	-22.3	0	0	0	119.7
707	I	28.1	Very low	27.8	Very low	151 Å²	151	133.8 Å²	133.8	77%	0.774	74%	0.743	S	S	*	*			trans	-128.5	128.7	159.2	-62.7	176.3	0	0	0	108	S709	I707-S709 PolarHBondContact O-N 2.77Å
708	V	28.8	Very low	27.8	Very low	151 Å²	151	137.7 Å²	137.7	92%	0.915	74%	0.744	S	S	*	*			trans	-80.1	106.2	170.2	176.7	0	0	0	0	108.3
709	S	27.8	Very low	27.8	Very low	71 Å²	71	140.3 Å²	140.3	50%	0.497	75%	0.745	S	S	.	*			trans	-80	125.4	-174.5	45.1	0	0	0	0	113	I707 H711	I707-S709 PolarHBondContact O-N 2.77Å; S709-H711 PolarHBondContact O-N 2.91Å; S709-H711 PolarHBondContact OG-CD2 2.86Å; S709-H711 PolarHBondContact OG-NE2 3.43Å
710	T	29.4	Very low	27.7	Very low	114 Å²	114	139.8 Å²	139.8	70%	0.699	74%	0.74	S	S	*	*			trans	-69.1	96.7	160.9	48.9	0	0	0	0	109.3	S712	T710-S712 PolarHBondContact O-N 3.05Å
711	H	29.2	Very low	27.6	Very low	145 Å²	145	139.4 Å²	139.4	67%	0.671	74%	0.738	S	S	*	*			trans	-77.4	84.9	177.3	-87.4	-76.7	0	0	0	112.3	S709	S709-H711 PolarHBondContact O-N 2.91Å; S709-H711 PolarHBondContact OG-CD2 2.86Å; S709-H711 PolarHBondContact OG-NE2 3.43Å
712	S	26.5	Very low	27.6	Very low	113 Å²	113	139 Å²	139	79%	0.79	74%	0.735	S	S	*	*			trans	-83.2	110.6	150.6	43.6	0	0	0	0	108.9	T710	T710-S712 PolarHBondContact O-N 3.05Å
713	T	29.8	Very low	27.7	Very low	105 Å²	105	139.4 Å²	139.4	64%	0.644	73%	0.733	S	S	*	*			trans	-121.6	110.8	174.5	50	0	0	0	0	110.5
714	N	25.5	Very low	27.7	Very low	161 Å²	161	138.7 Å²	138.7	86%	0.861	73%	0.73	S	S	*	*			trans	-66.7	129.9	167.7	-74	-42.6	0	0	0	110.1
715	S	29.3	Very low	27.9	Very low	115 Å²	115	136.3 Å²	136.3	80%	0.804	72%	0.722	S	S	*	*			trans	-132	84.1	165	-70.8	0	0	0	0	109.1
716	I	24.5	Very low	27.8	Very low	156 Å²	156	141 Å²	141	80%	0.8	73%	0.733	S	S	*	*			trans	-83.8	118	167	-62.9	171	0	0	0	107.2
717	E	29.3	Very low	28	Very low	138 Å²	138	137.2 Å²	137.2	65%	0.645	73%	0.731	S	S	*	*			trans	-176.1	128.1	140.3	-101.3	-176.7	157.4	0	0	109.4
718	R	28.8	Very low	28.1	Very low	202 Å²	202	137.9 Å²	137.9	76%	0.762	74%	0.736	S	S	*	*				61.4	131.6	91.7	-69.1	-158.4	-81.4	-160.4	-4	113.7
719	Y	25.4	Very low	28	Very low	194 Å²	194	139.9 Å²	139.9	76%	0.761	73%	0.732	S	S	*	*			cis	-166.9	151.9	-6.8	-144.4	-132.3	0	0	0	108.1
720	F	28.2	Very low	28.1	Very low	161 Å²	161	141.9 Å²	141.9	71%	0.706	75%	0.746	S	S	*	*			trans	39.7	111.2	158.3	-80.4	-110	0	0	0	121.6
721	D	24.7	Very low	28.2	Very low	137 Å²	137	142.4 Å²	142.4	73%	0.733	75%	0.75	S	S	*	*				57.1	142.6	113.6	-151.6	-9.7	0	0	0	122.2
722	S	28	Very low	28.3	Very low	87 Å²	87	142.4 Å²	142.4	61%	0.608	75%	0.754	S	S	*	*			trans	82	117.1	150.9	-82.4	0	0	0	0	122.8
723	Q	29.2	Very low	28.4	Very low	155 Å²	155	141.6 Å²	141.6	72%	0.724	75%	0.748	S	S	*	*			trans	80.4	100.7	130	-63.4	-68.1	-24.9	0	0	121.4
724	N	27	Very low	28.4	Very low	116 Å²	116	141.7 Å²	141.7	62%	0.62	75%	0.748	S	S	*	*				83.6	146.6	119.3	-119.8	-46.2	0	0	0	122.3
725	Q	30.8	Very low	28.6	Very low	142 Å²	142	141.3 Å²	141.3	66%	0.664	75%	0.747	S	S	*	*			trans	61.8	109.3	158.8	-78.3	150.8	67.2	0	0	119.7
726	Q	26.6	Very low	28.7	Very low	190 Å²	190	139.9 Å²	139.9	89%	0.888	74%	0.742	S	S	*	*				78.4	115.6	83.3	-76.1	-178.4	22.7	0	0	115.1
727	G	30.7	Very low	29	Very low	77 Å²	77	138 Å²	138	79%	0.794	74%	0.742	S	S	*	*			trans	178.9	89.8	174.4	0	0	0	0	0	117.3
728	L	30.3	Very low	28.9	Very low	166 Å²	166	140.1 Å²	140.1	87%	0.869	75%	0.752	S	S	*	*			trans	4.1	118.4	154.4	-56.3	165.4	0	0	0	118.5
729	K	27.5	Very low	29	Very low	193 Å²	193	136.2 Å²	136.2	84%	0.839	75%	0.753	S	S	*	*				88.7	145.2	63.6	-92.9	-164.4	172.6	-175.9	0	116.9
730	S	29	Very low	29.2	Very low	113 Å²	113	132 Å²	132	79%	0.79	75%	0.752	S	S	*	*			trans	72.5	142.2	173.9	74.7	0	0	0	0	115.6
731	T	31.6	Very low	29.1	Very low	125 Å²	125	134.8 Å²	134.8	77%	0.767	76%	0.759	S	S	*	*			cis	-155.9	168	-0.4	-4.7	0	0	0	0	107.1
732	L	30.8	Very low	29.3	Very low	145 Å²	145	134.8 Å²	134.8	76%	0.759	76%	0.759	S	S	*	*			cis	-129.6	155.5	14.8	-75.2	92.3	0	0	0	110.4
733	S	28.8	Very low	29.6	Very low	95 Å²	95	137.9 Å²	137.9	66%	0.664	77%	0.768	S	S	*	*				49.4	133.2	91.5	105.8	0	0	0	0	116.8
734	T	31.4	Very low	29.6	Very low	107 Å²	107	141.2 Å²	141.2	66%	0.656	77%	0.774	S	S	*	*			cis	-154.5	152.2	14.4	-22.5	0	0	0	0	112.3
735	D	29.1	Very low	29.9	Very low	154 Å²	154	138.8 Å²	138.8	82%	0.824	77%	0.77	S	S	*	*			trans	59	136.3	159.4	-56.3	-32.9	0	0	0	120.5
736	A	31.7	Very low	30.3	Very low	85 Å²	85	136.1 Å²	136.1	70%	0.702	76%	0.764	S	S	*	*			cis	-146.3	152.7	0.8	0	0	0	0	0	113.6
737	S	31.1	Very low	30.7	Very low	116 Å²	116	132.3 Å²	132.3	81%	0.811	75%	0.746	S	S	*	*			trans	25.2	120.3	159.1	55.9	0	0	0	0	121.2
738	Q	26.3	Very low	30.9	Very low	183 Å²	183	133.4 Å²	133.4	86%	0.855	73%	0.733	S	S	*	*	P	Polyproline II helix	trans	-67.6	157.1	172.3	-49	-163.9	-89.4	0	0	114.5
739	P	30.7	Very low	31.2	Very low	120 Å²	120	131.3 Å²	131.3	78%	0.779	72%	0.718	S	S	*	*	P	Polyproline II helix	trans	-76.8	138.9	148.2	33.5	-30.6	0	0	0	110.4
740	S	30	Very low	31.7	Very low	105 Å²	105	128.9 Å²	128.9	73%	0.734	71%	0.708	S	S	*	*	P	Polyproline II helix	trans	-77.5	154.1	175.3	-164.7	0	0	0	0	112	D742	S740-D742 PolarHBondContact O-N 3.45Å
741	Y	26.6	Very low	32	Very low	220 Å²	220	129.9 Å²	129.9	86%	0.863	70%	0.7	S	S	*	*	S	Bend	trans	-71.5	109.1	159.7	-81.5	-110.2	0	0	0	108.5
742	D	28.3	Very low	32	Very low	136 Å²	136	129.1 Å²	129.1	73%	0.727	69%	0.688	S	S	*	*			trans	-164.5	28.7	164.8	-95.7	-37.6	0	0	0	113.5	S740	S740-D742 PolarHBondContact O-N 3.45Å
743	L	33.7	Very low	32.1	Very low	152 Å²	152	129.4 Å²	129.4	80%	0.796	69%	0.685	S	S	*	*	S	Bend	trans	-121.4	0.1	-175.1	-93.9	165.7	0	0	0	116.1
744	W	30.4	Very low	32.3	Very low	226 Å²	226	134 Å²	134	86%	0.856	69%	0.689	S	S	*	*	H	α-helix	trans	-91.3	-11.4	176.7	-128.1	-59	0	0	0	113.9
745	A	33.4	Very low	32.4	Very low	64 Å²	64	131.4 Å²	131.4	53%	0.529	68%	0.675	S	S	.	*	H	α-helix	trans	-85.4	-27	-179.2	0	0	0	0	0	113.7	H749	A745-H749 PolarHBondContact O-ND1 2.64Å
