A0A087XMC9_POEFO Loading...

Xeroderma pigmentosum, complementation group C

AlphaFold DB , UniProt , Accession A0A087XMC9, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 842 aa.

						>A0A087XMC9_POEFO|A0A087XMC9
MAKRRKCAETEADTKKPKQVLNAEDRGAKTRSRKKAPENDPAEKEEKLERKVNPKPRWSSKRAAQNKTSSATNTSAHSKTSKYFQSPPKEEVNSDDDFEMPTAAPPVVKKSTKKPEEEEEKEEEEEDDSEDEDDWEEMEELAEPLGPAETPEPVLPSQPVEIEIETAEVRKQKKRQAEFETYLRRMMKRFKKDLLIDTHKVHLLCLLANGMFRNRLCSEPDLLAVALSLLPPHFCTVARERIDQNYLSGLLKWFRATFTLDPSLPTEERPDPQALLERRLGSLSARDHQEMTHLFLLFLRSLQLFCRLVLSLHPVPFKPPSSKSKGPRTSTGAPERCQTSQESSKSNSPETKVSPGTKRPAQGEKVKGSSGGKKAKRKKMKEEEEEKPVLSAGQRPKNSKRRSVASKVSYKEESNSEEEEEEASDAEEYQESSEDDFETCTKRARKKMRNATSSEKTSRTQGTRKRRRTGEKNEDGEWEECKEEDDEDEGATSNRAKRRSGQRKDGPGADEWLEVYLDKSSSWVCVDVEHGVEVPHLCSQNATAPLTYVVAVDGDGFLKDLGRKYDPTWMTASRKRRVDDEWWEDTLEPFMGPEDERDKKEEKELQSKMLNKPMPTSIAEYKNHPLYALKRHLLKYEALYPPTAAVLGYCRGEPVYSRDCVHTLHSRETWLKEARTVRLGEEPYKMVKGFSNRSRKARMMSEMKDENDLPLFGEWQTEEYQPPIAVDGKVPRNDYGNVYLFKACMIPVGCVHLRLPNLHRVAKKLDLDAAPAVTGFDYHGGYSHAVTDGYIVCEEDEEVLRAAWVVEQEIQKRKEKEKKEKRAIASWNPLVNNLSVEKTNTV
					

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	29	Very low	32.8	Very low	250 Å²	250	158.7 Å²	158.7	100%	1.232	80%	0.796	S	S	*	*				0	-178.4	0	-64.6	-171.8	-173.8	0	0	109.1
2	A	34.2	Very low	32.7	Very low	90 Å²	90	153.2 Å²	153.2	74%	0.744	79%	0.793	S	S	*	*			trans	-67.5	165.2	176.5	0	0	0	0	0	111.8
3	K	36	Very low	32.8	Very low	179 Å²	179	149.4 Å²	149.4	78%	0.778	78%	0.775	S	S	*	*			cis	-170.8	143.6	44.3	-109.4	153.1	-179	169.1	0	110.2
4	R	35.5	Very low	32.8	Very low	197 Å²	197	146.7 Å²	146.7	74%	0.743	77%	0.769	S	S	*	*			trans	63.3	162.3	144.4	-65.2	-179.7	167.1	-176.7	-2.7	117.8
5	R	34.6	Very low	33	Very low	184 Å²	184	146.9 Å²	146.9	69%	0.694	76%	0.761	S	S	*	*			cis	-169.8	143.9	-15	-112.4	176.6	173.8	-175.8	-4.9	110.1
6	K	33	Very low	33.2	Very low	184 Å²	184	149.5 Å²	149.5	80%	0.8	77%	0.765	S	S	*	*			trans	63.2	158.8	146.3	-73.5	-160.4	158.5	-147.8	0	118.7
7	C	30.5	Very low	33.9	Very low	98 Å²	98	147.2 Å²	147.2	66%	0.662	76%	0.762	S	S	*	*			cis	-160.8	-174.8	-10.5	-115.8	0	0	0	0	110.9
8	A	30.9	Very low	33.9	Very low	84 Å²	84	148.5 Å²	148.5	69%	0.694	76%	0.761	S	S	*	*			trans	85.8	122.2	-173.3	0	0	0	0	0	113.3
9	E	33.1	Very low	33.8	Very low	181 Å²	181	148.1 Å²	148.1	85%	0.846	76%	0.755	S	S	*	*			cis	78.9	132.4	42.8	-60.8	171.5	-165.8	0	0	111.8
10	T	31.3	Very low	33.7	Very low	115 Å²	115	146.3 Å²	146.3	71%	0.706	75%	0.751	S	S	*	*			cis	-135.8	164.3	24.9	48.9	0	0	0	0	115.4
11	E	32.3	Very low	33.6	Very low	184 Å²	184	146.3 Å²	146.3	86%	0.86	75%	0.752	S	S	*	*			trans	46.3	154.8	137.6	-69.4	-179.5	160.8	0	0	122.8
12	A	32.5	Very low	33.7	Very low	92 Å²	92	141 Å²	141	76%	0.76	73%	0.729	S	S	*	*			cis	-173.4	166.8	-11.5	0	0	0	0	0	106.7
13	D	33.4	Very low	33.5	Very low	104 Å²	104	140.3 Å²	140.3	56%	0.556	72%	0.723	S	S	*	*			cis	-155.3	-171.3	-10.9	161.3	49.4	0	0	0	105.7	K15	D13-K15 VanDerWaalsContact CG-NZ 3.32Å; D13-K15 WeakPolarHBondContact OD1-CE 3.5Å; D13-K15 IonicContact OD1-NZ 3.17Å; D13-K15 PolarHBondContact OD1-NZ 2.65Å; D13-K15 VanDerWaalsContact OD1-NZ 3.17Å; D13-K15 WeakPolarHBondContact OD2-CE 3.16Å; D13-K15 IonicContact OD2-NZ 2.65Å; D13-K15 PolarHBondContact OD2-NZ 3.17Å
14	T	32.8	Very low	33.3	Very low	112 Å²	112	140.7 Å²	140.7	69%	0.687	73%	0.728	S	S	*	*			trans	86.2	103	171.6	73.5	0	0	0	0	114.6
15	K	35.3	Very low	33.1	Very low	149 Å²	149	136.6 Å²	136.6	65%	0.648	72%	0.72	S	S	*	*				75.3	134.3	57.1	-62	160.1	-174.1	151.2	0	111.6	D13	D13-K15 VanDerWaalsContact CG-NZ 3.32Å; D13-K15 WeakPolarHBondContact OD1-CE 3.5Å; D13-K15 IonicContact OD1-NZ 3.17Å; D13-K15 PolarHBondContact OD1-NZ 2.65Å; D13-K15 VanDerWaalsContact OD1-NZ 3.17Å; D13-K15 WeakPolarHBondContact OD2-CE 3.16Å; D13-K15 IonicContact OD2-NZ 2.65Å; D13-K15 PolarHBondContact OD2-NZ 3.17Å
16	K	36.1	Very low	32.9	Very low	189 Å²	189	138.6 Å²	138.6	82%	0.822	73%	0.728	S	S	*	*			cis	-154.8	170.8	-3.5	-115.5	175.7	178.1	-178	0	110.1
17	P	46.2	Very low	32.6	Very low	110 Å²	110	133.3 Å²	133.3	71%	0.714	73%	0.726	S	S	*	*			trans	-123.9	-140.9	-160.6	43.6	-29.2	0	0	0	112.4
18	K	33.1	Very low	32.6	Very low	171 Å²	171	133.1 Å²	133.1	74%	0.743	73%	0.731	S	S	*	*			trans	94.4	149.7	161.4	-67.1	-155.9	170.6	-145.9	0	118.2
19	Q	33	Very low	32.5	Very low	140 Å²	140	138.3 Å²	138.3	65%	0.654	74%	0.738	S	S	*	*			cis	-165.4	130.4	-34.8	-123.7	175.2	-35	0	0	109.6
20	V	31.3	Very low	32.4	Very low	112 Å²	112	135.8 Å²	135.8	68%	0.679	74%	0.735	S	S	*	*				34.9	131.6	126	-179.3	0	0	0	0	120.2
21	L	31.8	Very low	32.3	Very low	147 Å²	147	141.4 Å²	141.4	77%	0.77	74%	0.744	S	S	*	*				177	111.1	124.1	-89.8	173.9	0	0	0	107.9
22	N	31.1	Very low	32.2	Very low	140 Å²	140	137.6 Å²	137.6	75%	0.749	74%	0.737	S	S	*	*				85	141.3	93.6	-78.2	28.1	0	0	0	114.3
23	A	30.6	Very low	31.9	Very low	75 Å²	75	145 Å²	145	62%	0.62	75%	0.746	S	S	*	*			cis	-161.3	163	-4.8	0	0	0	0	0	112.1
24	E	31.4	Very low	31.7	Very low	187 Å²	187	149.6 Å²	149.6	87%	0.874	76%	0.76	S	S	*	*			trans	35.7	152.3	141.6	-58.5	178.3	163.8	0	0	121.9
25	D	31.1	Very low	31.5	Very low	110 Å²	110	154.2 Å²	154.2	59%	0.588	77%	0.771	S	S	*	*			cis	-158	165.1	13.9	-159.8	-3	0	0	0	112.6
26	R	29.4	Very low	31.3	Very low	226 Å²	226	151 Å²	151	85%	0.853	77%	0.772	S	S	*	*			trans	57.8	142.9	161.1	-39.9	-168.2	-176	-178.6	2.9	122.9
27	G	28	Very low	31.7	Very low	73 Å²	73	147 Å²	147	75%	0.753	77%	0.766	S	S	*	*				137	66.7	128.8	0	0	0	0	0	122.6
28	A	29.7	Very low	30.8	Very low	94 Å²	94	150.2 Å²	150.2	78%	0.777	77%	0.771	S	S	*	*			trans	39.2	122.7	144.1	0	0	0	0	0	124.4
29	K	29.7	Very low	30.5	Very low	193 Å²	193	150.2 Å²	150.2	84%	0.839	78%	0.779	S	S	*	*			trans	78.3	146.7	137.9	-72	-176.9	176.6	177.9	0	123.4
30	T	29.7	Very low	30.3	Very low	128 Å²	128	150.9 Å²	150.9	79%	0.785	79%	0.787	S	S	*	*			trans	81.4	95.7	147.8	31.3	0	0	0	0	123.6
31	R	30	Very low	31.1	Very low	234 Å²	234	151.1 Å²	151.1	88%	0.883	79%	0.791	S	S	*	*				48.4	104.8	123.5	-96.7	-173.1	168.6	174.5	-4	121.6
32	S	29.7	Very low	30.9	Very low	104 Å²	104	148.7 Å²	148.7	73%	0.727	79%	0.792	S	S	*	*				50.3	122.9	118.8	65.2	0	0	0	0	121.9
33	R	26.2	Very low	30.8	Very low	248 Å²	248	149.3 Å²	149.3	94%	0.936	79%	0.791	S	S	*	*			trans	-159.3	159.1	158.1	-149.8	173	-177.1	-172.4	1	113.9
34	K	29.4	Very low	30.7	Very low	200 Å²	200	153.4 Å²	153.4	87%	0.87	79%	0.794	S	S	*	*			trans	88.3	130.7	178.5	-57.3	-179.9	179.1	-179.3	0	114.1
35	K	29.1	Very low	30.6	Very low	208 Å²	208	153.2 Å²	153.2	90%	0.904	79%	0.793	S	S	*	*			cis	92.2	118.8	18.1	-157.3	-170.2	-177.4	-168.5	0	114.8
36	A	30.4	Very low	30.5	Very low	82 Å²	82	156 Å²	156	68%	0.678	80%	0.803	S	S	*	*			trans	-76.6	-175.8	175.9	0	0	0	0	0	112.3
37	P	44.1	Very low	30.3	Very low	106 Å²	106	155 Å²	155	69%	0.688	81%	0.805	S	S	*	*			cis	-140.9	175.3	14	43.9	-24.3	0	0	0	119.2
38	E	27.8	Very low	30.3	Very low	177 Å²	177	157.6 Å²	157.6	83%	0.827	80%	0.801	S	S	*	*			trans	33	135.2	145.4	-66.2	165.1	143.3	0	0	124
39	N	26.8	Very low	30.3	Very low	171 Å²	171	162.1 Å²	162.1	91%	0.914	81%	0.806	S	S	*	*			trans	-162.8	151	135.1	-99.5	-56.3	0	0	0	110.8
40	D	28.5	Very low	30.3	Very low	154 Å²	154	164 Å²	164	82%	0.824	81%	0.808	S	S	*	*			trans	-93.6	-175.6	-177.4	-94.9	-43.1	0	0	0	113
41	P	49.5	Very low	30.2	Very low	116 Å²	116	166.9 Å²	166.9	75%	0.753	81%	0.809	S	S	*	*			cis	-136.9	170.6	-45.6	38.8	-23.7	0	0	0	113.5
42	A	26.9	Very low	30.1	Very low	96 Å²	96	162.6 Å²	162.6	79%	0.793	81%	0.809	S	S	*	*			trans	176.4	144.2	144.7	0	0	0	0	0	115.3
43	E	29.3	Very low	29.9	Very low	153 Å²	153	164 Å²	164	72%	0.715	81%	0.808	S	S	*	*			trans	8.6	149.5	147.5	-51.9	-155.2	149.6	0	0	121.8
44	K	28.1	Very low	30.1	Very low	161 Å²	161	158 Å²	158	70%	0.7	80%	0.802	S	S	*	*			cis	-166.2	-177.1	1.9	-117.8	169.2	-165.9	149	0	110.8
45	E	29.3	Very low	29.9	Very low	183 Å²	183	158.2 Å²	158.2	86%	0.855	80%	0.802	S	S	*	*			trans	65.7	102	174.6	-58.4	-173.7	178.8	0	0	114.9
46	E	28.4	Very low	30	Very low	169 Å²	169	154.3 Å²	154.3	79%	0.79	80%	0.798	S	S	*	*				74.2	106.7	50.6	-162.5	174.8	-159.6	0	0	114.6
47	K	26.3	Very low	29.8	Very low	204 Å²	204	161.3 Å²	161.3	89%	0.887	81%	0.807	S	S	*	*			trans	-126.1	118.5	166	-172	176.9	-178	-179.4	0	109.2