746	T	38.3	Very low	32.3	Very low	87 Å²	87	130.7 Å²	130.7	53%	0.534	67%	0.672	S	S	.	*	H	α-helix	trans	-87.8	-35.8	-170.7	-25.7	0	0	0	0	112.9	L748 H749 K750	T746-L748 VanDerWaalsContact C-N 3.31Å; T746-H749 PolarHBondContact O-N 2.68Å; T746-K750 PolarHBondContact O-N 3.33Å
747	E	35	Very low	32.3	Very low	109 Å²	109	135.6 Å²	135.6	51%	0.509	68%	0.68	S	S	.	*	H	α-helix	trans	-69.2	-31.5	175.1	-172.3	60.4	-160.6	0	0	111.6	H749 K750 Q751	E747-H749 VanDerWaalsContact C-N 3.32Å; E747-H749 PolarHBondContact O-N 3.4Å; E747-K750 PolarHBondContact O-N 3.29Å; E747-Q751 PolarHBondContact O-N 3.41Å; E747-Q751 VanDerWaalsContact O-N 3.08Å
748	L	35.2	Very low	32.2	Very low	100 Å²	100	139.4 Å²	139.4	52%	0.524	68%	0.682	S	S	.	*	H	α-helix	trans	-61.2	-38.9	171	-93.7	165.7	0	0	0	112.1	T746 Q751 Q752	T746-L748 VanDerWaalsContact C-N 3.31Å; L748-Q751 PolarHBondContact O-N 3.24Å; L748-Q752 WeakPolarHBondContact O-CG 3.42Å; L748-Q752 PolarHBondContact O-N 2.85Å
749	H	37.3	Very low	32.6	Very low	122 Å²	122	137.6 Å²	137.6	57%	0.565	67%	0.673	S	S	*	*	H	α-helix	trans	-66.9	-40.9	175.3	-80.1	81.1	0	0	0	112.3	A745 T746 E747 Q751 Q752 E753	A745-H749 PolarHBondContact O-ND1 2.64Å; T746-H749 PolarHBondContact O-N 2.68Å; E747-H749 VanDerWaalsContact C-N 3.32Å; E747-H749 PolarHBondContact O-N 3.4Å; H749-Q751 VanDerWaalsContact C-N 3.28Å; H749-Q751 PolarHBondContact O-N 2.97Å; H749-Q752 WeakPolarHBondContact O-CB 3.23Å; H749-Q752 PolarHBondContact O-N 3.11Å; H749-E753 PolarHBondContact O-N 3.47Å; H749-E753 VanDerWaalsContact O-N 3.12Å
750	K	36.7	Very low	32.6	Very low	142 Å²	142	133.6 Å²	133.6	62%	0.617	65%	0.654	S	S	*	*	H	α-helix	trans	-68.2	-22	175.9	-88.3	-169.4	169.9	-175.6	0	114.8	T746 E747	T746-K750 PolarHBondContact O-N 3.33Å; E747-K750 PolarHBondContact O-N 3.29Å
751	Q	34.7	Very low	32.9	Very low	135 Å²	135	132.9 Å²	132.9	63%	0.631	65%	0.645	S	S	*	*	H	α-helix	trans	-86.6	-16.2	168.9	-64.6	-167.9	16.4	0	0	113.3	E747 L748 H749	E747-Q751 PolarHBondContact O-N 3.41Å; E747-Q751 VanDerWaalsContact O-N 3.08Å; L748-Q751 PolarHBondContact O-N 3.24Å; H749-Q751 VanDerWaalsContact C-N 3.28Å; H749-Q751 PolarHBondContact O-N 2.97Å
752	Q	32.4	Very low	33.2	Very low	109 Å²	109	127.6 Å²	127.6	51%	0.509	64%	0.635	S	S	.	*	H	α-helix	trans	-78.5	-35.1	171.4	-76.7	177.7	-110.4	0	0	112.8	L748 H749 Y754 S755	L748-Q752 WeakPolarHBondContact O-CG 3.42Å; L748-Q752 PolarHBondContact O-N 2.85Å; H749-Q752 WeakPolarHBondContact O-CB 3.23Å; H749-Q752 PolarHBondContact O-N 3.11Å; Q752-Y754 PolarHBondContact O-N 3.46Å; Q752-S755 WeakPolarHBondContact O-CB 3.25Å; Q752-S755 PolarHBondContact O-N 3.14Å
753	E	32.3	Very low	34.1	Very low	151 Å²	151	125.4 Å²	125.4	71%	0.706	62%	0.618	S	S	*	*	G	3₁₀ helix	trans	-64.3	-21.3	178.1	-69.6	-179.7	132.5	0	0	113.8	H749 S755	H749-E753 PolarHBondContact O-N 3.47Å; H749-E753 VanDerWaalsContact O-N 3.12Å; E753-S755 VanDerWaalsContact C-N 3.31Å
754	Y	34.1	Very low	34.4	Very low	191 Å²	191	122.9 Å²	122.9	75%	0.749	61%	0.61	S	S	*	*	G	3₁₀ helix	trans	-82.7	-0.5	170.2	-97.5	-76.3	0	0	0	114.4	Q213 Q752	Q213-Y754 PolarHBondContact NE2-OH 3.03Å; Q752-Y754 PolarHBondContact O-N 3.46Å
755	S	32.3	Very low	34.9	Very low	52 Å²	52	118.3 Å²	118.3	36%	0.364	60%	0.598	S	S	.	*	G	3₁₀ helix	trans	-90.5	-16.7	178.4	-171.6	0	0	0	0	113.9	Q752 E753 Q757	Q752-S755 WeakPolarHBondContact O-CB 3.25Å; Q752-S755 PolarHBondContact O-N 3.14Å; E753-S755 VanDerWaalsContact C-N 3.31Å; S755-Q757 PolarHBondContact O-N 3.16Å
756	D	28.7	Very low	35.6	Very low	140 Å²	140	121.5 Å²	121.5	75%	0.749	60%	0.6	S	S	*	*			trans	-100.5	42.6	-165.9	-76.4	-30.6	0	0	0	114.9
757	Q	31.4	Very low	36.3	Very low	187 Å²	187	117.8 Å²	117.8	87%	0.874	58%	0.577	S	S	*	*	S	Bend	trans	-119.5	91.2	149.2	-71.2	-165.7	-5.5	0	0	109.5	S755	S755-Q757 PolarHBondContact O-N 3.16Å
758	K	28.7	Very low	36.9	Very low	197 Å²	197	115.1 Å²	115.1	86%	0.857	57%	0.57	S	S	*	*	S	Bend	trans	14.8	115	172.6	-67.4	177.6	-179.9	172.7	0	116.1
759	H	33.7	Very low	37.6	Very low	145 Å²	145	116 Å²	116	67%	0.671	57%	0.57	S	S	*	*			trans	97.7	37.2	178	-52.3	-75.4	0	0	0	117.3
760	G	32.1	Very low	38.3	Very low	35 Å²	35	113 Å²	113	36%	0.361	56%	0.558	S	S	.	*			trans	-73.7	150.8	158.9	0	0	0	0	0	113.8	V762	G760-V762 PolarHBondContact O-N 2.86Å
761	T	35	Very low	39.2	Very low	90 Å²	90	106.5 Å²	106.5	55%	0.552	53%	0.53	S	S	*	.			trans	-76.9	99.3	-171	45.7	0	0	0	0	114.7	L381	L381-T761 HydrophobicContact CD1-CG2 4.37Å
762	V	32.8	Very low	39.9	Very low	110 Å²	110	104 Å²	104	67%	0.667	52%	0.521	S	S	*	.			trans	-119.7	70.8	169.6	-169.6	0	0	0	0	111	G760	G760-V762 PolarHBondContact O-N 2.86Å
763	Y	47.7	Very low	40.2	Very low	90 Å²	90	103.1 Å²	103.1	35%	0.353	53%	0.526	S	S	.	.			trans	-125.9	-24.6	-171	-77.4	-79	0	0	0	119.5	E765 K766 I767	Y763-E765 PolarHBondContact O-N 3.49Å; Y763-K766 PolarHBondContact O-N 2.81Å; Y763-I767 WeakPolarHBondContact O-CG1 3.45Å; Y763-I767 PolarHBondContact O-N 3.15Å
764	P	41	Very low	41	Very low	98 Å²	98	97.1 Å²	97.1	64%	0.636	50%	0.499	S	S	*	.	H	α-helix	trans	-61.3	-39.8	-164.6	21.3	-32.3	0	0	0	114.4	S768	P764-S768 PolarHBondContact O-N 3.09Å
765	E	40.3	Very low	41.3	Very low	130 Å²	130	89.4 Å²	89.4	61%	0.607	47%	0.473	S	S	*	.	H	α-helix	trans	-67.2	-36.3	173.4	-89.2	-154.8	-158.7	0	0	113.9	Y763 S768 K769	Y763-E765 PolarHBondContact O-N 3.49Å; E765-S768 PolarHBondContact O-OG 3.16Å; E765-K769 WeakPolarHBondContact O-CB 3.34Å; E765-K769 VanDerWaalsContact O-CD 3.29Å; E765-K769 WeakPolarHBondContact O-CD 3.4Å; E765-K769 VanDerWaalsContact O-CG 3.22Å; E765-K769 WeakPolarHBondContact O-CG 3.39Å; E765-K769 PolarHBondContact O-N 3.41Å; E765-K769 VanDerWaalsContact O-N 3.14Å; E765-K769 IonicContact OE2-NZ 3.78Å; E765-K769 PolarHBondContact OE2-NZ 2.86Å
766	K	47.7	Very low	41.5	Very low	131 Å²	131	89.9 Å²	89.9	57%	0.57	48%	0.477	S	S	*	.	H	α-helix	trans	-70.4	-41	178.6	-70	178.8	179.6	171.9	0	110	Y763 K769 L770	Y763-K766 PolarHBondContact O-N 2.81Å; K766-K769 PolarHBondContact O-N 2.96Å; K766-L770 WeakPolarHBondContact O-CB 3.21Å; K766-L770 VanDerWaalsContact O-CG 3.24Å; K766-L770 WeakPolarHBondContact O-CG 3.28Å; K766-L770 PolarHBondContact O-N 2.95Å
767	I	53	Low	42	Very low	10 Å²	10	90 Å²	90	5%	0.051	48%	0.477	C	S	.	.	H	α-helix	trans	-59.4	-51	174.9	-70	176.8	0	0	0	110.5	L536 N537 Y763 K769 L770 L771	L536-I767 HydrophobicContact CB-CD1 3.65Å; L536-I767 HydrophobicContact CB-CG1 3.84Å; L536-I767 HydrophobicContact CD1-CG1 4.17Å; L536-I767 HydrophobicContact CD1-CG2 4.17Å; N537-I767 WeakPolarHBondContact OD1-CD1 3.45Å; Y763-I767 WeakPolarHBondContact O-CG1 3.45Å; Y763-I767 PolarHBondContact O-N 3.15Å; I767-K769 VanDerWaalsContact C-N 3.31Å; I767-K769 PolarHBondContact O-N 3.16Å; I767-L770 PolarHBondContact O-N 2.95Å; I767-L771 HydrophobicContact CG2-CD1 3.43Å; I767-L771 VanDerWaalsContact CG2-CD1 3.43Å; I767-L771 HydrophobicContact CG2-CG 4.29Å; I767-L771 WeakPolarHBondContact O-CB 3.36Å; I767-L771 WeakPolarHBondContact O-CD1 3.28Å; I767-L771 VanDerWaalsContact O-CG 3.24Å; I767-L771 WeakPolarHBondContact O-CG 3.41Å; I767-L771 PolarHBondContact O-N 2.95Å
768	S	48.5	Very low	42.3	Very low	52 Å²	52	85.3 Å²	85.3	36%	0.364	45%	0.452	S	S	.	.	H	α-helix	trans	-62.6	-37.6	179.4	71.2	0	0	0	0	112.7	P764 E765 N772	P764-S768 PolarHBondContact O-N 3.09Å; E765-S768 PolarHBondContact O-OG 3.16Å; S768-N772 VanDerWaalsContact O-CB 3.23Å; S768-N772 WeakPolarHBondContact O-CB 3.37Å; S768-N772 PolarHBondContact O-N 2.79Å; S768-N772 PolarHBondContact O-ND2 3.29Å
769	K	50.1	Low	42.5	Very low	120 Å²	120	78 Å²	78	52%	0.522	43%	0.425	S	S	.	.	H	α-helix	trans	-63.6	-47.5	173.8	-72.4	163.3	-176.5	164.2	0	111.9	E765 K766 I767 N772 C773	E765-K769 WeakPolarHBondContact O-CB 3.34Å; E765-K769 VanDerWaalsContact O-CD 3.29Å; E765-K769 WeakPolarHBondContact O-CD 3.4Å; E765-K769 VanDerWaalsContact O-CG 3.22Å; E765-K769 WeakPolarHBondContact O-CG 3.39Å; E765-K769 PolarHBondContact O-N 3.41Å; E765-K769 VanDerWaalsContact O-N 3.14Å; E765-K769 IonicContact OE2-NZ 3.78Å; E765-K769 PolarHBondContact OE2-NZ 2.86Å; K766-K769 PolarHBondContact O-N 2.96Å; I767-K769 VanDerWaalsContact C-N 3.31Å; I767-K769 PolarHBondContact O-N 3.16Å; K769-N772 PolarHBondContact O-N 2.86Å; K769-C773 WeakPolarHBondContact O-CB 3.33Å; K769-C773 PolarHBondContact O-N 3.16Å; K769-C773 PolarHBondContact O-SG 3.17Å
770	L	52.1	Low	42.3	Very low	59 Å²	59	78.1 Å²	78.1	31%	0.309	43%	0.428	S	S	.	.	H	α-helix	trans	-61	-45.9	177.5	-71.8	164.3	0	0	0	112.4	D490 K766 I767 T774	D490-L770 HydrophobicContact CB-CD2 4.24Å; K766-L770 WeakPolarHBondContact O-CB 3.21Å; K766-L770 VanDerWaalsContact O-CG 3.24Å; K766-L770 WeakPolarHBondContact O-CG 3.28Å; K766-L770 PolarHBondContact O-N 2.95Å; I767-L770 PolarHBondContact O-N 2.95Å; L770-T774 WeakPolarHBondContact O-CG2 3.32Å; L770-T774 PolarHBondContact O-N 3.12Å; L770-T774 PolarHBondContact O-OG1 2.79Å
771	L	54	Low	42.4	Very low	4 Å²	4	83.7 Å²	83.7	2%	0.021	44%	0.439	C	S	.	.	H	α-helix	trans	-69.7	-34.6	-179.1	-66	163.1	0	0	0	112.6	R529 H532 E533 I767 T774 S775	R529-L771 HydrophobicContact CG-CD2 4.26Å; H532-L771 HydrophobicContact CB-CD2 4.4Å; E533-L771 HydrophobicContact CG-CD1 3.27Å; E533-L771 HydrophobicContact CG-CD2 4.02Å; E533-L771 HydrophobicContact CG-CG 4.28Å; I767-L771 HydrophobicContact CG2-CD1 3.43Å; I767-L771 VanDerWaalsContact CG2-CD1 3.43Å; I767-L771 HydrophobicContact CG2-CG 4.29Å; I767-L771 WeakPolarHBondContact O-CB 3.36Å; I767-L771 WeakPolarHBondContact O-CD1 3.28Å; I767-L771 VanDerWaalsContact O-CG 3.24Å; I767-L771 WeakPolarHBondContact O-CG 3.41Å; I767-L771 PolarHBondContact O-N 2.95Å; L771-T774 WeakPolarHBondContact CA-OG1 3.41Å; L771-T774 PolarHBondContact O-OG1 2.82Å; L771-S775 WeakPolarHBondContact O-CB 3.44Å; L771-S775 PolarHBondContact O-N 3.08Å; L771-S775 PolarHBondContact O-OG 3.43Å
772	N	49.4	Very low	42.3	Very low	84 Å²	84	82 Å²	82	45%	0.449	43%	0.431	S	S	.	.	H	α-helix	trans	-74.4	-42.4	176.8	-69	-10	0	0	0	110.9	R529 S768 K769 T774 S775 S776	R529-N772 PolarHBondContact NH2-OD1 3.08Å; S768-N772 VanDerWaalsContact O-CB 3.23Å; S768-N772 WeakPolarHBondContact O-CB 3.37Å; S768-N772 PolarHBondContact O-N 2.79Å; S768-N772 PolarHBondContact O-ND2 3.29Å; K769-N772 PolarHBondContact O-N 2.86Å; N772-T774 VanDerWaalsContact C-N 3.27Å; N772-T774 PolarHBondContact O-N 2.82Å; N772-S775 PolarHBondContact O-N 3.44Å; N772-S776 VanDerWaalsContact O-CB 3.26Å; N772-S776 WeakPolarHBondContact O-CB 3.48Å; N772-S776 PolarHBondContact O-N 3.46Å; N772-S776 PolarHBondContact O-OG 3.44Å
773	C	40.5	Very low	42.1	Very low	90 Å²	90	82 Å²	82	61%	0.608	42%	0.424	S	S	*	.	H	α-helix	trans	-61.6	-32	173.8	-70.3	0	0	0	0	113.5	K769	K769-C773 WeakPolarHBondContact O-CB 3.33Å; K769-C773 PolarHBondContact O-N 3.16Å; K769-C773 PolarHBondContact O-SG 3.17Å
774	T	47.6	Very low	41.2	Very low	24 Å²	24	80.7 Å²	80.7	15%	0.147	43%	0.427	C	S	.	.	H	α-helix	trans	-81.7	-19.1	177.8	46.6	0	0	0	0	113.9	D490 Y517 L770 L771 N772	D490-T774 HydrophobicContact CB-CG2 3.97Å; D490-T774 WeakPolarHBondContact O-CG2 3.41Å; Y517-T774 HydrophobicContact CD2-CG2 4.46Å; Y517-T774 HydrophobicContact CE2-CG2 4.22Å; L770-T774 WeakPolarHBondContact O-CG2 3.32Å; L770-T774 PolarHBondContact O-N 3.12Å; L770-T774 PolarHBondContact O-OG1 2.79Å; L771-T774 WeakPolarHBondContact CA-OG1 3.41Å; L771-T774 PolarHBondContact O-OG1 2.82Å; N772-T774 VanDerWaalsContact C-N 3.27Å; N772-T774 PolarHBondContact O-N 2.82Å
775	S	42	Very low	40.8	Very low	30 Å²	30	80.1 Å²	80.1	21%	0.21	43%	0.426	C	S	.	.	H	α-helix	trans	-107.1	-20.5	179	56	0	0	0	0	115	R529 L771 N772 N777 Y778 S779	R529-S775 PolarHBondContact NH1-OG 3.04Å; L771-S775 WeakPolarHBondContact O-CB 3.44Å; L771-S775 PolarHBondContact O-N 3.08Å; L771-S775 PolarHBondContact O-OG 3.43Å; N772-S775 PolarHBondContact O-N 3.44Å; S775-N777 VanDerWaalsContact C-N 3.26Å; S775-N777 PolarHBondContact O-N 3.27Å; S775-Y778 CarbonylContact O-C 3.57Å; S775-Y778 PolarHBondContact O-N 3Å; S775-S779 PolarHBondContact O-N 3.48Å
776	S	35.8	Very low	40.5	Very low	62 Å²	62	80.8 Å²	80.8	43%	0.434	43%	0.427	S	S	.	.	H	α-helix	trans	-63	-29	-177.7	60	0	0	0	0	113.9	N772 Y778 S779	N772-S776 VanDerWaalsContact O-CB 3.26Å; N772-S776 WeakPolarHBondContact O-CB 3.48Å; N772-S776 PolarHBondContact O-N 3.46Å; N772-S776 PolarHBondContact O-OG 3.44Å; S776-Y778 PolarHBondContact O-N 2.96Å; S776-S779 PolarHBondContact O-OG 2.95Å