48	L	28.3	Very low	28.8	Very low	128 Å²	128	166.8 Å²	166.8	67%	0.67	81%	0.814	S	S	*	*			trans	-79.4	131.1	-170.8	-71	157.7	0	0	0	113.2
49	E	29.5	Very low	28.8	Very low	189 Å²	189	163.7 Å²	163.7	88%	0.883	81%	0.812	S	S	*	*			trans	-84.6	143	156.6	-64	-173.7	153.9	0	0	110.2
50	R	29.2	Very low	28.8	Very low	234 Å²	234	161 Å²	161	88%	0.883	81%	0.806	S	S	*	*			trans	-128.7	107.1	172.1	-87	-168.7	170.5	-172.7	-1.1	113.7
51	K	28.4	Very low	28.8	Very low	188 Å²	188	163.4 Å²	163.4	82%	0.817	81%	0.81	S	S	*	*			trans	-46.1	149.7	169.8	-52.4	159.9	-176.9	173.3	0	114.4
52	V	26.6	Very low	27.7	Very low	143 Å²	143	169.5 Å²	169.5	87%	0.867	82%	0.818	S	S	*	*			trans	-134.9	139.6	139.2	-178.1	0	0	0	0	108.3
53	N	25.2	Very low	27.7	Very low	133 Å²	133	169.7 Å²	169.7	71%	0.711	82%	0.819	S	S	*	*			trans	-104.6	142.7	-179.3	-73.5	-0.6	0	0	0	112
54	P	30.3	Very low	27.6	Very low	124 Å²	124	167 Å²	167	81%	0.805	82%	0.823	S	S	*	*	P	Polyproline II helix	trans	-76.6	157.5	158.1	30.8	-29.8	0	0	0	111.8
55	K	26.3	Very low	27.6	Very low	203 Å²	203	168.7 Å²	168.7	88%	0.883	83%	0.834	S	S	*	*	P	Polyproline II helix	trans	-101.5	140.5	178.5	-67.2	174.5	-178.3	169.1	0	111.3
56	P	31.5	Very low	27.6	Very low	126 Å²	126	167.4 Å²	167.4	82%	0.818	83%	0.832	S	S	*	*	P	Polyproline II helix	trans	-85.2	155.9	176.1	34.8	-35.2	0	0	0	112.5
57	R	25.4	Very low	27.6	Very low	230 Å²	230	168.7 Å²	168.7	87%	0.868	84%	0.835	S	S	*	*			trans	-147.3	120.9	163.8	-123.2	-179.6	-179	178.1	-0.1	113.6
58	W	24.2	Very low	27.8	Very low	220 Å²	220	164.8 Å²	164.8	83%	0.833	83%	0.829	S	S	*	*			trans	43.1	108.6	159.6	-102.9	-63.8	0	0	0	120.7
59	S	26.1	Very low	27.9	Very low	113 Å²	113	163.4 Å²	163.4	79%	0.79	83%	0.83	S	S	*	*			trans	-114.5	146.8	137	60.5	0	0	0	0	108.6
60	S	27.8	Very low	27.8	Very low	113 Å²	113	159.9 Å²	159.9	79%	0.79	83%	0.826	S	S	*	*			trans	-107.1	109.8	-175.8	-167.7	0	0	0	0	110.9
61	K	28.2	Very low	27.8	Very low	205 Å²	205	152.8 Å²	152.8	89%	0.891	82%	0.817	S	S	*	*			trans	-101.1	137.7	164.6	-80.6	-174.8	174.3	-179.4	0	109.2
62	R	26.2	Very low	27.8	Very low	245 Å²	245	149.3 Å²	149.3	93%	0.925	81%	0.812	S	S	*	*			trans	-130	122.3	163.7	-151.3	175	-168	-172.4	2.6	108.9
63	A	27.1	Very low	27.8	Very low	100 Å²	100	149.3 Å²	149.3	83%	0.826	81%	0.807	S	S	*	*			trans	-89.7	163.7	179.6	0	0	0	0	0	111.5
64	A	28	Very low	28	Very low	95 Å²	95	149 Å²	149	79%	0.785	81%	0.811	S	S	*	*			trans	-79.3	157.5	-175.9	0	0	0	0	0	113.8
65	Q	27.6	Very low	27.7	Very low	198 Å²	198	148.4 Å²	148.4	93%	0.925	81%	0.809	S	S	*	*			trans	-151.3	141.9	153.6	-112	178.6	3.2	0	0	110.1
66	N	28.8	Very low	27.8	Very low	155 Å²	155	142.9 Å²	142.9	83%	0.829	80%	0.801	S	S	*	*			trans	-89.2	147.3	-175.5	-68	-24	0	0	0	112.6
67	K	29.6	Very low	27.7	Very low	196 Å²	196	145 Å²	145	85%	0.852	80%	0.8	S	S	*	*			trans	-174.4	111.1	134.4	-104.5	163.7	-176	-178	0	114.4
68	T	28.7	Very low	27.8	Very low	122 Å²	122	138.4 Å²	138.4	75%	0.748	79%	0.789	S	S	*	*			trans	35	148.4	132.6	55.9	0	0	0	0	124.3
69	S	30.7	Very low	28.1	Very low	100 Å²	100	137.2 Å²	137.2	70%	0.699	79%	0.79	S	S	*	*			trans	82.8	89.8	144.5	67	0	0	0	0	122.3
70	S	27.7	Very low	28.2	Very low	115 Å²	115	138 Å²	138	80%	0.804	79%	0.789	S	S	*	*				62.9	136.5	113.9	68.8	0	0	0	0	124.3
71	A	29.2	Very low	28.4	Very low	84 Å²	84	137.9 Å²	137.9	69%	0.694	79%	0.789	S	S	*	*			trans	101.4	105.6	133.8	0	0	0	0	0	121.9
72	T	27.8	Very low	28.5	Very low	116 Å²	116	137 Å²	137	71%	0.712	79%	0.785	S	S	*	*				61.3	117.8	127.7	60.6	0	0	0	0	124.1
73	N	27.7	Very low	28.7	Very low	142 Å²	142	135.3 Å²	135.3	76%	0.759	78%	0.78	S	S	*	*				84.7	145.7	121.3	-69.7	3.1	0	0	0	124.8
74	T	28.2	Very low	28.8	Very low	128 Å²	128	139.1 Å²	139.1	79%	0.785	78%	0.778	S	S	*	*			trans	75.3	106.7	147.7	38.9	0	0	0	0	122
75	S	25.5	Very low	28.7	Very low	110 Å²	110	143.1 Å²	143.1	77%	0.769	78%	0.781	S	S	*	*			trans	-22.9	146	148.1	54.3	0	0	0	0	119.4
76	A	28.4	Very low	29.1	Very low	87 Å²	87	138.9 Å²	138.9	72%	0.719	77%	0.773	S	S	*	*				173.9	160.6	93	0	0	0	0	0	115.7
77	H	28.3	Very low	29.6	Very low	172 Å²	172	137.6 Å²	137.6	80%	0.796	77%	0.773	S	S	*	*			trans	64.7	78.3	154.5	-72.5	-57.5	0	0	0	124.6
78	S	27.9	Very low	29.9	Very low	90 Å²	90	133.5 Å²	133.5	63%	0.629	77%	0.767	S	S	*	*				41.4	121.2	109.3	67.2	0	0	0	0	123.1
79	K	30.9	Very low	30	Very low	196 Å²	196	137.2 Å²	137.2	85%	0.852	77%	0.772	S	S	*	*			trans	160.1	141.5	135.7	-90.7	166.2	-177.8	178.2	0	109
80	T	28.7	Very low	29.9	Very low	128 Å²	128	140.6 Å²	140.6	79%	0.785	78%	0.777	S	S	*	*			cis	-161.5	167.8	-1	-0.1	0	0	0	0	111
81	S	30.5	Very low	29.8	Very low	111 Å²	111	143.6 Å²	143.6	78%	0.776	78%	0.779	S	S	*	*			trans	78	139.3	164.8	-151.6	0	0	0	0	117
82	K	30.8	Very low	29.7	Very low	187 Å²	187	145 Å²	145	81%	0.813	78%	0.778	S	S	*	*			cis	161.7	105.9	-31.3	-103.8	-174.6	174.7	-174	0	106.1
83	Y	30.1	Very low	29.6	Very low	209 Å²	209	146.1 Å²	146.1	82%	0.82	78%	0.78	S	S	*	*				-168	130.9	121.7	-128.9	-104.2	0	0	0	112.4
84	F	28.6	Very low	29.6	Very low	181 Å²	181	143.7 Å²	143.7	79%	0.794	77%	0.774	S	S	*	*			trans	19.2	128	166.6	-84.8	-95.7	0	0	0	123.4
85	Q	27.8	Very low	29.6	Very low	178 Å²	178	145.2 Å²	145.2	83%	0.832	78%	0.777	S	S	*	*			trans	-134.8	148.9	147.5	-76.8	-173.3	-19.3	0	0	109.4
86	S	35.3	Very low	29.7	Very low	109 Å²	109	147.3 Å²	147.3	76%	0.762	78%	0.78	S	S	*	*			trans	42.9	146.3	150.5	-51	0	0	0	0	122
87	P	38.5	Very low	29.8	Very low	128 Å²	128	149.7 Å²	149.7	83%	0.831	78%	0.781	S	S	*	*				-146.4	164.3	108.6	39.6	-26.9	0	0	0	115.7
88	P	36.1	Very low	29.6	Very low	111 Å²	111	150.8 Å²	150.8	72%	0.721	78%	0.783	S	S	*	*			trans	-115.7	144.8	166.4	37.8	-27.3	0	0	0	114.5
89	K	31.6	Very low	29.7	Very low	199 Å²	199	154.8 Å²	154.8	87%	0.865	79%	0.792	S	S	*	*			trans	51.7	159.7	151	-52.7	-173.5	174.1	-173.7	0	119.5
90	E	27.7	Very low	29.6	Very low	172 Å²	172	153.7 Å²	153.7	80%	0.804	79%	0.792	S	S	*	*			cis	-137.8	163.5	12.9	-68.7	179	138.9	0	0	111.9
91	E	26.2	Very low	29.7	Very low	178 Å²	178	153.1 Å²	153.1	83%	0.832	79%	0.79	S	S	*	*				155.9	119	127.5	-84.2	-159.2	-160.7	0	0	116.6
92	V	27.6	Very low	29.6	Very low	113 Å²	113	154.5 Å²	154.5	69%	0.685	79%	0.794	S	S	*	*			trans	57.3	146.2	131.8	-162.2	0	0	0	0	123.8
93	N	25.3	Very low	29.4	Very low	140 Å²	140	150.6 Å²	150.6	75%	0.749	80%	0.797	S	S	*	*			trans	80	128	177.5	-47.2	-66.8	0	0	0	115.5
94	S	27.5	Very low	29.4	Very low	91 Å²	91	145.1 Å²	145.1	64%	0.636	80%	0.795	S	S	*	*			cis	96.6	111	18.7	81.2	0	0	0	0	116.2
95	D	27.8	Very low	29.5	Very low	160 Å²	160	142.1 Å²	142.1	86%	0.856	79%	0.794	S	S	*	*				-171.7	161.5	129.4	-92.8	-20.5	0	0	0	110
96	D	28.9	Very low	29.6	Very low	153 Å²	153	139.7 Å²	139.7	82%	0.818	79%	0.794	S	S	*	*			trans	-75	-179.8	-179.5	-67.9	-68.8	0	0	0	112.3
97	D	29	Very low	29.2	Very low	138 Å²	138	140.8 Å²	140.8	74%	0.738	80%	0.795	S	S	*	*			cis	-164.4	-179.1	25.4	-155.8	-11.3	0	0	0	112.7
98	F	25.2	Very low	28.6	Very low	194 Å²	194	141.5 Å²	141.5	85%	0.851	80%	0.797	S	S	*	*			trans	112.3	126.9	152.4	-120.2	-91.6	0	0	0	119.8
99	E	29.6	Very low	28.1	Very low	174 Å²	174	145.4 Å²	145.4	81%	0.813	80%	0.803	S	S	*	*			trans	-95.1	166.8	-168.4	-54.3	-179	117.4	0	0	114.6
100	M	28.9	Very low	27.8	Very low	174 Å²	174	145.9 Å²	145.9	86%	0.857	81%	0.805	S	S	*	*			trans	-130.2	121.6	160.1	-110.9	-145.5	74.2	0	0	111.3
101	P	31.3	Very low	27.5	Very low	115 Å²	115	142.6 Å²	142.6	75%	0.747	80%	0.801	S	S	*	*			trans	-88.6	161.9	-174.2	34.4	-36.3	0	0	0	114.7
102	T	27.1	Very low	27.4	Very low	140 Å²	140	141.1 Å²	141.1	86%	0.859	80%	0.804	S	S	*	*			trans	-88.7	143.2	-178.1	53.9	0	0	0	0	114.5
103	A	27.3	Very low	27.4	Very low	105 Å²	105	145.5 Å²	145.5	87%	0.868	81%	0.814	S	S	*	*			trans	-156.4	161	153.9	0	0	0	0	0	112.1
104	A	29.6	Very low	27.4	Very low	94 Å²	94	146.3 Å²	146.3	78%	0.777	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-95.3	158.2	-171.1	0	0	0	0	0	114.5
105	P	31.3	Very low	27.7	Very low	119 Å²	119	147.7 Å²	147.7	77%	0.773	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-82.7	154.3	175.7	33.9	-35.7	0	0	0	113.7
106	P	29.2	Very low	27.8	Very low	127 Å²	127	146.9 Å²	146.9	83%	0.825	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-88.8	172.4	-179.3	36.6	-36.9	0	0	0	114.3