777	N	38.4	Very low	39.7	Very low	141 Å²	141	81.4 Å²	81.4	75%	0.754	43%	0.432	S	S	*	.	H	α-helix	trans	-75.7	-5.7	175.4	-67.5	-8.4	0	0	0	113.1	S775	S775-N777 VanDerWaalsContact C-N 3.26Å; S775-N777 PolarHBondContact O-N 3.27Å
778	Y	38.9	Very low	38.8	Very low	89 Å²	89	86.4 Å²	86.4	35%	0.349	46%	0.459	S	S	.	.	H	α-helix	trans	-123.4	-12.4	178.7	-125.6	-81.1	0	0	0	113.5	T522 S775 S776 M780 Y781	T522-Y778 HydrophobicContact CG2-CE1 3.83Å; S775-Y778 CarbonylContact O-C 3.57Å; S775-Y778 PolarHBondContact O-N 3Å; S776-Y778 PolarHBondContact O-N 2.96Å; Y778-M780 VanDerWaalsContact C-N 3.28Å; Y778-M780 PolarHBondContact O-N 2.92Å; Y778-Y781 HydrophobicContact CD1-CD2 4.27Å; Y778-Y781 HydrophobicContact CE1-CD2 4.4Å; Y778-Y781 PolarHBondContact O-N 2.86Å
779	S	32.9	Very low	38	Very low	43 Å²	43	90.4 Å²	90.4	30%	0.301	48%	0.476	S	S	.	.	H	α-helix	trans	-61.9	-34.4	-177.7	66.2	0	0	0	0	112.8	S775 S776 Y781 S782 E783	S775-S779 PolarHBondContact O-N 3.48Å; S776-S779 PolarHBondContact O-OG 2.95Å; S779-Y781 PolarHBondContact O-N 2.99Å; S779-S782 WeakPolarHBondContact O-CA 3.42Å; S779-S782 WeakPolarHBondContact O-CB 3.49Å; S779-S782 PolarHBondContact O-N 3.44Å; S779-S782 PolarHBondContact O-OG 2.96Å; S779-E783 PolarHBondContact O-N 3.34Å
780	M	29.7	Very low	37.2	Very low	148 Å²	148	91.4 Å²	91.4	73%	0.729	49%	0.487	S	S	*	.	H	α-helix	trans	-57.1	-28.9	172.9	-83.4	-166	159.6	0	0	113.6	Y778	Y778-M780 VanDerWaalsContact C-N 3.28Å; Y778-M780 PolarHBondContact O-N 2.92Å
781	Y	32.7	Very low	36.2	Very low	152 Å²	152	96.5 Å²	96.5	60%	0.596	51%	0.509	S	S	*	.	H	α-helix	trans	-82.3	-14.2	173.9	-68.7	-77.5	0	0	0	113.3	Y778 S779	Y778-Y781 HydrophobicContact CD1-CD2 4.27Å; Y778-Y781 HydrophobicContact CE1-CD2 4.4Å; Y778-Y781 PolarHBondContact O-N 2.86Å; S779-Y781 PolarHBondContact O-N 2.99Å
782	S	32.6	Very low	34.9	Very low	55 Å²	55	103.9 Å²	103.9	39%	0.385	54%	0.543	S	S	.	.	H	α-helix	trans	-93	-26.3	175.9	77.2	0	0	0	0	113.6	S779 S785	S779-S782 WeakPolarHBondContact O-CA 3.42Å; S779-S782 WeakPolarHBondContact O-CB 3.49Å; S779-S782 PolarHBondContact O-N 3.44Å; S779-S782 PolarHBondContact O-OG 2.96Å; S782-S785 PolarHBondContact O-N 3.33Å
783	E	30.3	Very low	33.9	Very low	109 Å²	109	105.5 Å²	105.5	51%	0.509	56%	0.561	S	S	.	*	H	α-helix	trans	-75.2	-37.4	-178.4	-71.6	172.1	136.4	0	0	111.2	S779 S785 K786 E787	S779-E783 PolarHBondContact O-N 3.34Å; E783-S785 PolarHBondContact O-N 3.3Å; E783-S785 VanDerWaalsContact O-N 3.09Å; E783-K786 PolarHBondContact O-N 2.87Å; E783-E787 PolarHBondContact O-N 2.96Å
784	C	28.8	Very low	33.2	Very low	63 Å²	63	108.7 Å²	108.7	43%	0.426	57%	0.571	S	S	.	*	T	Hydrogen-bonded Turn	trans	-61.2	-17	169.7	-64.4	0	0	0	0	114.3
785	S	32.3	Very low	32.3	Very low	86 Å²	86	115.6 Å²	115.6	60%	0.601	61%	0.607	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.3	-14.5	171.2	-60	0	0	0	0	113.7	S782 E783	S782-S785 PolarHBondContact O-N 3.33Å; E783-S785 PolarHBondContact O-N 3.3Å; E783-S785 VanDerWaalsContact O-N 3.09Å
786	K	32.8	Very low	31.4	Very low	144 Å²	144	123.2 Å²	123.2	63%	0.626	64%	0.639	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.8	-19.7	178.1	-68.4	-179.6	179.7	176	0	113.5	E783 N788	E783-K786 PolarHBondContact O-N 2.87Å; K786-N788 VanDerWaalsContact C-N 3.27Å; K786-N788 PolarHBondContact O-N 3.48Å
787	E	32.1	Very low	31	Very low	145 Å²	145	131.6 Å²	131.6	68%	0.678	66%	0.661	S	S	*	*	G	3₁₀ helix	trans	-73.3	-16.2	176.1	-68.3	-171.1	126.2	0	0	113.6	E783	E783-E787 PolarHBondContact O-N 2.96Å
788	N	32.5	Very low	30.5	Very low	115 Å²	115	129.4 Å²	129.4	62%	0.615	66%	0.656	S	S	*	*	G	3₁₀ helix	trans	-80.1	-20.5	177	-88.8	-60.8	0	0	0	114.8	K786 N790 H791	K786-N788 VanDerWaalsContact C-N 3.27Å; K786-N788 PolarHBondContact O-N 3.48Å; N788-N790 PolarHBondContact O-N 2.91Å; N788-H791 PolarHBondContact O-N 3.44Å
789	D	33.6	Very low	30	Very low	136 Å²	136	133.3 Å²	133.3	73%	0.727	68%	0.678	S	S	*	*	G	3₁₀ helix	trans	-74	-4.9	-179.2	-73.8	-34.6	0	0	0	113.7
790	N	33	Very low	29.7	Very low	140 Å²	140	138.2 Å²	138.2	75%	0.749	70%	0.698	S	S	*	*	G	3₁₀ helix	trans	-88.9	3	177.6	-80.8	-53.8	0	0	0	114.6	N788 Q792	N788-N790 PolarHBondContact O-N 2.91Å; N790-Q792 PolarHBondContact O-N 3.47Å
791	H	30.2	Very low	29.7	Very low	166 Å²	166	136.9 Å²	136.9	77%	0.769	69%	0.694	S	S	*	*			trans	-80.6	42.6	174.8	-93.4	-58.5	0	0	0	114.6	N788	N788-H791 PolarHBondContact O-N 3.44Å
792	Q	27	Very low	29.4	Very low	159 Å²	159	137.3 Å²	137.3	74%	0.743	70%	0.699	S	S	*	*			trans	-76	159	156.1	-83	-76.3	-7.1	0	0	110.5	N790	N790-Q792 PolarHBondContact O-N 3.47Å
793	S	28.7	Very low	29.3	Very low	118 Å²	118	141.1 Å²	141.1	83%	0.825	72%	0.715	S	S	*	*	S	Bend	trans	69.3	43.6	167.7	72.2	0	0	0	0	119.6
794	L	26.2	Very low	29.3	Very low	158 Å²	158	140.9 Å²	140.9	83%	0.827	72%	0.723	S	S	*	*			trans	-143.9	157.7	154.9	-108.4	166.1	0	0	0	111.4
795	L	28.1	Very low	29.3	Very low	169 Å²	169	145.3 Å²	145.3	89%	0.885	74%	0.742	S	S	*	*			trans	72	46.1	-179.5	-54.3	177.7	0	0	0	118
796	Q	23.6	Very low	29.3	Very low	190 Å²	190	149.1 Å²	149.1	89%	0.888	76%	0.756	S	S	*	*			trans	-100.9	73.5	155.2	-169.2	-171.8	6.2	0	0	110.9
797	W	26.7	Very low	29	Very low	238 Å²	238	152.9 Å²	152.9	90%	0.902	77%	0.766	S	S	*	*			trans	-142.6	136.4	175	-101.1	76.4	0	0	0	112.7
798	S	28.6	Very low	28.8	Very low	94 Å²	94	150.7 Å²	150.7	66%	0.657	77%	0.767	S	S	*	*			trans	40.7	97.7	167.8	53.3	0	0	0	0	117.7
799	H	27.4	Very low	28.6	Very low	171 Å²	171	152.2 Å²	152.2	79%	0.792	77%	0.77	S	S	*	*				53.8	118.9	85.4	-87.5	-112.7	0	0	0	117.3
800	M	27.5	Very low	28.4	Very low	147 Å²	147	155 Å²	155	72%	0.724	77%	0.772	S	S	*	*			trans	79.5	111.2	138.9	-72.9	-179.3	158.8	0	0	121.6
801	N	27.9	Very low	28.1	Very low	120 Å²	120	155.8 Å²	155.8	64%	0.642	77%	0.771	S	S	*	*				93.4	114.7	117.7	-71.4	3.9	0	0	0	121.5
802	F	28.3	Very low	28	Very low	160 Å²	160	154.7 Å²	154.7	70%	0.702	77%	0.77	S	S	*	*			trans	55.6	143.1	142	-68	-90.1	0	0	0	119
803	D	29.4	Very low	28.1	Very low	135 Å²	135	157.3 Å²	157.3	72%	0.722	77%	0.774	S	S	*	*			cis	-157.3	170.3	-10.3	-134	8.9	0	0	0	107.7
804	P	31.2	Very low	28.3	Very low	105 Å²	105	158.4 Å²	158.4	68%	0.682	77%	0.765	S	S	*	*			trans	-87.2	-173.8	-173.7	36.5	-35.8	0	0	0	114.8
805	D	28.8	Very low	28.5	Very low	155 Å²	155	155.4 Å²	155.4	83%	0.829	75%	0.75	S	S	*	*			trans	66.1	104.2	172.4	-76.4	-9.9	0	0	0	119.2
806	N	31.2	Very low	28.5	Very low	167 Å²	167	156.7 Å²	156.7	89%	0.893	74%	0.743	S	S	*	*				-147.1	157.2	119.8	-137.3	-42.1	0	0	0	113.6
807	R	27.9	Very low	28.8	Very low	222 Å²	222	155.3 Å²	155.3	84%	0.838	74%	0.737	S	S	*	*			trans	-94.4	149.9	-169	-89	179.3	168	176.4	-3	113.9
808	S	27.4	Very low	28.7	Very low	99 Å²	99	149.8 Å²	149.8	69%	0.692	73%	0.725	S	S	*	*			trans	81.4	154.3	134.7	71.6	0	0	0	0	122.7
809	H	28.4	Very low	28.7	Very low	147 Å²	147	152.9 Å²	152.9	68%	0.681	73%	0.729	S	S	*	*			trans	104.8	135.5	140.4	-93.9	-65	0	0	0	121.6
810	Y	29	Very low	28.5	Very low	196 Å²	196	148.4 Å²	148.4	77%	0.769	72%	0.717	S	S	*	*			trans	83.8	67.6	162.2	-66.3	-66.6	0	0	0	122.2
811	Q	27.4	Very low	28.6	Very low	156 Å²	156	149.1 Å²	149.1	73%	0.729	72%	0.718	S	S	*	*				36.9	138.4	104.8	-129.4	94.7	12.2	0	0	122.3
812	N	27.2	Very low	28.5	Very low	142 Å²	142	150 Å²	150	76%	0.759	72%	0.722	S	S	*	*			trans	93.8	149.9	131	-92.4	-9.7	0	0	0	123.2
813	R	28.5	Very low	28.5	Very low	215 Å²	215	147 Å²	147	81%	0.811	71%	0.713	S	S	*	*			trans	81.6	144.9	169.6	-61	-175.1	159.7	156.4	2.9	115.8
814	H	33.7	Very low	28.4	Very low	141 Å²	141	144.1 Å²	144.1	65%	0.653	69%	0.694	S	S	*	*			cis	-169	160.8	-7.3	-106.2	-38.2	0	0	0	106.5
815	D	29.6	Very low	28.3	Very low	94 Å²	94	143.3 Å²	143.3	50%	0.503	68%	0.684	S	S	.	*			cis	-165.5	168.6	-6.2	-136.5	25	0	0	0	108.9
816	R	29.6	Very low	28.3	Very low	196 Å²	196	141.1 Å²	141.1	74%	0.74	67%	0.672	S	S	*	*			trans	74.8	122.9	150.4	-72.4	171.1	-144.1	-142.9	-5.6	119.9
817	Q	29.3	Very low	28.2	Very low	162 Å²	162	142.7 Å²	142.7	76%	0.757	67%	0.672	S	S	*	*				78.4	143	76.9	-79	179.2	-24.1	0	0	114.1
818	N	24.9	Very low	28.4	Very low	121 Å²	121	136.3 Å²	136.3	65%	0.647	67%	0.666	S	S	*	*			cis	-167.8	171.4	-18.6	-144.3	31.9	0	0	0	108.8
819	E	27.1	Very low	28.5	Very low	160 Å²	160	139.3 Å²	139.3	75%	0.748	67%	0.673	S	S	*	*			trans	64.9	158.4	156.8	-72.9	151.1	-120.9	0	0	119.7
820	S	25.2	Very low	28.6	Very low	77 Å²	77	138.3 Å²	138.3	54%	0.538	68%	0.677	S	S	.	*			cis	-171.4	170.4	-34.5	52.5	0	0	0	0	111.7
821	H	28.1	Very low	29	Very low	161 Å²	161	135 Å²	135	75%	0.745	68%	0.679	S	S	*	*			trans	73.6	128.9	173.2	-48.4	-72.4	0	0	0	117.2
822	L	27.2	Very low	29.4	Very low	138 Å²	138	131.1 Å²	131.1	72%	0.723	68%	0.682	S	S	*	*			cis	79.2	130.3	35.9	-56.9	176.4	0	0	0	114.3
823	L	28.2	Very low	29.8	Very low	98 Å²	98	130.4 Å²	130.4	51%	0.513	68%	0.678	S	S	.	*			cis	-143.9	-137.5	-8.4	-121.3	167.9	0	0	0	109.5	Q627 L628	Q627-L823 HydrophobicContact CB-CB 4.14Å; Q627-L823 HydrophobicContact CB-CD1 4.12Å; Q627-L823 HydrophobicContact CG-CD1 3.66Å; L628-L823 CarbonylContact O-C 2.92Å; L628-L823 WeakPolarHBondContact O-CA 3.43Å; L628-L823 PolarHBondContact O-N 3.28Å
824	F	26.6	Very low	30.1	Very low	75 Å²	75	128.3 Å²	128.3	33%	0.329	67%	0.67	S	S	.	*			cis	-150.4	-133.6	5.3	-167.8	14.5	0	0	0	107	Q627 L628 N826	Q627-F824 HydrophobicContact CB-CB 4.06Å; Q627-F824 HydrophobicContact CB-CD1 3.6Å; Q627-F824 HydrophobicContact CB-CD2 3.47Å; Q627-F824 VanDerWaalsContact CB-CD2 3.47Å; Q627-F824 HydrophobicContact CB-CE1 3.8Å; Q627-F824 HydrophobicContact CB-CE2 3.67Å; Q627-F824 HydrophobicContact CB-CG 3.44Å; Q627-F824 VanDerWaalsContact CB-CG 3.44Å; Q627-F824 HydrophobicContact CB-CZ 3.82Å; Q627-F824 HydrophobicContact CG-CD1 3.76Å; Q627-F824 HydrophobicContact CG-CD2 4.41Å; Q627-F824 HydrophobicContact CG-CE1 3.67Å; Q627-F824 HydrophobicContact CG-CE2 4.33Å; Q627-F824 HydrophobicContact CG-CG 4.15Å; Q627-F824 HydrophobicContact CG-CZ 3.96Å; L628-F824 WeakPolarHBondContact O-CB 3.43Å; L628-F824 PolarHBondContact O-N 3.4Å; F824-N826 WeakPolarHBondContact CE1-OD1 3.36Å; F824-N826 WeakPolarHBondContact CZ-ND2 3.4Å; F824-N826 WeakPolarHBondContact CZ-OD1 3.4Å
825	N	28.4	Very low	30.2	Very low	87 Å²	87	127 Å²	127	47%	0.465	67%	0.674	S	S	.	*			cis	-164.8	111.2	2.1	-153.7	-26.1	0	0	0	113.3	S629	S629-N825 PolarHBondContact OG-ND2 2.96Å
826	N	30.5	Very low	30.5	Very low	109 Å²	109	129.6 Å²	129.6	58%	0.583	68%	0.683	S	S	*	*			trans	24.4	130.7	149.7	-59.1	-11.8	0	0	0	126.2	F824	F824-N826 WeakPolarHBondContact CE1-OD1 3.36Å; F824-N826 WeakPolarHBondContact CZ-ND2 3.4Å; F824-N826 WeakPolarHBondContact CZ-OD1 3.4Å
827	F	28.8	Very low	30.5	Very low	201 Å²	201	127.3 Å²	127.3	88%	0.882	69%	0.691	S	S	*	*				-172.8	112.6	107.6	-97.8	-74.7	0	0	0	107.8
828	A	30.3	Very low	30.6	Very low	88 Å²	88	123.2 Å²	123.2	73%	0.727	69%	0.692	S	S	*	*				63.2	140	97.1	0	0	0	0	0	114.9
829	I	30.3	Very low	30.8	Very low	161 Å²	161	124.7 Å²	124.7	83%	0.826	70%	0.698	S	S	*	*			cis	-147	159.6	33.1	-67.5	169.9	0	0	0	111.8
830	T	30.3	Very low	31	Very low	127 Å²	127	123.3 Å²	123.3	78%	0.779	70%	0.7	S	S	*	*			trans	-141.2	-160.5	173.9	56.6	0	0	0	0	109.2
831	P	38.1	Very low	31.3	Very low	125 Å²	125	125.2 Å²	125.2	81%	0.812	71%	0.711	S	S	*	*			cis	-144.9	-172.6	-5.9	44.4	-24.9	0	0	0	118
832	G	35	Very low	31.5	Very low	75 Å²	75	125.1 Å²	125.1	77%	0.773	72%	0.715	S	S	*	*			trans	107.4	154.4	143.4	0	0	0	0	0	118
833	D	37.1	Very low	31.8	Very low	128 Å²	128	123.8 Å²	123.8	68%	0.684	72%	0.715	S	S	*	*			cis	-163.2	172.8	-25.2	-157.3	24.3	0	0	0	105
834	R	33.7	Very low	31.8	Very low	170 Å²	170	124.6 Å²	124.6	64%	0.642	72%	0.723	S	S	*	*			cis	-160.4	150.4	11.3	168.4	158.5	-70.5	-93	-19.3	110.4	E836	R834-E836 IonicContact NH1-OE1 2.91Å; R834-E836 PolarHBondContact NH1-OE1 3.41Å; R834-E836 VanDerWaalsContact NH1-OE1 3.14Å
835	P	35.1	Very low	32	Very low	114 Å²	114	129.6 Å²	129.6	74%	0.74	75%	0.747	S	S	*	*			trans	-127.5	136.6	166.3	37.6	-24.1	0	0	0	116.4
836	E	35.9	Very low	32	Very low	149 Å²	149	130.4 Å²	130.4	70%	0.696	76%	0.76	S	S	*	*			trans	-147	117.3	165.4	-64.5	-179	-163.7	0	0	107.7	R834	R834-E836 IonicContact NH1-OE1 2.91Å; R834-E836 PolarHBondContact NH1-OE1 3.41Å; R834-E836 VanDerWaalsContact NH1-OE1 3.14Å