107	V	26.7	Very low	27.7	Very low	131 Å²	131	149.1 Å²	149.1	79%	0.794	81%	0.814	S	S	*	*			trans	-124.9	126.7	177.8	175.9	0	0	0	0	110.9
108	V	26.2	Very low	28.1	Very low	144 Å²	144	151.8 Å²	151.8	87%	0.873	82%	0.822	S	S	*	*			trans	-140	145.5	161.8	-174.6	0	0	0	0	109.2
109	K	25.6	Very low	28.3	Very low	192 Å²	192	151 Å²	151	84%	0.835	82%	0.821	S	S	*	*			trans	-95.5	161	-179.7	-56.9	172.3	-176.7	173.9	0	111.1
110	K	25	Very low	28.6	Very low	209 Å²	209	152 Å²	152	91%	0.909	83%	0.826	S	S	*	*			trans	-129.2	159.9	154.9	-141.8	177.5	-175.3	-177.3	0	110.3
111	S	22.7	Very low	28.6	Very low	103 Å²	103	152.7 Å²	152.7	72%	0.72	82%	0.824	S	S	*	*			trans	-100.8	161.4	-165.4	46.6	0	0	0	0	114
112	T	24	Very low	28.5	Very low	147 Å²	147	154.8 Å²	154.8	90%	0.902	82%	0.824	S	S	*	*			trans	-160.6	172.7	146.6	0.7	0	0	0	0	112.1
113	K	27	Very low	28.6	Very low	205 Å²	205	157 Å²	157	89%	0.891	82%	0.824	S	S	*	*	P	Polyproline II helix	trans	-85.6	169.1	-155	-63.2	174	173.2	178	0	116.7
114	K	26.2	Very low	28.8	Very low	157 Å²	157	155.9 Å²	155.9	68%	0.683	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-54.1	167.4	153.3	-107	178.4	171.2	-169.5	0	112.2	E116	K114-E116 HydrophobicContact CD-CG 3.8Å; K114-E116 WeakPolarHBondContact CD-OE1 3.44Å; K114-E116 VanDerWaalsContact CE-OE1 3.31Å; K114-E116 WeakPolarHBondContact CE-OE1 3.5Å; K114-E116 HydrophobicContact CG-CG 4.26Å; K114-E116 IonicContact NZ-OE1 2.77Å; K114-E116 PolarHBondContact NZ-OE1 3.25Å
115	P	32.5	Very low	28.8	Very low	120 Å²	120	160.6 Å²	160.6	78%	0.779	81%	0.807	S	S	*	*	P	Polyproline II helix	cis	-97	163.6	37.6	-1.2	23.3	0	0	0	113.7
116	E	30	Very low	28.6	Very low	143 Å²	143	161.5 Å²	161.5	67%	0.668	80%	0.801	S	S	*	*			cis	79.7	96.5	40.5	-75.3	176.3	-167.8	0	0	116	K114	K114-E116 HydrophobicContact CD-CG 3.8Å; K114-E116 WeakPolarHBondContact CD-OE1 3.44Å; K114-E116 VanDerWaalsContact CE-OE1 3.31Å; K114-E116 WeakPolarHBondContact CE-OE1 3.5Å; K114-E116 HydrophobicContact CG-CG 4.26Å; K114-E116 IonicContact NZ-OE1 2.77Å; K114-E116 PolarHBondContact NZ-OE1 3.25Å
117	E	27.6	Very low	28.6	Very low	200 Å²	200	162.1 Å²	162.1	94%	0.935	80%	0.797	S	S	*	*			trans	-155.6	154.5	147.2	-117.6	170.2	-163.7	0	0	107.5
118	E	37.7	Very low	28.7	Very low	195 Å²	195	161.3 Å²	161.3	91%	0.911	79%	0.789	S	S	*	*			trans	-103.7	128.1	-170	-60.2	-178.5	132.3	0	0	112.3
119	E	29.4	Very low	29.2	Very low	177 Å²	177	157.7 Å²	157.7	83%	0.827	77%	0.77	S	S	*	*			trans	-143.5	134.3	161	-90.8	-165.5	157.7	0	0	110.1
120	E	35.8	Very low	29.4	Very low	195 Å²	195	156 Å²	156	91%	0.911	77%	0.765	S	S	*	*			trans	-71	154.8	176.8	-60.4	-178.5	128.5	0	0	111.7
121	K	28	Very low	29.7	Very low	189 Å²	189	152.3 Å²	152.3	82%	0.822	76%	0.755	S	S	*	*			trans	-138.3	106.5	173.6	-70.3	-160.9	174.2	-164.6	0	112.5
122	E	30.3	Very low	30.1	Very low	158 Å²	158	154.7 Å²	154.7	74%	0.738	76%	0.755	S	S	*	*			trans	-63.1	158.5	158.7	-58.3	-169.6	141.7	0	0	110.9
123	E	29.8	Very low	30.6	Very low	186 Å²	186	152.4 Å²	152.4	87%	0.869	74%	0.737	S	S	*	*			trans	-92.6	113.8	178.5	-57.8	-165.9	121.1	0	0	110.5
124	E	30.4	Very low	31	Very low	83 Å²	83	147.8 Å²	147.8	39%	0.388	72%	0.722	S	S	.	*			trans	-85.3	128.8	164.8	-73.3	-159.3	135.4	0	0	110.5	R695 M699	E124-R695 WeakPolarHBondContact OE1-CD 3.4Å; E124-R695 WeakPolarHBondContact OE1-CG 3.31Å; E124-R695 WeakPolarHBondContact OE2-CD 3.31Å; E124-R695 IonicContact OE2-CZ 3.18Å; E124-R695 IonicContact OE2-NE 2.62Å; E124-R695 IonicContact OE2-NH1 3.54Å; E124-R695 PolarHBondContact OE2-NH1 3Å; E124-M699 HydrophobicContact CG-CE 3.53Å; E124-M699 HydrophobicContact CG-SD 4.25Å
125	E	29.6	Very low	31.3	Very low	193 Å²	193	151.8 Å²	151.8	90%	0.902	73%	0.733	S	S	*	*			trans	-81.6	133.7	157.8	-63.9	-166.6	142.3	0	0	109.8
126	E	27.8	Very low	31.3	Very low	137 Å²	137	153 Å²	153	64%	0.64	73%	0.729	S	S	*	*			trans	-96.2	98	174.8	-64.2	-156.8	112.6	0	0	111.1	D128 R695	E126-D128 PolarHBondContact O-N 3.22Å; E126-D128 VanDerWaalsContact O-N 3.11Å; E126-R695 IonicContact OE1-CZ 3.88Å; E126-R695 IonicContact OE1-NH1 2.74Å; E126-R695 PolarHBondContact OE1-NH1 3.28Å; E126-R695 IonicContact OE1-NH2 3.85Å; E126-R695 PolarHBondContact OE1-NH2 2.78Å
127	D	27.9	Very low	31.4	Very low	140 Å²	140	153.8 Å²	153.8	75%	0.749	73%	0.732	S	S	*	*			trans	-74.3	88.9	164.9	-175.8	25	0	0	0	109.7	S129	D127-S129 PolarHBondContact O-N 3.5Å
128	D	29.2	Very low	31.5	Very low	115 Å²	115	152.7 Å²	152.7	62%	0.615	73%	0.729	S	S	*	*			trans	-80.1	75.3	-173.8	-162.6	17.7	0	0	0	110.9	E126 E130 R185	E126-D128 PolarHBondContact O-N 3.22Å; E126-D128 VanDerWaalsContact O-N 3.11Å; D128-E130 VanDerWaalsContact C-N 3.35Å; D128-E130 PolarHBondContact O-N 2.97Å; D128-R185 IonicContact OD2-NH1 3.47Å
129	S	37.3	Very low	31.3	Very low	68 Å²	68	152.2 Å²	152.2	48%	0.476	73%	0.727	S	S	.	*			trans	-75.4	72.1	-167.9	81.4	0	0	0	0	114.6	D127 F690	D127-S129 PolarHBondContact O-N 3.5Å; S129-F690 WeakPolarHBondContact OG-CE2 3.48Å; S129-F690 WeakPolarHBondContact OG-CZ 3.48Å
130	E	29.1	Very low	31.3	Very low	157 Å²	157	152.8 Å²	152.8	73%	0.734	73%	0.73	S	S	*	*			trans	-121	138.1	166.8	-64.3	-165.2	149.3	0	0	111.6	D128	D128-E130 VanDerWaalsContact C-N 3.35Å; D128-E130 PolarHBondContact O-N 2.97Å
131	D	30.8	Very low	31.1	Very low	131 Å²	131	151.2 Å²	151.2	70%	0.701	73%	0.727	S	S	*	*			trans	59	81.1	177	-72.3	-6.7	0	0	0	119	D133	D131-D133 VanDerWaalsContact C-N 3.26Å; D131-D133 PolarHBondContact O-N 3.33Å
132	E	31.6	Very low	31.2	Very low	152 Å²	152	146.4 Å²	146.4	71%	0.71	72%	0.722	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.6	66.4	164.8	-70.4	-168.5	162.6	0	0	114	K622	E132-K622 PolarHBondContact O-NZ 3.05Å
133	D	34.9	Very low	31.4	Very low	99 Å²	99	147 Å²	147	53%	0.529	73%	0.725	S	S	.	*	T	Hydrogen-bonded Turn	trans	-157.3	26.9	165.5	-119.3	47.6	0	0	0	111.3	D131 K575 K622	D131-D133 VanDerWaalsContact C-N 3.26Å; D131-D133 PolarHBondContact O-N 3.33Å; D133-K575 VanDerWaalsContact CG-NZ 3.28Å; D133-K575 IonicContact OD1-NZ 2.64Å; D133-K575 PolarHBondContact OD1-NZ 2.78Å; D133-K575 IonicContact OD2-NZ 3.57Å; D133-K575 PolarHBondContact OD2-NZ 3.34Å; D133-K622 IonicContact OD1-NZ 2.69Å; D133-K622 PolarHBondContact OD1-NZ 2.85Å
134	D	35.3	Very low	31.7	Very low	109 Å²	109	144.4 Å²	144.4	58%	0.583	72%	0.724	S	S	*	*			trans	-123.3	40.1	-177	-160.2	28.7	0	0	0	113	K188	D134-K188 IonicContact OD1-NZ 3.74Å; D134-K188 PolarHBondContact OD1-NZ 2.89Å; D134-K188 IonicContact OD2-NZ 3.81Å; D134-K188 PolarHBondContact OD2-NZ 3.17Å
135	W	32.5	Very low	31.8	Very low	240 Å²	240	148.7 Å²	148.7	91%	0.909	75%	0.749	S	S	*	*			trans	-103.9	153.1	172	-77.2	101.9	0	0	0	111.8
136	E	31.9	Very low	31.9	Very low	147 Å²	147	142.9 Å²	142.9	69%	0.687	74%	0.741	S	S	*	*			trans	66.7	128.8	-163	-54.9	-179.1	175.1	0	0	111.2	K323	E136-K323 VanDerWaalsContact CD-NZ 3.27Å; E136-K323 IonicContact OE1-NZ 3.67Å; E136-K323 PolarHBondContact OE1-NZ 3.37Å; E136-K323 IonicContact OE2-NZ 3.02Å; E136-K323 PolarHBondContact OE2-NZ 3.32Å
137	E	33.2	Very low	32.6	Very low	158 Å²	158	143 Å²	143	74%	0.738	75%	0.753	S	S	*	*			cis	-137	136.4	20.3	-170.8	161.8	-167.2	0	0	110	S322	E137-S322 PolarHBondContact OE2-OG 3.06Å
138	M	29.9	Very low	32.6	Very low	178 Å²	178	140.9 Å²	140.9	88%	0.877	76%	0.756	S	S	*	*			trans	-84.2	135.3	177.5	-174.1	172.9	-174.5	0	0	109.1	E140	M138-E140 PolarHBondContact O-N 3.45Å
139	E	33.3	Very low	32.7	Very low	184 Å²	184	144.3 Å²	144.3	86%	0.86	77%	0.768	S	S	*	*			trans	-71.8	96.2	177.8	-166.8	162.6	-147.5	0	0	109.2	L141	E139-L141 VanDerWaalsContact C-N 3.29Å; E139-L141 PolarHBondContact O-N 3.3Å
140	E	28.4	Very low	32.7	Very low	190 Å²	190	147.9 Å²	147.9	89%	0.888	79%	0.787	S	S	*	*			trans	-69.7	81.1	-173.6	-167.1	172.8	-124.7	0	0	110.7	M138 A142	M138-E140 PolarHBondContact O-N 3.45Å; E140-A142 PolarHBondContact O-N 2.93Å
141	L	31.8	Very low	33.1	Very low	162 Å²	162	146.3 Å²	146.3	85%	0.848	79%	0.79	S	S	*	*			trans	-63.3	105.5	178.4	-120.8	168	0	0	0	109.4	E139 E143	E139-L141 VanDerWaalsContact C-N 3.29Å; E139-L141 PolarHBondContact O-N 3.3Å; L141-E143 PolarHBondContact O-N 3.35Å; L141-E143 VanDerWaalsContact O-N 3.14Å
142	A	30.6	Very low	33.2	Very low	88 Å²	88	148.4 Å²	148.4	73%	0.727	80%	0.796	S	S	*	*			trans	-60.1	113.4	-165.5	0	0	0	0	0	113.8	E140 P144	E140-A142 PolarHBondContact O-N 2.93Å; A142-P144 WeakPolarHBondContact O-CD 3.38Å
143	E	33.9	Very low	33.5	Very low	170 Å²	170	147.4 Å²	147.4	79%	0.794	80%	0.802	S	S	*	*			trans	-67.8	127.8	167.4	-65.7	-170.4	147.3	0	0	110.8	L141 L145	L141-E143 PolarHBondContact O-N 3.35Å; L141-E143 VanDerWaalsContact O-N 3.14Å; E143-L145 PolarHBondContact O-N 3.13Å; E143-L145 VanDerWaalsContact O-N 3.17Å
144	P	36	Very low	33.7	Very low	132 Å²	132	149 Å²	149	86%	0.857	82%	0.816	S	S	*	*			trans	-70.9	107.8	171.8	-19.8	34	0	0	0	111.6	A142	A142-P144 WeakPolarHBondContact O-CD 3.38Å
145	L	32.4	Very low	34.3	Very low	173 Å²	173	151.3 Å²	151.3	91%	0.906	83%	0.827	S	S	*	*			trans	-68.6	132.7	173.8	-66.5	170.4	0	0	0	112	E143	E143-L145 PolarHBondContact O-N 3.13Å; E143-L145 VanDerWaalsContact O-N 3.17Å
146	G	32.1	Very low	34.9	Very low	71 Å²	71	145.7 Å²	145.7	73%	0.732	82%	0.821	S	S	*	*			trans	156.4	113.4	164.2	0	0	0	0	0	114.5
147	P	41.6	Very low	35.8	Very low	139 Å²	139	144.5 Å²	144.5	90%	0.903	83%	0.829	S	S	*	*			trans	-86.1	141.1	180	33.5	-33.5	0	0	0	112.7
148	A	29.7	Very low	36.7	Very low	96 Å²	96	144.9 Å²	144.9	79%	0.793	83%	0.831	S	S	*	*			trans	-141.4	122.5	164.2	0	0	0	0	0	110.7
149	E	30.6	Very low	37.4	Very low	186 Å²	186	142.2 Å²	142.2	87%	0.869	83%	0.827	S	S	*	*			trans	23.4	126.9	152.3	-58.6	179.8	163.1	0	0	120.5	P151	E149-P151 WeakPolarHBondContact O-CD 3.42Å
150	T	37.2	Very low	37.9	Very low	144 Å²	144	139.3 Å²	139.3	88%	0.883	82%	0.822	S	S	*	*	P	Polyproline II helix	trans	-74.4	125.7	171.2	48.8	0	0	0	0	113.2
151	P	36.5	Very low	38.7	Very low	123 Å²	123	138.9 Å²	138.9	80%	0.799	82%	0.82	S	S	*	*	P	Polyproline II helix	trans	-97.5	166.1	161.8	-0.7	23.1	0	0	0	112.1	E149	E149-P151 WeakPolarHBondContact O-CD 3.42Å
152	E	33.1	Very low	39.7	Very low	176 Å²	176	137.5 Å²	137.5	82%	0.822	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-74.4	158.4	-176.3	-66.6	-179.2	135.2	0	0	114	V154	E152-V154 PolarHBondContact O-N 3.15Å
153	P	38.5	Very low	40.9	Very low	130 Å²	130	141.4 Å²	141.4	84%	0.844	82%	0.815	S	S	*	*			trans	-73	96.9	-176.7	29.5	-36.2	0	0	0	112.9
154	V	38.7	Very low	42.1	Very low	133 Å²	133	140 Å²	140	81%	0.806	81%	0.811	S	S	*	*			trans	-87	124.4	168.6	-177.7	0	0	0	0	110	E152 P156	E152-V154 PolarHBondContact O-N 3.15Å; V154-P156 WeakPolarHBondContact O-CD 3.39Å
155	L	48.5	Very low	43.1	Very low	158 Å²	158	136.3 Å²	136.3	83%	0.827	78%	0.783	S	S	*	*			trans	-70.4	123.6	-179.8	-66.5	170	0	0	0	111.6	S157	L155-S157 PolarHBondContact O-N 3.38Å
156	P	44.4	Very low	44.8	Very low	121 Å²	121	131.4 Å²	131.4	79%	0.786	76%	0.76	S	S	*	*			trans	-79.1	102.9	174.6	29.9	-31.9	0	0	0	110.9	V154 Q158	V154-P156 WeakPolarHBondContact O-CD 3.39Å; P156-Q158 VanDerWaalsContact C-N 3.31Å; P156-Q158 PolarHBondContact O-N 2.95Å
157	S	51.9	Low	46.5	Very low	122 Å²	122	131 Å²	131	85%	0.853	75%	0.75	S	S	*	*			trans	-82.6	69.1	178.5	61.6	0	0	0	0	112.5	L155	L155-S157 PolarHBondContact O-N 3.38Å
158	Q	50.9	Low	47.8	Very low	166 Å²	166	131.6 Å²	131.6	78%	0.776	74%	0.74	S	S	*	*	S	Bend	trans	-131.4	144.2	166.3	-74	-172.5	-23.4	0	0	110.5	P156 V160	P156-Q158 VanDerWaalsContact C-N 3.31Å; P156-Q158 PolarHBondContact O-N 2.95Å; Q158-V160 PolarHBondContact O-N 3.4Å
159	P	45.6	Very low	49.9	Very low	122 Å²	122	129.9 Å²	129.9	79%	0.792	72%	0.72	S	S	*	*			trans	-66	121.9	175.4	28	-33	0	0	0	109.4	E161	P159-E161 PolarHBondContact O-N 3.48Å; P159-E161 VanDerWaalsContact O-N 3.09Å
160	V	43.9	Very low	51.9	Low	123 Å²	123	128.1 Å²	128.1	75%	0.745	71%	0.706	S	S	*	*			trans	-71.9	104.6	172	-177.2	0	0	0	0	107.6	Q158 I162	Q158-V160 PolarHBondContact O-N 3.4Å; V160-I162 HydrophobicContact CB-CG1 4.39Å; V160-I162 HydrophobicContact CG1-CG1 3.77Å; V160-I162 PolarHBondContact O-N 2.96Å
161	E	45.8	Very low	53.7	Low	182 Å²	182	127.8 Å²	127.8	85%	0.85	69%	0.692	S	S	*	*			trans	-66.5	89.4	162.7	-69.8	-172	158	0	0	107.8	P159 E163	P159-E161 PolarHBondContact O-N 3.48Å; P159-E161 VanDerWaalsContact O-N 3.09Å; E161-E163 PolarHBondContact O-N 2.96Å
162	I	52.3	Low	55.6	Low	133 Å²	133	127.7 Å²	127.7	68%	0.682	68%	0.681	S	S	*	*			trans	-69.3	89.9	170.6	-56.8	177	0	0	0	106.2	V160 I164	V160-I162 HydrophobicContact CB-CG1 4.39Å; V160-I162 HydrophobicContact CG1-CG1 3.77Å; V160-I162 PolarHBondContact O-N 2.96Å; I162-I164 VanDerWaalsContact C-N 3.29Å; I162-I164 HydrophobicContact CG2-CG1 4.1Å; I162-I164 WeakPolarHBondContact O-CG1 3.47Å; I162-I164 PolarHBondContact O-N 2.98Å
163	E	55.2	Low	57.8	Low	169 Å²	169	124.4 Å²	124.4	79%	0.79	66%	0.664	S	S	*	*			trans	-63.9	95	169	-170.7	178.6	-140.7	0	0	107.6	E161 E165	E161-E163 PolarHBondContact O-N 2.96Å; E163-E165 PolarHBondContact O-N 3.28Å
164	I	60	Low	59.9	Low	140 Å²	140	124.4 Å²	124.4	72%	0.718	65%	0.65	S	S	*	*			trans	-69.7	87.7	178.5	-55.3	179.1	0	0	0	107.5	I162 T166	I162-I164 VanDerWaalsContact C-N 3.29Å; I162-I164 HydrophobicContact CG2-CG1 4.1Å; I162-I164 WeakPolarHBondContact O-CG1 3.47Å; I162-I164 PolarHBondContact O-N 2.98Å; I164-T166 PolarHBondContact O-N 3.02Å
165	E	56.5	Low	61.8	Low	55 Å²	55	126.5 Å²	126.5	26%	0.257	64%	0.644	S	S	.	*			trans	-51.8	106.4	168.7	-66.9	-172.2	116.4	0	0	108.9	E163 R170 K173	E163-E165 PolarHBondContact O-N 3.28Å; E165-R170 HydrophobicContact CB-CG 4.03Å; E165-R170 IonicContact OE2-CZ 3.55Å; E165-R170 VanDerWaalsContact OE2-CZ 3.26Å; E165-R170 IonicContact OE2-NE 3.73Å; E165-R170 PolarHBondContact OE2-NE 3.4Å; E165-R170 IonicContact OE2-NH2 2.94Å; E165-R170 PolarHBondContact OE2-NH2 2.98Å; E165-K173 IonicContact OE1-NZ 3.96Å; E165-K173 PolarHBondContact OE1-NZ 3.27Å
166	T	67.4	Low	63.4	Low	71 Å²	71	124.5 Å²	124.5	44%	0.436	63%	0.63	S	S	.	*			trans	-59.6	149.5	178.2	68	0	0	0	0	109.2	I164 E168 V169 R170	I164-T166 PolarHBondContact O-N 3.02Å; T166-E168 PolarHBondContact O-N 3.38Å; T166-V169 PolarHBondContact O-N 3.17Å; T166-V169 PolarHBondContact OG1-N 3.26Å; T166-R170 PolarHBondContact O-N 3.26Å
167	A	67.9	Low	65.4	Low	62 Å²	62	121.1 Å²	121.1	51%	0.512	61%	0.612	S	S	.	*	H	α-helix	trans	-56	-22.1	178.9	0	0	0	0	0	112.4	K171	A167-K171 VanDerWaalsContact O-CB 3.31Å; A167-K171 WeakPolarHBondContact O-CB 3.35Å; A167-K171 WeakPolarHBondContact O-CD 3.3Å; A167-K171 WeakPolarHBondContact O-CG 3.2Å; A167-K171 PolarHBondContact O-N 3.45Å
168	E	69.6	Low	66.9	Low	151 Å²	151	120 Å²	120	71%	0.706	59%	0.594	S	S	*	*	H	α-helix	trans	-73.2	-43.6	173.5	-58.1	-178.2	144.6	0	0	112.6	T166 R170 K171 Q172	T166-E168 PolarHBondContact O-N 3.38Å; E168-R170 VanDerWaalsContact C-N 3.35Å; E168-K171 PolarHBondContact O-N 3.31Å; E168-Q172 WeakPolarHBondContact O-CB 3.27Å; E168-Q172 PolarHBondContact O-N 3.48Å
169	V	74.5	Confident	68.5	Low	61 Å²	61	118 Å²	118	37%	0.37	58%	0.583	S	S	.	*	H	α-helix	trans	-61.7	-43	172.3	171.7	0	0	0	0	110.5	T166 Q172 K173	T166-V169 PolarHBondContact O-N 3.17Å; T166-V169 PolarHBondContact OG1-N 3.26Å; V169-Q172 PolarHBondContact O-N 3.44Å; V169-K173 HydrophobicContact CG1-CD 4.31Å; V169-K173 HydrophobicContact CG1-CG 4.49Å; V169-K173 WeakPolarHBondContact O-CG 3.35Å; V169-K173 PolarHBondContact O-N 2.98Å
170	R	71.1	Confident	70.5	Confident	149 Å²	149	116.8 Å²	116.8	56%	0.562	57%	0.566	S	S	*	*	H	α-helix	trans	-63.2	-45	174.5	-71	-172.5	172.6	159.4	6.2	112.5	E165 T166 E168 Q172 K173 K174	E165-R170 HydrophobicContact CB-CG 4.03Å; E165-R170 IonicContact OE2-CZ 3.55Å; E165-R170 VanDerWaalsContact OE2-CZ 3.26Å; E165-R170 IonicContact OE2-NE 3.73Å; E165-R170 PolarHBondContact OE2-NE 3.4Å; E165-R170 IonicContact OE2-NH2 2.94Å; E165-R170 PolarHBondContact OE2-NH2 2.98Å; T166-R170 PolarHBondContact O-N 3.26Å; E168-R170 VanDerWaalsContact C-N 3.35Å; R170-Q172 VanDerWaalsContact C-N 3.26Å; R170-Q172 PolarHBondContact O-N 3.39Å; R170-K173 PolarHBondContact O-N 2.95Å; R170-K174 WeakPolarHBondContact O-CB 3.34Å; R170-K174 PolarHBondContact O-N 2.65Å