837	V	30.9	Very low	32	Very low	148 Å²	148	133.2 Å²	133.2	90%	0.897	77%	0.77	S	S	*	*				74.5	114.7	76.3	176.1	0	0	0	0	114.7
838	G	32.1	Very low	31.9	Very low	75 Å²	75	131.4 Å²	131.4	77%	0.773	77%	0.766	S	S	*	*			trans	179.8	39	-176.4	0	0	0	0	0	123.5
839	I	28.5	Very low	31.7	Very low	153 Å²	153	132.4 Å²	132.4	79%	0.785	76%	0.763	S	S	*	*			trans	24.3	112	148.3	-62.8	175.3	0	0	0	121.7
840	V	30.2	Very low	31.8	Very low	131 Å²	131	131 Å²	131	79%	0.794	76%	0.763	S	S	*	*				56.9	142.9	128.7	-179.7	0	0	0	0	121.5
841	P	32.7	Very low	31.7	Very low	116 Å²	116	132.5 Å²	132.5	75%	0.753	76%	0.758	S	S	*	*			cis	-137.1	-162.1	-32.8	42.1	-20.6	0	0	0	114.8
842	L	31.8	Very low	31.4	Very low	159 Å²	159	133.3 Å²	133.3	83%	0.832	76%	0.755	S	S	*	*			trans	-47.1	152.3	168.9	-86.6	157.4	0	0	0	116.4
843	P	33.8	Very low	31.2	Very low	111 Å²	111	136 Å²	136	72%	0.721	75%	0.747	S	S	*	*				-157.4	150.3	87.1	42.6	-22.9	0	0	0	120.9
844	T	28.5	Very low	31.1	Very low	114 Å²	114	137.5 Å²	137.5	70%	0.699	76%	0.755	S	S	*	*			trans	44.5	127.7	138.4	65.3	0	0	0	0	126.3
845	H	29.7	Very low	31	Very low	180 Å²	180	136.6 Å²	136.6	83%	0.833	76%	0.763	S	S	*	*			trans	78.4	155	131.4	-90.8	-85.8	0	0	0	124.9
846	S	29.3	Very low	31	Very low	104 Å²	104	137.6 Å²	137.6	73%	0.727	77%	0.767	S	S	*	*			trans	67.2	125.7	175.7	57.8	0	0	0	0	116.2
847	E	29.4	Very low	30.8	Very low	169 Å²	169	137.9 Å²	137.9	79%	0.79	77%	0.773	S	S	*	*			cis	107.7	153.8	27.7	-85.7	-163.3	152.1	0	0	112.6
848	M	27	Very low	30.8	Very low	162 Å²	162	139.3 Å²	139.3	80%	0.798	77%	0.768	S	S	*	*			trans	74.9	145.5	172.5	-53.1	-158.8	-172.2	0	0	117
849	T	27.2	Very low	31	Very low	109 Å²	109	141.7 Å²	141.7	67%	0.669	77%	0.77	S	S	*	*			cis	-162.7	176.8	-22.9	30.3	0	0	0	0	108.1
850	T	31.9	Very low	31	Very low	133 Å²	133	145.1 Å²	145.1	82%	0.816	77%	0.773	S	S	*	*			trans	80	156.5	158.9	71.4	0	0	0	0	118.5
851	K	28	Very low	31.2	Very low	158 Å²	158	148.2 Å²	148.2	69%	0.687	78%	0.778	S	S	*	*			cis	-172.2	-178.7	-44.4	-141.4	177.1	175.7	-86.8	0	107.7	E853	K851-E853 IonicContact NZ-OE1 3.14Å; K851-E853 PolarHBondContact NZ-OE1 2.81Å
852	L	32.5	Very low	31	Very low	141 Å²	141	151.7 Å²	151.7	74%	0.738	78%	0.781	S	S	*	*			trans	78.3	118.3	177.7	-49	169.8	0	0	0	112.5
853	E	30.5	Very low	31.1	Very low	131 Å²	131	152.1 Å²	152.1	61%	0.612	78%	0.784	S	S	*	*			cis	81.3	111.2	42.4	-60.7	157.1	-155.6	0	0	112.5	K851	K851-E853 IonicContact NZ-OE1 3.14Å; K851-E853 PolarHBondContact NZ-OE1 2.81Å
854	D	35.1	Very low	30.8	Very low	160 Å²	160	152.7 Å²	152.7	86%	0.856	79%	0.785	S	S	*	*				-170.7	156.2	117.5	-92.6	-16.1	0	0	0	112.5
855	D	31.8	Very low	31	Very low	152 Å²	152	154.9 Å²	154.9	81%	0.813	79%	0.79	S	S	*	*			trans	-79.7	173.9	-164.4	-66.2	-57.8	0	0	0	116.6
856	V	34.1	Very low	31	Very low	134 Å²	134	151.6 Å²	151.6	81%	0.812	78%	0.783	S	S	*	*				-177.8	107.2	106.2	155.8	0	0	0	0	113.8
857	N	31.7	Very low	31.3	Very low	155 Å²	155	154.1 Å²	154.1	83%	0.829	78%	0.783	S	S	*	*			trans	51.2	144.3	146.1	-86.6	-50	0	0	0	127.7
858	F	31.2	Very low	31.4	Very low	179 Å²	179	152.8 Å²	152.8	79%	0.785	78%	0.777	S	S	*	*			trans	-90.8	171.9	171.7	-107.6	-79	0	0	0	111.3
859	P	35.1	Very low	31.7	Very low	125 Å²	125	150.7 Å²	150.7	81%	0.812	77%	0.769	S	S	*	*				-149.7	168.7	77.2	38	-16.5	0	0	0	118.6
860	R	29.5	Very low	32.2	Very low	225 Å²	225	151.5 Å²	151.5	85%	0.849	77%	0.769	S	S	*	*			trans	-82.6	164	170.3	-73.9	169.7	154.4	159.7	-7.1	112.1
861	E	34.8	Very low	32.3	Very low	195 Å²	195	151.7 Å²	151.7	91%	0.911	76%	0.76	S	S	*	*			trans	-137.5	171.4	139.4	-132.9	167.9	-149.8	0	0	112.6
862	K	28.7	Very low	32.8	Very low	189 Å²	189	150 Å²	150	82%	0.822	76%	0.759	S	S	*	*			trans	-122.4	163.4	-177.9	-68.7	178.2	174.2	-179.3	0	109.7
863	L	33.1	Very low	32.8	Very low	168 Å²	168	151.3 Å²	151.3	88%	0.88	76%	0.758	S	S	*	*			trans	-160.1	154.7	137.8	-110.8	164.8	0	0	0	112.8
864	T	27.7	Very low	33	Very low	123 Å²	123	154.2 Å²	154.2	76%	0.755	77%	0.769	S	S	*	*			trans	-153.9	123.3	-178.8	49.9	0	0	0	0	111.5
865	M	32.7	Very low	32.7	Very low	161 Å²	161	151.6 Å²	151.6	79%	0.793	76%	0.759	S	S	*	*			trans	-147.6	136.1	158.1	-78.9	-174.4	57.7	0	0	107.6
866	T	29.3	Very low	32.8	Very low	111 Å²	111	152.4 Å²	152.4	68%	0.681	76%	0.758	S	S	*	*			cis	100.8	136.4	26.1	-54.6	0	0	0	0	112.9
867	Q	35.5	Very low	32.6	Very low	157 Å²	157	150 Å²	150	73%	0.734	75%	0.747	S	S	*	*			trans	96.2	144.1	171.2	-54.9	-167.6	32.3	0	0	118.3
868	Q	31.7	Very low	32.5	Very low	141 Å²	141	150.7 Å²	150.7	66%	0.659	75%	0.747	S	S	*	*			cis	-171.3	162.2	-39.5	-124.4	174.5	-82	0	0	113.9
869	N	33.8	Very low	32.6	Very low	118 Å²	118	147.8 Å²	147.8	63%	0.631	74%	0.744	S	S	*	*			trans	88.6	135.5	139.5	-78.6	-3.1	0	0	0	124.9
870	N	37.2	Very low	32.2	Very low	125 Å²	125	148.4 Å²	148.4	67%	0.668	74%	0.741	S	S	*	*			trans	84	111.4	144.1	-62.7	1.8	0	0	0	119.5
871	H	34.6	Very low	32.3	Very low	137 Å²	137	146.3 Å²	146.3	63%	0.634	73%	0.734	S	S	*	*				94.8	141.6	68.1	-92.9	-83.2	0	0	0	111.3
872	D	37.6	Very low	32.1	Very low	123 Å²	123	141 Å²	141	66%	0.658	72%	0.719	S	S	*	*			cis	-143.5	139.5	14	-100.9	-54.1	0	0	0	110.9
873	K	32.8	Very low	32.3	Very low	168 Å²	168	139.1 Å²	139.1	73%	0.73	71%	0.713	S	S	*	*				65.1	112.5	86.2	-68	-169.5	-168	162.5	0	119.6
874	K	35.1	Very low	32.1	Very low	192 Å²	192	137.3 Å²	137.3	84%	0.835	71%	0.709	S	S	*	*				156.4	121.5	126.9	-86.9	-170.6	175.3	-177.1	0	110.1
875	T	29.4	Very low	32.1	Very low	105 Å²	105	136.8 Å²	136.8	64%	0.644	71%	0.711	S	S	*	*				54.1	130.8	74.8	67	0	0	0	0	114.2
876	E	32.3	Very low	31.9	Very low	169 Å²	169	137.2 Å²	137.2	79%	0.79	71%	0.711	S	S	*	*			cis	-173.6	168	3.2	-104	174.7	-100.5	0	0	107.1
877	S	31.4	Very low	31.9	Very low	85 Å²	85	137.9 Å²	137.9	59%	0.594	72%	0.715	S	S	*	*			cis	-169.4	170.6	-14.8	49.7	0	0	0	0	110.3
878	M	28.1	Very low	31.6	Very low	168 Å²	168	137 Å²	137	83%	0.828	72%	0.72	S	S	*	*			trans	68.1	147.5	170.7	-64.6	172.9	64.1	0	0	116.8