171	K	76.1	Confident	72.6	Confident	137 Å²	137	113.7 Å²	113.7	60%	0.596	55%	0.548	S	S	*	.	H	α-helix	trans	-60.8	-34.1	173.3	-76.1	165.5	-174.4	173.4	0	112.1	A167 E168 R175	A167-K171 VanDerWaalsContact O-CB 3.31Å; A167-K171 WeakPolarHBondContact O-CB 3.35Å; A167-K171 WeakPolarHBondContact O-CD 3.3Å; A167-K171 WeakPolarHBondContact O-CG 3.2Å; A167-K171 PolarHBondContact O-N 3.45Å; E168-K171 PolarHBondContact O-N 3.31Å; K171-R175 WeakPolarHBondContact O-CB 3.32Å; K171-R175 VanDerWaalsContact O-CG 3.28Å; K171-R175 WeakPolarHBondContact O-CG 3.39Å; K171-R175 PolarHBondContact O-N 2.89Å
172	Q	75.6	Confident	74.4	Confident	121 Å²	121	111 Å²	111	57%	0.565	53%	0.531	S	S	*	.	H	α-helix	trans	-73.5	-43.8	176.3	-174.1	169.2	-33	0	0	112.3	E168 V169 R170 R175 Q176	E168-Q172 WeakPolarHBondContact O-CB 3.27Å; E168-Q172 PolarHBondContact O-N 3.48Å; V169-Q172 PolarHBondContact O-N 3.44Å; R170-Q172 VanDerWaalsContact C-N 3.26Å; R170-Q172 PolarHBondContact O-N 3.39Å; Q172-R175 PolarHBondContact O-N 3.01Å; Q172-Q176 WeakPolarHBondContact O-CG 3.14Å; Q172-Q176 PolarHBondContact O-N 3.35Å
173	K	78.8	Confident	76.1	Confident	107 Å²	107	107.9 Å²	107.9	47%	0.465	52%	0.515	S	S	.	.	H	α-helix	trans	-60	-44.8	172.6	-73.1	-178.8	179.6	-178.5	0	111.3	E165 V169 R170 Q176 A177	E165-K173 IonicContact OE1-NZ 3.96Å; E165-K173 PolarHBondContact OE1-NZ 3.27Å; V169-K173 HydrophobicContact CG1-CD 4.31Å; V169-K173 HydrophobicContact CG1-CG 4.49Å; V169-K173 WeakPolarHBondContact O-CG 3.35Å; V169-K173 PolarHBondContact O-N 2.98Å; R170-K173 PolarHBondContact O-N 2.95Å; K173-Q176 WeakPolarHBondContact O-CB 3.28Å; K173-Q176 PolarHBondContact O-N 2.88Å; K173-A177 PolarHBondContact O-N 3.37Å
174	K	82.4	Confident	77.8	Confident	129 Å²	129	106.4 Å²	106.4	56%	0.561	50%	0.502	S	S	*	.	H	α-helix	trans	-59.5	-48.3	174.6	-179.4	163.4	-179.3	166.5	0	111.8	R170 Q176 A177 E178	R170-K174 WeakPolarHBondContact O-CB 3.34Å; R170-K174 PolarHBondContact O-N 2.65Å; K174-Q176 VanDerWaalsContact C-N 3.3Å; K174-Q176 PolarHBondContact O-N 2.72Å; K174-A177 PolarHBondContact O-N 2.89Å; K174-E178 WeakPolarHBondContact CE-OE1 3.42Å; K174-E178 HydrophobicContact CG-CG 4.31Å; K174-E178 VanDerWaalsContact CG-OE1 3.3Å; K174-E178 WeakPolarHBondContact CG-OE1 3.12Å; K174-E178 WeakPolarHBondContact O-CB 3.4Å; K174-E178 VanDerWaalsContact O-CG 3.3Å; K174-E178 WeakPolarHBondContact O-CG 3.21Å; K174-E178 PolarHBondContact O-N 2.85Å
175	R	80.3	Confident	79.1	Confident	178 Å²	178	105.5 Å²	105.5	67%	0.672	49%	0.49	S	S	*	.	H	α-helix	trans	-60.1	-34.9	174.7	-77.2	172.9	175.8	178.4	-0.7	113.7	K171 Q172 F179	K171-R175 WeakPolarHBondContact O-CB 3.32Å; K171-R175 VanDerWaalsContact O-CG 3.28Å; K171-R175 WeakPolarHBondContact O-CG 3.39Å; K171-R175 PolarHBondContact O-N 2.89Å; Q172-R175 PolarHBondContact O-N 3.01Å; R175-F179 VanDerWaalsContact O-CB 3.25Å; R175-F179 WeakPolarHBondContact O-CB 3.15Å; R175-F179 PolarHBondContact O-N 2.74Å
176	Q	81.5	Confident	80.6	Confident	115 Å²	115	107.4 Å²	107.4	54%	0.537	50%	0.5	S	S	.	.	H	α-helix	trans	-67.4	-45.3	174.5	-75.6	172	-30.9	0	0	111.3	Q172 K173 K174 F179 E180	Q172-Q176 WeakPolarHBondContact O-CG 3.14Å; Q172-Q176 PolarHBondContact O-N 3.35Å; K173-Q176 WeakPolarHBondContact O-CB 3.28Å; K173-Q176 PolarHBondContact O-N 2.88Å; K174-Q176 VanDerWaalsContact C-N 3.3Å; K174-Q176 PolarHBondContact O-N 2.72Å; Q176-F179 PolarHBondContact O-N 2.68Å; Q176-E180 WeakPolarHBondContact O-CB 3.31Å; Q176-E180 PolarHBondContact O-N 3.04Å
177	A	85.3	Confident	81.6	Confident	50 Å²	50	108.8 Å²	108.8	41%	0.413	50%	0.503	S	S	.	.	H	α-helix	trans	-65	-40.7	175.9	0	0	0	0	0	112.7	K173 K174 E180 T181	K173-A177 PolarHBondContact O-N 3.37Å; K174-A177 PolarHBondContact O-N 2.89Å; A177-E180 PolarHBondContact O-N 3.35Å; A177-T181 WeakPolarHBondContact O-CB 3.21Å; A177-T181 PolarHBondContact O-N 3.22Å; A177-T181 PolarHBondContact O-OG1 3.11Å
178	E	85.1	Confident	82.6	Confident	98 Å²	98	111.6 Å²	111.6	46%	0.458	50%	0.503	S	S	.	.	H	α-helix	trans	-59	-46.3	172.5	-74.2	166.2	177.8	0	0	111.3	K174 T181 Y182	K174-E178 WeakPolarHBondContact CE-OE1 3.42Å; K174-E178 HydrophobicContact CG-CG 4.31Å; K174-E178 VanDerWaalsContact CG-OE1 3.3Å; K174-E178 WeakPolarHBondContact CG-OE1 3.12Å; K174-E178 WeakPolarHBondContact O-CB 3.4Å; K174-E178 VanDerWaalsContact O-CG 3.3Å; K174-E178 WeakPolarHBondContact O-CG 3.21Å; K174-E178 PolarHBondContact O-N 2.85Å; E178-T181 PolarHBondContact O-N 2.82Å; E178-Y182 WeakPolarHBondContact O-CB 3.17Å; E178-Y182 PolarHBondContact O-N 3Å
179	F	83.3	Confident	83.6	Confident	125 Å²	125	111.9 Å²	111.9	55%	0.548	50%	0.498	S	S	.	.	H	α-helix	trans	-68.4	-42	178.7	-178.3	-109.8	0	0	0	112.7	R175 Q176 T181 Y182 L183	R175-F179 VanDerWaalsContact O-CB 3.25Å; R175-F179 WeakPolarHBondContact O-CB 3.15Å; R175-F179 PolarHBondContact O-N 2.74Å; Q176-F179 PolarHBondContact O-N 2.68Å; F179-T181 VanDerWaalsContact C-N 3.33Å; F179-T181 PolarHBondContact O-N 2.62Å; F179-Y182 HydrophobicContact CD2-CD1 4.49Å; F179-Y182 WeakPolarHBondContact O-CB 3.3Å; F179-Y182 PolarHBondContact O-N 2.92Å; F179-L183 HydrophobicContact CD1-CD1 4.07Å; F179-L183 HydrophobicContact CE1-CD1 3.57Å; F179-L183 HydrophobicContact CE1-CG 4.17Å; F179-L183 HydrophobicContact CE2-CG 4.5Å; F179-L183 HydrophobicContact CZ-CD1 3.94Å; F179-L183 HydrophobicContact CZ-CD2 4.27Å; F179-L183 HydrophobicContact CZ-CG 4.16Å; F179-L183 WeakPolarHBondContact O-CG 3.4Å; F179-L183 PolarHBondContact O-N 2.89Å
180	E	87.5	Confident	84.4	Confident	96 Å²	96	115.1 Å²	115.1	45%	0.449	51%	0.507	S	S	.	.	H	α-helix	trans	-65.1	-38.5	175.5	-159.5	-164.7	-179.7	0	0	111.2	Q176 A177 L183 R184	Q176-E180 WeakPolarHBondContact O-CB 3.31Å; Q176-E180 PolarHBondContact O-N 3.04Å; A177-E180 PolarHBondContact O-N 3.35Å; E180-L183 PolarHBondContact O-N 3.1Å; E180-R184 VanDerWaalsContact CD-CZ 3.43Å; E180-R184 PolarHBondContact O-N 3.16Å; E180-R184 IonicContact OE1-CZ 2.68Å; E180-R184 IonicContact OE1-NH1 3.67Å; E180-R184 PolarHBondContact OE1-NH1 2.94Å; E180-R184 IonicContact OE1-NH2 3.01Å; E180-R184 PolarHBondContact OE1-NH2 3.38Å; E180-R184 IonicContact OE2-CZ 3.85Å; E180-R184 IonicContact OE2-NH1 3.13Å; E180-R184 IonicContact OE2-NH2 2.68Å; E180-R184 PolarHBondContact OE2-NH2 2.96Å
181	T	88.2	Confident	85.3	Confident	58 Å²	58	114 Å²	114	36%	0.356	51%	0.507	S	S	.	.	H	α-helix	trans	-69.4	-34.7	174.5	-57.4	0	0	0	0	111.9	A177 E178 F179 R185	A177-T181 WeakPolarHBondContact O-CB 3.21Å; A177-T181 PolarHBondContact O-N 3.22Å; A177-T181 PolarHBondContact O-OG1 3.11Å; E178-T181 PolarHBondContact O-N 2.82Å; F179-T181 VanDerWaalsContact C-N 3.33Å; F179-T181 PolarHBondContact O-N 2.62Å; T181-R185 WeakPolarHBondContact O-CB 3.5Å; T181-R185 WeakPolarHBondContact O-CG 3.17Å; T181-R185 PolarHBondContact O-N 2.88Å
182	Y	84.9	Confident	86	Confident	125 Å²	125	113.1 Å²	113.1	49%	0.49	50%	0.503	S	S	.	.	H	α-helix	trans	-62.8	-45	168.3	169.8	-92.1	0	0	0	111.5	E178 F179 R185 M186	E178-Y182 WeakPolarHBondContact O-CB 3.17Å; E178-Y182 PolarHBondContact O-N 3Å; F179-Y182 HydrophobicContact CD2-CD1 4.49Å; F179-Y182 WeakPolarHBondContact O-CB 3.3Å; F179-Y182 PolarHBondContact O-N 2.92Å; Y182-R185 PolarHBondContact O-N 3.13Å; Y182-M186 HydrophobicContact CE1-SD 4.17Å; Y182-M186 VanDerWaalsContact O-CB 3.32Å; Y182-M186 WeakPolarHBondContact O-CB 3.44Å; Y182-M186 PolarHBondContact O-N 3.03Å
183	L	87.7	Confident	86.8	Confident	68 Å²	68	111.5 Å²	111.5	36%	0.356	50%	0.498	S	S	.	.	H	α-helix	trans	-63.7	-41.5	175.3	-70.7	179	0	0	0	112.1	F179 E180 M186 M187	F179-L183 HydrophobicContact CD1-CD1 4.07Å; F179-L183 HydrophobicContact CE1-CD1 3.57Å; F179-L183 HydrophobicContact CE1-CG 4.17Å; F179-L183 HydrophobicContact CE2-CG 4.5Å; F179-L183 HydrophobicContact CZ-CD1 3.94Å; F179-L183 HydrophobicContact CZ-CD2 4.27Å; F179-L183 HydrophobicContact CZ-CG 4.16Å; F179-L183 WeakPolarHBondContact O-CG 3.4Å; F179-L183 PolarHBondContact O-N 2.89Å; E180-L183 PolarHBondContact O-N 3.1Å; L183-M186 HydrophobicContact CD2-CE 3.72Å; L183-M186 PolarHBondContact O-N 3.22Å; L183-M187 VanDerWaalsContact O-CB 3.32Å; L183-M187 WeakPolarHBondContact O-CB 3.45Å; L183-M187 PolarHBondContact O-N 2.94Å