879	T	33.3	Very low	31.4	Very low	118 Å²	118	139.9 Å²	139.9	72%	0.724	73%	0.73	S	S	*	*			cis	-149.4	161.6	7.1	-7.6	0	0	0	0	112
880	N	28.3	Very low	31.2	Very low	139 Å²	139	144.5 Å²	144.5	74%	0.743	74%	0.739	S	S	*	*			trans	-48	147.4	-178.8	-45.1	-13.2	0	0	0	116.4
881	Y	30.8	Very low	30.8	Very low	180 Å²	180	145.8 Å²	145.8	71%	0.706	75%	0.746	S	S	*	*				-158.2	149.2	105.3	-109	-78.3	0	0	0	111	Y56	Y56-Y881 VanDerWaalsContact OH-CE1 3.24Å; Y56-Y881 WeakPolarHBondContact OH-CE1 3.14Å; Y56-Y881 PolarHBondContact OH-OH 3.02Å
882	S	30	Very low	30.7	Very low	85 Å²	85	146.5 Å²	146.5	59%	0.594	75%	0.754	S	S	*	*			trans	-121.1	171.7	179.1	55.1	0	0	0	0	108.8
883	E	33.6	Very low	30.3	Very low	148 Å²	148	150.4 Å²	150.4	69%	0.692	77%	0.766	S	S	*	*			cis	-147.7	162.2	31.5	-71.4	-175.9	114.7	0	0	115.1
884	T	29.5	Very low	30.2	Very low	131 Å²	131	148.6 Å²	148.6	80%	0.804	77%	0.768	S	S	*	*			trans	47.8	93.3	150.8	54.6	0	0	0	0	120.4
885	S	27.4	Very low	30	Very low	112 Å²	112	146.8 Å²	146.8	78%	0.783	77%	0.767	S	S	*	*			trans	-120.7	132.7	139.1	-70.4	0	0	0	0	109.6
886	E	29	Very low	29.9	Very low	169 Å²	169	150.1 Å²	150.1	79%	0.79	78%	0.777	S	S	*	*			trans	57.9	159.5	153.3	-56.1	-172.9	131	0	0	122.3
887	T	27.9	Very low	29.9	Very low	125 Å²	125	148.5 Å²	148.5	77%	0.767	78%	0.778	S	S	*	*			trans	66	112.2	164	67	0	0	0	0	120.1
888	V	29.8	Very low	29.7	Very low	138 Å²	138	151 Å²	151	84%	0.836	79%	0.786	S	S	*	*			trans	-133.5	96.9	132.3	-177.7	0	0	0	0	109.4
889	F	27.5	Very low	30	Very low	202 Å²	202	150.6 Å²	150.6	89%	0.886	79%	0.786	S	S	*	*			trans	-85.4	118	153.2	-105.3	-92.5	0	0	0	107.9
890	R	30.2	Very low	29.8	Very low	215 Å²	215	152.7 Å²	152.7	81%	0.811	79%	0.793	S	S	*	*			trans	-169.8	121.5	155.4	-102.4	145.6	-176	176.6	2.1	107.2
891	N	28.2	Very low	30.1	Very low	153 Å²	153	149.7 Å²	149.7	82%	0.818	79%	0.794	S	S	*	*				57.8	84.4	74.9	-79.2	0.5	0	0	0	112.9
892	D	33.4	Very low	30.2	Very low	151 Å²	151	150 Å²	150	81%	0.807	80%	0.802	S	S	*	*			trans	-122.4	92.6	155	-92.6	-46.6	0	0	0	109.9	V894	D892-V894 HydrophobicContact CB-CG2 4.45Å
893	K	27.6	Very low	30.3	Very low	206 Å²	206	150.3 Å²	150.3	90%	0.896	80%	0.804	S	S	*	*			trans	-83.4	100.7	155.4	-76.8	-173.9	177.1	-175.7	0	106.8
894	V	31.8	Very low	30.4	Very low	130 Å²	130	151.4 Å²	151.4	79%	0.788	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-87.2	122.5	171.8	-177.4	0	0	0	0	109.2	D892	D892-V894 HydrophobicContact CB-CG2 4.45Å
895	L	30.5	Very low	30.7	Very low	154 Å²	154	153.3 Å²	153.3	81%	0.806	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-77.1	145.7	-179.2	-82.4	150.9	0	0	0	111.9	V897	L895-V897 PolarHBondContact O-N 3.42Å
896	M	26.6	Very low	31	Very low	175 Å²	175	157.3 Å²	157.3	86%	0.862	82%	0.821	S	S	*	*	P	Polyproline II helix	trans	-66.1	126	167.8	-64.4	-80	-84.1	0	0	109.7
897	V	32.7	Very low	31	Very low	134 Å²	134	158.1 Å²	158.1	81%	0.812	82%	0.822	S	S	*	*			trans	-133.7	121.1	163.8	-177.7	0	0	0	0	107.6	L895	L895-V897 PolarHBondContact O-N 3.42Å
898	N	28.8	Very low	31.3	Very low	139 Å²	139	160.1 Å²	160.1	74%	0.743	83%	0.828	S	S	*	*			trans	-75.8	146.1	175.9	-60.9	-31.8	0	0	0	110.1
899	D	33	Very low	31.2	Very low	158 Å²	158	158.9 Å²	158.9	85%	0.845	83%	0.825	S	S	*	*			trans	-149.2	155.1	141.5	-129.9	-31.5	0	0	0	111.3
900	L	30.3	Very low	31.5	Very low	163 Å²	163	155.8 Å²	155.8	85%	0.853	82%	0.822	S	S	*	*			trans	-91.7	144.6	-161.4	-63.7	101	0	0	0	114.4
901	G	33.4	Very low	31.6	Very low	76 Å²	76	151.5 Å²	151.5	78%	0.784	82%	0.82	S	S	*	*			trans	-159.4	84.5	177.1	0	0	0	0	0	113.2
902	Q	33.4	Very low	31.8	Very low	185 Å²	185	149.9 Å²	149.9	86%	0.864	82%	0.815	S	S	*	*			trans	-63.9	159.5	168.4	-69.7	168.4	-11.6	0	0	111.3
903	S	33	Very low	31.8	Very low	92 Å²	92	146.7 Å²	146.7	64%	0.643	81%	0.81	S	S	*	*			cis	-178.8	148.2	-22.4	54.7	0	0	0	0	107
904	D	35.6	Very low	32.1	Very low	171 Å²	171	145.3 Å²	145.3	91%	0.914	81%	0.807	S	S	*	*			trans	-153.5	140.4	147.9	-118.6	-32.1	0	0	0	111.2
905	H	34	Very low	32.5	Very low	172 Å²	172	147.7 Å²	147.7	80%	0.796	81%	0.809	S	S	*	*			trans	-107.3	133.3	-175	-84	-67	0	0	0	111.3
906	Q	34.4	Very low	32.9	Very low	196 Å²	196	149.3 Å²	149.3	92%	0.916	81%	0.812	S	S	*	*			trans	-128	131.4	145.6	-156.8	155	6.1	0	0	108.8
907	K	29.9	Very low	33.4	Very low	186 Å²	186	148.1 Å²	148.1	81%	0.809	81%	0.81	S	S	*	*			trans	-87.6	136.5	-173.1	-63.8	176.5	178.2	179.9	0	110.1
908	D	33.3	Very low	33.8	Very low	167 Å²	167	150 Å²	150	89%	0.893	82%	0.816	S	S	*	*			trans	-137.4	148.2	139.4	-99.7	-44.5	0	0	0	108.9
909	S	28.1	Very low	34.5	Very low	111 Å²	111	149 Å²	149	78%	0.776	81%	0.814	S	S	*	*			trans	-91.1	116.3	-165.7	55	0	0	0	0	112.8
910	V	33.4	Very low	34.8	Very low	137 Å²	137	149.2 Å²	149.2	83%	0.83	82%	0.815	S	S	*	*			trans	-97.8	124.3	159	-179.9	0	0	0	0	107.9	V912	V910-V912 PolarHBondContact O-N 2.91Å
911	V	32.3	Very low	35.1	Very low	126 Å²	126	145.1 Å²	145.1	76%	0.764	81%	0.812	S	S	*	*			trans	-75.9	115.7	175	176.9	0	0	0	0	108.2	A913	V911-A913 PolarHBondContact O-N 3.01Å
912	V	31.8	Very low	35.3	Very low	118 Å²	118	151 Å²	151	72%	0.715	82%	0.819	S	S	*	*			trans	-72.2	117	159.8	177.7	0	0	0	0	106.3	V910	V910-V912 PolarHBondContact O-N 2.91Å
913	A	34.1	Very low	35.7	Very low	84 Å²	84	151.2 Å²	151.2	69%	0.694	82%	0.82	S	S	*	*			trans	-80.6	113.7	161.7	0	0	0	0	0	106.8	V911 E915	V911-A913 PolarHBondContact O-N 3.01Å; A913-E915 PolarHBondContact O-N 3.37Å
914	E	33.3	Very low	36	Very low	178 Å²	178	155.8 Å²	155.8	83%	0.832	83%	0.831	S	S	*	*			trans	-70.2	113.7	168.1	-65.5	165.8	157.5	0	0	106.4
915	E	40.1	Very low	36.2	Very low	180 Å²	180	157 Å²	157	84%	0.841	83%	0.832	S	S	*	*			trans	-76.9	124.4	163.6	-70.7	-169.4	151.5	0	0	106.5	A913 D917	A913-E915 PolarHBondContact O-N 3.37Å; E915-D917 PolarHBondContact O-N 3.03Å
916	E	39.2	Very low	36.6	Very low	187 Å²	187	157.5 Å²	157.5	87%	0.874	83%	0.834	S	S	*	*			trans	-72.1	116.8	-176.7	-64.4	177.2	132.6	0	0	109.7	D918	E916-D918 PolarHBondContact O-N 3.11Å
917	D	38.3	Very low	36.9	Very low	151 Å²	151	155.4 Å²	155.4	81%	0.807	83%	0.83	S	S	*	*			trans	-70.1	107.8	174	-76.4	-53.3	0	0	0	110.1	E915 V919	E915-D917 PolarHBondContact O-N 3.03Å; D917-V919 PolarHBondContact O-N 3.38Å; D917-V919 VanDerWaalsContact O-N 3.09Å