184	R	89.8	Confident	87.5	Confident	139 Å²	139	110.8 Å²	110.8	53%	0.525	50%	0.499	S	S	.	.	H	α-helix	trans	-60.2	-47.4	172.6	-79.7	-166.4	-93.9	-86.4	-1.3	111.6	E180 M187 K188	E180-R184 VanDerWaalsContact CD-CZ 3.43Å; E180-R184 PolarHBondContact O-N 3.16Å; E180-R184 IonicContact OE1-CZ 2.68Å; E180-R184 IonicContact OE1-NH1 3.67Å; E180-R184 PolarHBondContact OE1-NH1 2.94Å; E180-R184 IonicContact OE1-NH2 3.01Å; E180-R184 PolarHBondContact OE1-NH2 3.38Å; E180-R184 IonicContact OE2-CZ 3.85Å; E180-R184 IonicContact OE2-NH1 3.13Å; E180-R184 IonicContact OE2-NH2 2.68Å; E180-R184 PolarHBondContact OE2-NH2 2.96Å; R184-M187 PolarHBondContact O-N 2.83Å; R184-K188 PolarHBondContact O-N 3.36Å
185	R	88.5	Confident	88	Confident	120 Å²	120	108.6 Å²	108.6	45%	0.453	49%	0.493	S	S	.	.	H	α-helix	trans	-60.7	-44.4	175.1	-76.4	-174.5	-73.3	177.9	-5.8	112.2	D128 T181 Y182 M187 K188 R189	D128-R185 IonicContact OD2-NH1 3.47Å; T181-R185 WeakPolarHBondContact O-CB 3.5Å; T181-R185 WeakPolarHBondContact O-CG 3.17Å; T181-R185 PolarHBondContact O-N 2.88Å; Y182-R185 PolarHBondContact O-N 3.13Å; R185-M187 PolarHBondContact O-N 3.4Å; R185-K188 PolarHBondContact O-N 2.96Å; R185-R189 WeakPolarHBondContact O-CG 3.47Å; R185-R189 PolarHBondContact O-N 2.91Å
186	M	86.9	Confident	88.6	Confident	95 Å²	95	102.1 Å²	102.1	47%	0.468	47%	0.471	S	S	.	.	H	α-helix	trans	-62.7	-41.4	177	-172	-179.8	73.6	0	0	111.9	Y182 L183 R189 F190	Y182-M186 HydrophobicContact CE1-SD 4.17Å; Y182-M186 VanDerWaalsContact O-CB 3.32Å; Y182-M186 WeakPolarHBondContact O-CB 3.44Å; Y182-M186 PolarHBondContact O-N 3.03Å; L183-M186 HydrophobicContact CD2-CE 3.72Å; L183-M186 PolarHBondContact O-N 3.22Å; M186-R189 PolarHBondContact O-N 3.44Å; M186-F190 WeakPolarHBondContact O-CB 3.28Å; M186-F190 PolarHBondContact O-N 2.89Å
187	M	88.8	Confident	89.3	Confident	101 Å²	101	101.1 Å²	101.1	50%	0.498	47%	0.469	S	S	.	.	H	α-helix	trans	-69.8	-37.7	175.9	-175.1	64.4	74.6	0	0	112.3	L183 R184 R185 K191	L183-M187 VanDerWaalsContact O-CB 3.32Å; L183-M187 WeakPolarHBondContact O-CB 3.45Å; L183-M187 PolarHBondContact O-N 2.94Å; R184-M187 PolarHBondContact O-N 2.83Å; R185-M187 PolarHBondContact O-N 3.4Å; M187-K191 HydrophobicContact CG-CD 4.36Å; M187-K191 WeakPolarHBondContact O-CB 3.36Å; M187-K191 VanDerWaalsContact O-CG 3.31Å; M187-K191 WeakPolarHBondContact O-CG 3.26Å; M187-K191 PolarHBondContact O-N 3.1Å; M187-K191 HydrophobicContact SD-CG 4.47Å
188	K	89.6	Confident	89.8	Confident	120 Å²	120	101.9 Å²	101.9	52%	0.522	47%	0.469	S	S	.	.	H	α-helix	trans	-62.7	-44.2	172.8	-170.8	179	-178.9	-176.9	0	110.8	D134 R184 R185 K191 K192	D134-K188 IonicContact OD1-NZ 3.74Å; D134-K188 PolarHBondContact OD1-NZ 2.89Å; D134-K188 IonicContact OD2-NZ 3.81Å; D134-K188 PolarHBondContact OD2-NZ 3.17Å; R184-K188 PolarHBondContact O-N 3.36Å; R185-K188 PolarHBondContact O-N 2.96Å; K188-K191 PolarHBondContact O-N 2.83Å; K188-K192 WeakPolarHBondContact O-CB 3.45Å; K188-K192 PolarHBondContact O-N 3.31Å
189	R	89.4	Confident	90.3	Very high	158 Å²	158	97.5 Å²	97.5	60%	0.596	45%	0.448	S	S	*	.	H	α-helix	trans	-59.5	-55.3	174.2	-72.2	174.7	178.9	-175.2	-2.6	111.2	R185 M186 K191 K192 D193	R185-R189 WeakPolarHBondContact O-CG 3.47Å; R185-R189 PolarHBondContact O-N 2.91Å; M186-R189 PolarHBondContact O-N 3.44Å; R189-K191 VanDerWaalsContact C-N 3.3Å; R189-K191 PolarHBondContact O-N 2.95Å; R189-K192 WeakPolarHBondContact O-CA 3.33Å; R189-K192 WeakPolarHBondContact O-CB 3.19Å; R189-K192 PolarHBondContact O-N 3.43Å; R189-D193 PolarHBondContact O-N 2.91Å
190	F	91.6	Very high	90.9	Very high	129 Å²	129	93.2 Å²	93.2	57%	0.566	43%	0.43	S	S	*	.	H	α-helix	trans	-56.2	-39.8	178.2	-179.3	-100.9	0	0	0	113.6	M186 L194	M186-F190 WeakPolarHBondContact O-CB 3.28Å; M186-F190 PolarHBondContact O-N 2.89Å; F190-L194 VanDerWaalsContact O-CB 3.3Å; F190-L194 WeakPolarHBondContact O-CB 3.44Å; F190-L194 PolarHBondContact O-N 2.87Å
191	K	90.8	Very high	91.4	Very high	126 Å²	126	93 Å²	93	55%	0.548	43%	0.434	S	S	.	.	H	α-helix	trans	-66.8	-40.8	174.4	-74.4	177.7	177.1	-174.8	0	112.8	M187 K188 R189 L195	M187-K191 HydrophobicContact CG-CD 4.36Å; M187-K191 WeakPolarHBondContact O-CB 3.36Å; M187-K191 VanDerWaalsContact O-CG 3.31Å; M187-K191 WeakPolarHBondContact O-CG 3.26Å; M187-K191 PolarHBondContact O-N 3.1Å; M187-K191 HydrophobicContact SD-CG 4.47Å; K188-K191 PolarHBondContact O-N 2.83Å; R189-K191 VanDerWaalsContact C-N 3.3Å; R189-K191 PolarHBondContact O-N 2.95Å; K191-L195 VanDerWaalsContact O-CG 3.31Å; K191-L195 WeakPolarHBondContact O-CG 3.45Å; K191-L195 PolarHBondContact O-N 3.48Å; K191-L195 VanDerWaalsContact O-N 3.07Å
192	K	90.8	Very high	91.8	Very high	118 Å²	118	93.4 Å²	93.4	51%	0.513	43%	0.432	S	S	.	.	H	α-helix	trans	-60.4	-47.2	174.5	177.4	-177.7	176.4	-179.5	0	110.5	K188 R189 L195 I196	K188-K192 WeakPolarHBondContact O-CB 3.45Å; K188-K192 PolarHBondContact O-N 3.31Å; R189-K192 WeakPolarHBondContact O-CA 3.33Å; R189-K192 WeakPolarHBondContact O-CB 3.19Å; R189-K192 PolarHBondContact O-N 3.43Å; K192-L195 PolarHBondContact O-N 2.9Å; K192-I196 HydrophobicContact CG-CD1 4.06Å; K192-I196 WeakPolarHBondContact O-CG1 3.47Å; K192-I196 PolarHBondContact O-N 2.61Å; K192-I196 VanDerWaalsContact O-N 3.08Å
193	D	91.4	Very high	92.4	Very high	86 Å²	86	87.5 Å²	87.5	46%	0.46	41%	0.409	S	S	.	.	H	α-helix	trans	-64.1	-46.2	-179.7	-56	-25.4	0	0	0	111.1	R189 L195 I196 D197	R189-D193 PolarHBondContact O-N 2.91Å; D193-L195 VanDerWaalsContact C-N 3.31Å; D193-L195 PolarHBondContact O-N 2.89Å; D193-I196 PolarHBondContact O-N 3Å; D193-D197 PolarHBondContact O-N 2.78Å
194	L	93.8	Very high	92.8	Very high	93 Å²	93	87.7 Å²	87.7	49%	0.487	41%	0.41	S	S	.	.	H	α-helix	trans	-60.1	-37.3	176.3	178.9	62.6	0	0	0	113	F190 T198	F190-L194 VanDerWaalsContact O-CB 3.3Å; F190-L194 WeakPolarHBondContact O-CB 3.44Å; F190-L194 PolarHBondContact O-N 2.87Å; L194-T198 VanDerWaalsContact O-CB 3.31Å; L194-T198 WeakPolarHBondContact O-CB 3.32Å; L194-T198 PolarHBondContact O-N 2.98Å; L194-T198 PolarHBondContact O-OG1 3.08Å
195	L	93.1	Very high	93.2	Very high	83 Å²	83	84.7 Å²	84.7	44%	0.435	41%	0.41	S	S	.	.	H	α-helix	trans	-68.8	-40	175.9	-75.7	169.9	0	0	0	111.9	K191 K192 D193 T198 H199 F317	K191-L195 VanDerWaalsContact O-CG 3.31Å; K191-L195 WeakPolarHBondContact O-CG 3.45Å; K191-L195 PolarHBondContact O-N 3.48Å; K191-L195 VanDerWaalsContact O-N 3.07Å; K192-L195 PolarHBondContact O-N 2.9Å; D193-L195 VanDerWaalsContact C-N 3.31Å; D193-L195 PolarHBondContact O-N 2.89Å; L195-T198 PolarHBondContact O-N 2.88Å; L195-H199 WeakPolarHBondContact O-CB 3.36Å; L195-H199 PolarHBondContact O-N 2.84Å; L195-F317 HydrophobicContact CB-CB 4.05Å; L195-F317 WeakPolarHBondContact O-CB 3.28Å
196	I	93.9	Very high	93.6	Very high	41 Å²	41	80.9 Å²	80.9	21%	0.21	40%	0.398	C	S	.	.	H	α-helix	trans	-64.3	-46.3	175.4	-68.9	164.3	0	0	0	110.3	K192 D193 H199 K200 F317	K192-I196 HydrophobicContact CG-CD1 4.06Å; K192-I196 WeakPolarHBondContact O-CG1 3.47Å; K192-I196 PolarHBondContact O-N 2.61Å; K192-I196 VanDerWaalsContact O-N 3.08Å; D193-I196 PolarHBondContact O-N 3Å; I196-H199 WeakPolarHBondContact O-CB 3.26Å; I196-H199 PolarHBondContact O-N 2.99Å; I196-K200 HydrophobicContact CG2-CD 4.26Å; I196-K200 WeakPolarHBondContact O-CG 3.3Å; I196-K200 PolarHBondContact O-N 3.3Å; I196-F317 HydrophobicContact CD1-CD2 4.41Å; I196-F317 HydrophobicContact CG1-CB 4.21Å; I196-F317 HydrophobicContact CG1-CD2 3.59Å; I196-F317 HydrophobicContact CG1-CE2 4.15Å; I196-F317 HydrophobicContact CG1-CG 4.01Å
197	D	95.1	Very high	94	Very high	95 Å²	95	76.6 Å²	76.6	51%	0.508	38%	0.377	S	S	.	.	H	α-helix	trans	-66.7	-38.3	178.1	-78.3	-12.9	0	0	0	112	D193 H199 K200 V201	D193-D197 PolarHBondContact O-N 2.78Å; D197-H199 VanDerWaalsContact C-N 3.33Å; D197-H199 PolarHBondContact O-N 2.78Å; D197-K200 PolarHBondContact O-N 2.93Å; D197-V201 WeakPolarHBondContact O-CB 3.35Å; D197-V201 WeakPolarHBondContact O-CG2 3.27Å; D197-V201 PolarHBondContact O-N 2.78Å
198	T	95.8	Very high	94.4	Very high	65 Å²	65	74.4 Å²	74.4	40%	0.399	38%	0.375	S	S	.	.	H	α-helix	trans	-60.2	-42.5	172.7	-59.1	0	0	0	0	111.6	L194 L195 H202	L194-T198 VanDerWaalsContact O-CB 3.31Å; L194-T198 WeakPolarHBondContact O-CB 3.32Å; L194-T198 PolarHBondContact O-N 2.98Å; L194-T198 PolarHBondContact O-OG1 3.08Å; L195-T198 PolarHBondContact O-N 2.88Å; T198-H202 PolarHBondContact O-N 3.41Å