918	D	41	Very low	37.6	Very low	174 Å²	174	156 Å²	156	93%	0.93	84%	0.835	S	S	*	*			trans	-67.2	101.4	167.7	-87.7	-41	0	0	0	109.7	E916	E916-D918 PolarHBondContact O-N 3.11Å
919	V	43	Very low	38.1	Very low	118 Å²	118	156.5 Å²	156.5	72%	0.715	83%	0.832	S	S	*	*			trans	-87.3	122.7	176.9	-175.9	0	0	0	0	110.7	D917	D917-V919 PolarHBondContact O-N 3.38Å; D917-V919 VanDerWaalsContact O-N 3.09Å
920	D	38.9	Very low	38.9	Very low	162 Å²	162	159.3 Å²	159.3	87%	0.866	84%	0.839	S	S	*	*			trans	167.5	126.8	135.7	-89	-22.1	0	0	0	109.7
921	G	37.6	Very low	39.4	Very low	77 Å²	77	160.3 Å²	160.3	79%	0.794	83%	0.834	S	S	*	*			trans	159.9	66.9	-177.8	0	0	0	0	0	113.9	E923	G921-E923 PolarHBondContact O-N 3.37Å
922	E	37.3	Very low	40	Very low	199 Å²	199	162.5 Å²	162.5	93%	0.93	84%	0.836	S	S	*	*			trans	-75.4	110.5	169.1	-62.9	178.3	150.8	0	0	109.6
923	E	41.2	Very low	40.8	Very low	190 Å²	190	166.3 Å²	166.3	89%	0.888	84%	0.839	S	S	*	*			trans	-128.6	141.8	161.9	-71.3	-172.1	163.3	0	0	108.2	G921	G921-E923 PolarHBondContact O-N 3.37Å
924	E	39.9	Very low	41.3	Very low	187 Å²	187	168.5 Å²	168.5	87%	0.874	84%	0.839	S	S	*	*			trans	-84.8	143.7	-160.7	-61.2	174.2	127.1	0	0	112.3	E926	E924-E926 PolarHBondContact O-N 3.35Å
925	E	39.8	Very low	41.7	Very low	198 Å²	198	167.3 Å²	167.3	93%	0.925	84%	0.838	S	S	*	*			trans	-78.3	101.5	170.2	-68.6	-171.8	141.7	0	0	108.9
926	E	40.7	Very low	42.2	Very low	182 Å²	182	166.3 Å²	166.3	85%	0.85	84%	0.839	S	S	*	*			trans	-82.2	120.3	166.1	-69.4	-170.1	142.9	0	0	109.8	E924 E928	E924-E926 PolarHBondContact O-N 3.35Å; E926-E928 PolarHBondContact O-N 2.96Å
927	D	41.8	Very low	42.5	Very low	152 Å²	152	164.5 Å²	164.5	81%	0.813	84%	0.835	S	S	*	*			trans	-73.5	109.7	174.9	-73.3	-61	0	0	0	110.7	E929	D927-E929 PolarHBondContact O-N 3.49Å; D927-E929 VanDerWaalsContact O-N 3.16Å
928	E	43.7	Very low	43.2	Very low	197 Å²	197	165.3 Å²	165.3	92%	0.921	84%	0.839	S	S	*	*			trans	-75.7	93.7	165.3	-72.4	-173.5	151.4	0	0	109.7	E926	E926-E928 PolarHBondContact O-N 2.96Å
929	E	45.2	Very low	43.6	Very low	178 Å²	178	163.9 Å²	163.9	83%	0.832	83%	0.832	S	S	*	*			trans	-73.4	130.1	168.2	-66.3	-165.9	138	0	0	110.8	D927 E931	D927-E929 PolarHBondContact O-N 3.49Å; D927-E929 VanDerWaalsContact O-N 3.16Å; E929-E931 PolarHBondContact O-N 3.42Å
930	D	44.3	Very low	43.9	Very low	171 Å²	171	165.5 Å²	165.5	91%	0.914	84%	0.836	S	S	*	*			trans	-67.5	96.3	177.1	-74	-62.2	0	0	0	111.3	E932	D930-E932 PolarHBondContact O-N 3.32Å
931	E	43.4	Very low	44.4	Very low	158 Å²	158	164.9 Å²	164.9	74%	0.738	83%	0.833	S	S	*	*			trans	-70	113.5	173.8	-79.1	-157	154.8	0	0	112.5	E929 Y933	E929-E931 PolarHBondContact O-N 3.42Å; E931-Y933 PolarHBondContact O-N 3.23Å; E931-Y933 VanDerWaalsContact O-N 3.14Å
932	E	46.5	Very low	44.8	Very low	172 Å²	172	169.8 Å²	169.8	80%	0.804	84%	0.835	S	S	*	*			trans	-80.2	88.5	178.2	-170.1	173.7	-128.9	0	0	110.9	D930 N934	D930-E932 PolarHBondContact O-N 3.32Å; E932-N934 PolarHBondContact O-N 3.14Å; E932-N934 VanDerWaalsContact O-N 3.09Å; E932-N934 PolarHBondContact O-ND2 2.79Å
933	Y	47.7	Very low	45.2	Very low	197 Å²	197	166.3 Å²	166.3	77%	0.773	82%	0.823	S	S	*	*			trans	-55.8	112.9	176.5	-83.6	-103.2	0	0	0	111.7	E931	E931-Y933 PolarHBondContact O-N 3.23Å; E931-Y933 VanDerWaalsContact O-N 3.14Å
934	N	44.5	Very low	45.3	Very low	130 Å²	130	165.8 Å²	165.8	70%	0.695	82%	0.821	S	S	*	*			trans	-109.4	112	167.5	-73.9	-100.3	0	0	0	107.9	E932	E932-N934 PolarHBondContact O-N 3.14Å; E932-N934 VanDerWaalsContact O-N 3.09Å; E932-N934 PolarHBondContact O-ND2 2.79Å
935	D	41.4	Very low	45.4	Very low	154 Å²	154	160.6 Å²	160.6	82%	0.824	82%	0.817	S	S	*	*			trans	-74.7	123.6	168	-62.7	-49.6	0	0	0	109.2
936	D	50.8	Low	45.6	Very low	158 Å²	158	159.5 Å²	159.5	85%	0.845	81%	0.812	S	S	*	*			trans	-151.3	141.6	160.1	-101.8	-29.5	0	0	0	108.9
937	D	45.1	Very low	45.7	Very low	150 Å²	150	159.2 Å²	159.2	80%	0.802	81%	0.811	S	S	*	*			trans	-49.8	151.4	-166.8	-49.8	-46.5	0	0	0	118.8
938	D	52.9	Low	45.7	Very low	167 Å²	167	160.7 Å²	160.7	89%	0.893	81%	0.813	S	S	*	*			trans	-158.1	148.8	133.8	-110.3	-23	0	0	0	110.7
939	D	49.6	Very low	45.7	Very low	144 Å²	144	158.9 Å²	158.9	77%	0.77	80%	0.804	S	S	*	*			trans	-85	157	-169.1	-63.7	-71.6	0	0	0	115.1
940	D	49.8	Very low	45.5	Very low	152 Å²	152	156.5 Å²	156.5	81%	0.813	80%	0.797	S	S	*	*				167	110.8	117.3	-91	-16.5	0	0	0	114.6
941	D	49.3	Very low	45.8	Very low	149 Å²	149	159.9 Å²	159.9	80%	0.797	82%	0.816	S	S	*	*			trans	55.6	146.3	134.7	-93.9	-17.3	0	0	0	126.5
942	E	45.9	Very low	45.9	Very low	180 Å²	180	160 Å²	160	84%	0.841	82%	0.819	S	S	*	*			trans	64.5	148	161.5	-65.6	-173	-171.4	0	0	121.5
943	N	45.1	Very low	45.8	Very low	127 Å²	127	159.4 Å²	159.4	68%	0.679	82%	0.82	S	S	*	*			cis	-169.5	152.5	-34.2	-169.3	18.2	0	0	0	108.7
944	E	44.2	Very low	45.7	Very low	179 Å²	179	157.3 Å²	157.3	84%	0.836	82%	0.823	S	S	*	*			trans	62.4	145.7	170.5	-37.4	-171.1	174.2	0	0	117
945	G	42.3	Very low	45.8	Very low	77 Å²	77	158.9 Å²	158.9	79%	0.794	83%	0.83	S	S	*	*			cis	-172.6	158.9	-3.5	0	0	0	0	0	113.4
946	E	44.2	Very low	46.1	Very low	175 Å²	175	159.2 Å²	159.2	82%	0.818	83%	0.831	S	S	*	*			trans	-33.9	133	-179.2	-57.9	165	169.1	0	0	119.8
947	Q	42	Very low	45.8	Very low	176 Å²	176	159.3 Å²	159.3	82%	0.822	83%	0.83	S	S	*	*				167.1	116.5	125.3	-89.8	153.4	37.8	0	0	109.2
948	E	42.6	Very low	45.8	Very low	183 Å²	183	159.9 Å²	159.9	86%	0.855	83%	0.832	S	S	*	*				80.9	143.1	60	-75.3	-156	142.5	0	0	115.7
949	E	42.7	Very low	45.3	Very low	159 Å²	159	159.4 Å²	159.4	74%	0.743	83%	0.827	S	S	*	*			trans	78	101.1	168.5	-58.8	-138.9	108.1	0	0	121.3
950	N	41.5	Very low	44.9	Very low	128 Å²	128	160.7 Å²	160.7	68%	0.684	83%	0.832	S	S	*	*				64.2	106.7	124.9	-44.8	-30.3	0	0	0	120.8
951	D	49.5	Very low	44.5	Very low	243 Å²	243	161.5 Å²	161.5	100%	1.299	83%	0.834	S	S	*	*				-153.5	0	85.9	-107.3	-10.3	0	0	0	110.8

Retrieved 951 of 951 residues in 159.1 ms (Link to these results)

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