199	H	95.4	Very high	94.6	Very high	6 Å²	6	71.5 Å²	71.5	3%	0.028	37%	0.365	C	S	.	.	H	α-helix	trans	-64.8	-44.9	175.5	178.8	106.4	0	0	0	112.1	L195 I196 D197 H202 L203 P314 V315 F317 Y548 V578	L195-H199 WeakPolarHBondContact O-CB 3.36Å; L195-H199 PolarHBondContact O-N 2.84Å; I196-H199 WeakPolarHBondContact O-CB 3.26Å; I196-H199 PolarHBondContact O-N 2.99Å; D197-H199 VanDerWaalsContact C-N 3.33Å; D197-H199 PolarHBondContact O-N 2.78Å; H199-H202 PolarHBondContact O-N 3.21Å; H199-L203 WeakPolarHBondContact O-CB 3.47Å; H199-L203 PolarHBondContact O-N 3.26Å; H199-P314 WeakPolarHBondContact CE1-CG 3.46Å; H199-V315 WeakPolarHBondContact CB-O 3.3Å; H199-V315 PolarHBondContact ND1-O 3.36Å; H199-F317 HydrophobicContact CB-CB 4.03Å; H199-F317 HydrophobicContact CB-CD1 4.05Å; H199-F317 HydrophobicContact CB-CG 4.49Å; H199-F317 AromaticContact CD2-CD1 3.95Å; H199-F317 AromaticContact CE1-CD1 3.76Å; H199-F317 AromaticContact CG-CD1 3.67Å; H199-F317 AromaticContact ND1-CD1 3.59Å; H199-Y548 AromaticContact CE1-CE2 3.94Å; H199-Y548 AromaticContact NE2-CE2 3.46Å; H199-Y548 WeakPolarHBondContact NE2-CE2 3.34Å; H199-Y548 AromaticContact NE2-CZ 3.53Å; H199-Y548 PolarHBondContact NE2-OH 3.48Å; H199-V578 VanDerWaalsContact CD2-CG1 3.41Å; H199-V578 WeakPolarHBondContact CD2-CG1 3.49Å
200	K	96.4	Very high	94.9	Very high	36 Å²	36	64 Å²	64	16%	0.157	34%	0.336	C	S	.	.	H	α-helix	trans	-58.5	-47.2	175.8	-75	178.9	172.2	-165.4	0	111.8	I196 D197 L203 L204 V578 W582	I196-K200 HydrophobicContact CG2-CD 4.26Å; I196-K200 WeakPolarHBondContact O-CG 3.3Å; I196-K200 PolarHBondContact O-N 3.3Å; D197-K200 PolarHBondContact O-N 2.93Å; K200-L203 PolarHBondContact O-N 2.84Å; K200-L204 WeakPolarHBondContact O-CG 3.43Å; K200-L204 PolarHBondContact O-N 2.82Å; K200-V578 HydrophobicContact CG-CG1 3.89Å; K200-W582 HydrophobicContact CB-CH2 3.7Å; K200-W582 HydrophobicContact CB-CZ2 3.8Å; K200-W582 HydrophobicContact CB-CZ3 4.35Å; K200-W582 HydrophobicContact CD-CD2 3.89Å; K200-W582 HydrophobicContact CD-CE3 4.25Å; K200-W582 HydrophobicContact CD-CG 4.47Å; K200-W582 HydrophobicContact CD-CH2 4.16Å; K200-W582 HydrophobicContact CD-CZ2 3.78Å; K200-W582 HydrophobicContact CD-CZ3 4.37Å; K200-W582 HydrophobicContact CG-CD2 4.26Å; K200-W582 HydrophobicContact CG-CE3 4.13Å; K200-W582 HydrophobicContact CG-CH2 3.66Å; K200-W582 HydrophobicContact CG-CZ2 3.79Å; K200-W582 HydrophobicContact CG-CZ3 3.84Å; K200-W582 VanDerWaalsContact NZ-CD1 3.34Å; K200-W582 VanDerWaalsContact NZ-CG 3.27Å
201	V	97.2	Very high	95.1	Very high	90 Å²	90	59.3 Å²	59.3	55%	0.545	32%	0.317	S	S	.	.	H	α-helix	trans	-63.4	-43.8	177.6	171.4	0	0	0	0	111.2	D197 L203 L204 C205	D197-V201 WeakPolarHBondContact O-CB 3.35Å; D197-V201 WeakPolarHBondContact O-CG2 3.27Å; D197-V201 PolarHBondContact O-N 2.78Å; V201-L203 PolarHBondContact O-N 2.88Å; V201-L204 PolarHBondContact O-N 3.09Å; V201-C205 PolarHBondContact O-N 3.02Å; V201-C205 PolarHBondContact O-SG 2.91Å; V201-C205 VanDerWaalsContact O-SG 3.33Å
202	H	97.1	Very high	95.3	Very high	68 Å²	68	57.9 Å²	57.9	32%	0.315	31%	0.311	S	S	.	.	H	α-helix	trans	-64.4	-40.9	176.6	-169	-160.4	0	0	0	111.8	T198 H199 L204 C205 L206 P314 V315	T198-H202 PolarHBondContact O-N 3.41Å; H199-H202 PolarHBondContact O-N 3.21Å; H202-L204 PolarHBondContact O-N 3.34Å; H202-C205 PolarHBondContact O-N 2.79Å; H202-L206 WeakPolarHBondContact O-CG 3.25Å; H202-L206 PolarHBondContact O-N 3.42Å; H202-P314 HydrophobicContact CB-CB 4.28Å; H202-P314 WeakPolarHBondContact ND1-CA 3.24Å; H202-V315 HydrophobicContact CB-CG2 4.36Å; H202-V315 WeakPolarHBondContact ND1-CG2 3.42Å; H202-V315 PolarHBondContact ND1-N 2.83Å
203	L	96.6	Very high	95.4	Very high	0 Å²	0	54.8 Å²	54.8	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-61.1	-42.1	176.7	-178.1	57.5	0	0	0	112.2	H199 K200 V201 L206 L207 L312 P314 Y548 W582 W583	H199-L203 WeakPolarHBondContact O-CB 3.47Å; H199-L203 PolarHBondContact O-N 3.26Å; K200-L203 PolarHBondContact O-N 2.84Å; V201-L203 PolarHBondContact O-N 2.88Å; L203-L206 PolarHBondContact O-N 3.45Å; L203-L207 WeakPolarHBondContact O-CB 3.49Å; L203-L207 PolarHBondContact O-N 2.87Å; L203-L312 HydrophobicContact CD1-CB 4.08Å; L203-L312 HydrophobicContact CD1-CD1 3.84Å; L203-P314 HydrophobicContact CB-CB 3.91Å; L203-P314 HydrophobicContact CB-CG 4.15Å; L203-P314 HydrophobicContact CD1-CG 4.11Å; L203-Y548 HydrophobicContact CD1-CD1 4.25Å; L203-Y548 HydrophobicContact CD1-CD2 3.89Å; L203-Y548 HydrophobicContact CD1-CE2 4.27Å; L203-Y548 HydrophobicContact CD1-CG 3.87Å; L203-Y548 HydrophobicContact CD2-CD1 3.94Å; L203-Y548 HydrophobicContact CD2-CD2 4.31Å; L203-Y548 HydrophobicContact CD2-CE1 3.56Å; L203-Y548 HydrophobicContact CD2-CE2 3.96Å; L203-Y548 HydrophobicContact CD2-CG 4.29Å; L203-W582 HydrophobicContact CD2-CZ3 4.41Å; L203-W583 HydrophobicContact CD1-CH2 4.15Å; L203-W583 HydrophobicContact CD1-CZ3 4.27Å; L203-W583 HydrophobicContact CD2-CE3 3.86Å; L203-W583 HydrophobicContact CD2-CH2 4.08Å; L203-W583 HydrophobicContact CD2-CZ3 3.47Å; L203-W583 VanDerWaalsContact CD2-CZ3 3.47Å; L203-W583 HydrophobicContact CG-CH2 4.14Å; L203-W583 HydrophobicContact CG-CZ3 3.74Å
204	L	97	Very high	95.6	Very high	73 Å²	73	50.7 Å²	50.7	38%	0.382	27%	0.274	S	S	.	.	H	α-helix	trans	-62.8	-41.8	173.7	-71.4	170.4	0	0	0	112.3	K200 V201 H202 L207 A208 W582 T586	K200-L204 WeakPolarHBondContact O-CG 3.43Å; K200-L204 PolarHBondContact O-N 2.82Å; V201-L204 PolarHBondContact O-N 3.09Å; H202-L204 PolarHBondContact O-N 3.34Å; L204-L207 PolarHBondContact O-N 2.86Å; L204-A208 WeakPolarHBondContact O-CB 3.3Å; L204-A208 PolarHBondContact O-N 3.31Å; L204-W582 HydrophobicContact CD1-CH2 4.43Å; L204-W582 HydrophobicContact CD1-CZ2 4.24Å; L204-W582 HydrophobicContact CD2-CH2 4.43Å; L204-W582 HydrophobicContact CG-CH2 4.22Å; L204-T586 HydrophobicContact CD2-CG2 3.58Å
205	C	97.6	Very high	95.7	Very high	76 Å²	76	53.4 Å²	53.4	51%	0.514	28%	0.278	S	S	.	.	H	α-helix	trans	-64	-42.6	175.7	-69.8	0	0	0	0	112.3	V201 H202 A208 N209	V201-C205 PolarHBondContact O-N 3.02Å; V201-C205 PolarHBondContact O-SG 2.91Å; V201-C205 VanDerWaalsContact O-SG 3.33Å; H202-C205 PolarHBondContact O-N 2.79Å; C205-A208 PolarHBondContact O-N 2.88Å; C205-N209 WeakPolarHBondContact O-CB 3.03Å; C205-N209 PolarHBondContact O-N 3.19Å
206	L	96.5	Very high	95.7	Very high	39 Å²	39	50.2 Å²	50.2	20%	0.204	26%	0.261	C	S	.	.	H	α-helix	trans	-62.8	-43.2	175.7	-70.9	170.1	0	0	0	111.4	H202 L203 N209 G210 L312 P314	H202-L206 WeakPolarHBondContact O-CG 3.25Å; H202-L206 PolarHBondContact O-N 3.42Å; L203-L206 PolarHBondContact O-N 3.45Å; L206-N209 PolarHBondContact O-N 3.4Å; L206-G210 PolarHBondContact O-N 3.22Å; L206-L312 HydrophobicContact CB-CB 4.4Å; L206-L312 HydrophobicContact CB-CD2 4.27Å; L206-L312 HydrophobicContact CD1-CB 4.3Å; L206-P314 HydrophobicContact CD1-CB 4.33Å
207	L	96.5	Very high	95.8	Very high	6 Å²	6	48.2 Å²	48.2	3%	0.031	25%	0.251	C	S	.	.	H	α-helix	trans	-63.4	-46.7	177.1	-171.7	64.8	0	0	0	111.8	L203 L204 N209 G210 M211 L312 V550 L558 W583 L587	L203-L207 WeakPolarHBondContact O-CB 3.49Å; L203-L207 PolarHBondContact O-N 2.87Å; L204-L207 PolarHBondContact O-N 2.86Å; L207-N209 PolarHBondContact O-N 2.92Å; L207-G210 WeakPolarHBondContact O-CA 3.49Å; L207-G210 PolarHBondContact O-N 3.4Å; L207-G210 VanDerWaalsContact O-N 3.12Å; L207-M211 WeakPolarHBondContact O-CG 3.48Å; L207-M211 PolarHBondContact O-N 2.93Å; L207-L312 HydrophobicContact CB-CD1 4.42Å; L207-L312 HydrophobicContact CD1-CD1 4.21Å; L207-V550 HydrophobicContact CD1-CB 4.35Å; L207-V550 HydrophobicContact CD1-CG1 3.89Å; L207-V550 HydrophobicContact CD1-CG2 4.44Å; L207-L558 HydrophobicContact CD1-CD1 3.87Å; L207-L558 HydrophobicContact CD1-CD2 4.08Å; L207-L558 HydrophobicContact CD2-CD1 3.86Å; L207-L558 HydrophobicContact CG-CD1 4.05Å; L207-W583 HydrophobicContact CD2-CH2 4.41Å; L207-L587 HydrophobicContact CD2-CD2 4.09Å
208	A	96.3	Very high	95.8	Very high	55 Å²	55	45.6 Å²	45.6	46%	0.455	24%	0.24	S	C	.	.	H	α-helix	trans	-63.6	-38.5	177.4	0	0	0	0	0	112.6	L204 C205 M211 F212	L204-A208 WeakPolarHBondContact O-CB 3.3Å; L204-A208 PolarHBondContact O-N 3.31Å; C205-A208 PolarHBondContact O-N 2.88Å; A208-M211 PolarHBondContact O-N 3.14Å; A208-F212 WeakPolarHBondContact O-CB 3.44Å; A208-F212 PolarHBondContact O-N 3.33Å
209	N	94.6	Very high	95.7	Very high	58 Å²	58	46.5 Å²	46.5	31%	0.31	24%	0.24	S	C	.	.	H	α-helix	trans	-61.4	-43	170.5	162.4	72.6	0	0	0	111.4	C205 L206 L207 F212 R213	C205-N209 WeakPolarHBondContact O-CB 3.03Å; C205-N209 PolarHBondContact O-N 3.19Å; L206-N209 PolarHBondContact O-N 3.4Å; L207-N209 PolarHBondContact O-N 2.92Å; N209-F212 WeakPolarHBondContact O-CB 3.25Å; N209-F212 PolarHBondContact O-N 2.98Å; N209-R213 PolarHBondContact ND2-NE 2.81Å; N209-R213 VanDerWaalsContact ND2-NE 3.18Å; N209-R213 WeakPolarHBondContact O-CG 3.31Å; N209-R213 PolarHBondContact O-N 3.19Å; N209-R213 PolarHBondContact OD1-NE 3.07Å
210	G	95.1	Very high	95.7	Very high	0 Å²	0	50.2 Å²	50.2	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-58.4	-48.5	173.2	0	0	0	0	0	113.3	L206 L207 F212 R213 N214	L206-G210 PolarHBondContact O-N 3.22Å; L207-G210 WeakPolarHBondContact O-CA 3.49Å; L207-G210 PolarHBondContact O-N 3.4Å; L207-G210 VanDerWaalsContact O-N 3.12Å; G210-F212 VanDerWaalsContact C-N 3.26Å; G210-F212 PolarHBondContact O-N 3.13Å; G210-R213 PolarHBondContact O-N 2.71Å; G210-N214 VanDerWaalsContact O-CB 3.27Å; G210-N214 WeakPolarHBondContact O-CB 3.46Å; G210-N214 PolarHBondContact O-N 3.21Å
211	M	95.9	Very high	95.6	Very high	32 Å²	32	53.5 Å²	53.5	16%	0.158	28%	0.284	C	S	.	.	H	α-helix	trans	-65.3	-26.8	175.9	-65.1	177.4	81.2	0	0	113.5	L207 A208 R215 V552 L558 F590	L207-M211 WeakPolarHBondContact O-CG 3.48Å; L207-M211 PolarHBondContact O-N 2.93Å; A208-M211 PolarHBondContact O-N 3.14Å; M211-R215 WeakPolarHBondContact O-CG 3.43Å; M211-R215 PolarHBondContact O-N 3.06Å; M211-R215 PolarHBondContact O-NE 3.03Å; M211-V552 HydrophobicContact CG-CG1 4.39Å; M211-L558 HydrophobicContact CE-CD1 4.48Å; M211-L558 HydrophobicContact CG-CD2 4Å; M211-L558 HydrophobicContact SD-CD1 4Å; M211-L558 HydrophobicContact SD-CD2 4.41Å; M211-L558 HydrophobicContact SD-CG 4.46Å; M211-F590 HydrophobicContact CE-CD1 3.52Å; M211-F590 HydrophobicContact CE-CE1 3.82Å; M211-F590 HydrophobicContact CE-CG 4.05Å; M211-F590 HydrophobicContact SD-CD1 4.47Å
212	F	95.2	Very high	95.5	Very high	95 Å²	95	49.2 Å²	49.2	42%	0.417	26%	0.258	S	S	.	.	H	α-helix	trans	-72.8	-51.9	172.3	173.5	-95	0	0	0	111.2	A208 N209 G210 N214 R215 L216 P272	A208-F212 WeakPolarHBondContact O-CB 3.44Å; A208-F212 PolarHBondContact O-N 3.33Å; N209-F212 WeakPolarHBondContact O-CB 3.25Å; N209-F212 PolarHBondContact O-N 2.98Å; G210-F212 VanDerWaalsContact C-N 3.26Å; G210-F212 PolarHBondContact O-N 3.13Å; F212-N214 PolarHBondContact O-N 3.47Å; F212-R215 PolarHBondContact O-N 2.72Å; F212-R215 VanDerWaalsContact O-N 3.13Å; F212-L216 PolarHBondContact O-N 2.94Å; F212-P272 HydrophobicContact CE1-CB 4.06Å; F212-P272 HydrophobicContact CE1-CG 3.82Å; F212-P272 HydrophobicContact CZ-CB 4.33Å; F212-P272 HydrophobicContact CZ-CG 4.01Å
213	R	93.8	Very high	95.5	Very high	53 Å²	53	47.6 Å²	47.6	20%	0.2	25%	0.251	C	S	.	.	H	α-helix	trans	-54.6	-41.8	174.3	-70.2	170	-177.2	-152.1	-18.9	112	N209 G210 L216 C217 Q289 L308 E511	N209-R213 PolarHBondContact ND2-NE 2.81Å; N209-R213 VanDerWaalsContact ND2-NE 3.18Å; N209-R213 WeakPolarHBondContact O-CG 3.31Å; N209-R213 PolarHBondContact O-N 3.19Å; N209-R213 PolarHBondContact OD1-NE 3.07Å; G210-R213 PolarHBondContact O-N 2.71Å; R213-L216 WeakPolarHBondContact O-CB 3.37Å; R213-L216 PolarHBondContact O-N 3.04Å; R213-C217 PolarHBondContact O-N 3.3Å; R213-C217 PolarHBondContact O-SG 2.86Å; R213-Q289 VanDerWaalsContact CZ-OE1 3.28Å; R213-Q289 VanDerWaalsContact NH1-NE2 3.15Å; R213-L308 HydrophobicContact CB-CD2 4.26Å; R213-E511 IonicContact CZ-OE1 2.88Å; R213-E511 IonicContact NH1-OE1 3.55Å; R213-E511 PolarHBondContact NH1-OE1 2.88Å; R213-E511 IonicContact NH1-OE2 3.97Å
214	N	95.5	Very high	95.4	Very high	1 Å²	1	50.4 Å²	50.4	1%	0.005	27%	0.274	C	S	.	.	H	α-helix	trans	-62.4	-42.5	177.7	-177.9	71.3	0	0	0	113.4	G210 F212 C217 R300 L308 V552 D553	G210-N214 VanDerWaalsContact O-CB 3.27Å; G210-N214 WeakPolarHBondContact O-CB 3.46Å; G210-N214 PolarHBondContact O-N 3.21Å; F212-N214 PolarHBondContact O-N 3.47Å; N214-C217 PolarHBondContact O-N 3.19Å; N214-R300 PolarHBondContact O-NH1 3.02Å; N214-R300 PolarHBondContact OD1-NH2 2.99Å; N214-L308 HydrophobicContact CB-CD2 4.27Å; N214-V552 HydrophobicContact CB-CB 3.87Å; N214-V552 HydrophobicContact CB-CG1 3.74Å; N214-V552 HydrophobicContact CB-CG2 4.38Å; N214-V552 VanDerWaalsContact CG-CG1 3.42Å; N214-V552 VanDerWaalsContact ND2-CG1 3.33Å; N214-V552 WeakPolarHBondContact ND2-CG1 3.34Å; N214-V552 PolarHBondContact OD1-O 3.33Å; N214-D553 PolarHBondContact ND2-O 2.9Å; N214-D553 PolarHBondContact OD1-O 2.98Å
215	R	94.9	Very high	95.3	Very high	149 Å²	149	49.7 Å²	49.7	56%	0.562	27%	0.273	S	S	*	.	H	α-helix	trans	-70.6	-40.4	177.3	-76.7	178.6	-68.3	163.6	1	112.1	M211 F212 C217 S218 E219	M211-R215 WeakPolarHBondContact O-CG 3.43Å; M211-R215 PolarHBondContact O-N 3.06Å; M211-R215 PolarHBondContact O-NE 3.03Å; F212-R215 PolarHBondContact O-N 2.72Å; F212-R215 VanDerWaalsContact O-N 3.13Å; R215-C217 PolarHBondContact O-N 2.83Å; R215-S218 WeakPolarHBondContact O-CA 3.28Å; R215-S218 WeakPolarHBondContact O-CB 3.3Å; R215-S218 PolarHBondContact O-N 3.08Å; R215-E219 PolarHBondContact O-N 3.35Å
216	L	93.9	Very high	95.3	Very high	16 Å²	16	46 Å²	46	8%	0.084	25%	0.248	C	C	.	.	H	α-helix	trans	-55	-41.8	172.4	-178.2	71	0	0	0	111.4	F212 R213 S218 E219 L222 P272 Q273 L276	F212-L216 PolarHBondContact O-N 2.94Å; R213-L216 WeakPolarHBondContact O-CB 3.37Å; R213-L216 PolarHBondContact O-N 3.04Å; L216-S218 PolarHBondContact O-N 2.9Å; L216-E219 PolarHBondContact O-N 3.44Å; L216-L222 HydrophobicContact CD1-CD1 4.26Å; L216-L222 HydrophobicContact CG-CD1 4.41Å; L216-L222 WeakPolarHBondContact O-CD1 3.39Å; L216-P272 HydrophobicContact CD1-CB 4.39Å; L216-P272 HydrophobicContact CD2-CB 3.47Å; L216-P272 VanDerWaalsContact CD2-CB 3.47Å; L216-Q273 HydrophobicContact CD1-CB 3.95Å; L216-L276 HydrophobicContact CD2-CD1 3.63Å; L216-L276 HydrophobicContact CG-CD1 3.84Å
217	C	95.1	Very high	95.2	Very high	0 Å²	0	48 Å²	48	0%	0	26%	0.258	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74	16	173.4	-59.2	0	0	0	0	114.2	R213 N214 R215 L296 L297 R300	R213-C217 PolarHBondContact O-N 3.3Å; R213-C217 PolarHBondContact O-SG 2.86Å; N214-C217 PolarHBondContact O-N 3.19Å; R215-C217 PolarHBondContact O-N 2.83Å; C217-L296 HydrophobicContact CB-CD2 3.7Å; C217-L296 HydrophobicContact CB-CG 4.07Å; C217-L297 HydrophobicContact CB-CD2 4.38Å; C217-R300 WeakPolarHBondContact O-CD 3.36Å; C217-R300 PolarHBondContact O-NH1 3.25Å
218	S	94.7	Very high	95.1	Very high	40 Å²	40	52.2 Å²	52.2	28%	0.28	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-127.6	2	171.9	-66.8	0	0	0	0	112.9	R215 L216 L223 R300	R215-S218 WeakPolarHBondContact O-CA 3.28Å; R215-S218 WeakPolarHBondContact O-CB 3.3Å; R215-S218 PolarHBondContact O-N 3.08Å; L216-S218 PolarHBondContact O-N 2.9Å; S218-L223 WeakPolarHBondContact O-CD1 3.4Å; S218-R300 PolarHBondContact OG-NH1 3.14Å
219	E	94.8	Very high	95.1	Very high	83 Å²	83	52.7 Å²	52.7	39%	0.388	28%	0.283	S	S	.	.			trans	-65.8	134.8	-179.4	-68.3	-60.2	154.4	0	0	111.7	R215 L216 D221 L222 L223	R215-E219 PolarHBondContact O-N 3.35Å; L216-E219 PolarHBondContact O-N 3.44Å; E219-D221 VanDerWaalsContact C-N 3.32Å; E219-D221 PolarHBondContact O-N 3.44Å; E219-L222 HydrophobicContact CB-CD1 4.38Å; E219-L222 PolarHBondContact O-N 2.99Å; E219-L223 WeakPolarHBondContact O-CG 3.28Å; E219-L223 PolarHBondContact O-N 3.42Å
220	P	94.9	Very high	95.1	Very high	84 Å²	84	50.3 Å²	50.3	55%	0.545	27%	0.27	S	S	.	.	H	α-helix	trans	-65.6	-33.4	-166.3	25.9	-34.6	0	0	0	113.2	L223 A224	P220-L223 PolarHBondContact O-N 2.91Å; P220-A224 WeakPolarHBondContact O-CB 3.22Å; P220-A224 PolarHBondContact O-N 3.47Å
221	D	94.6	Very high	95	Very high	105 Å²	105	51.5 Å²	51.5	56%	0.561	28%	0.278	S	S	*	.	H	α-helix	trans	-70.9	-42.9	-179.1	-62.6	-31.2	0	0	0	111.2	E219 L223 A224 V225	E219-D221 VanDerWaalsContact C-N 3.32Å; E219-D221 PolarHBondContact O-N 3.44Å; D221-L223 VanDerWaalsContact C-N 3.35Å; D221-L223 PolarHBondContact O-N 3.39Å; D221-A224 PolarHBondContact O-N 3.48Å; D221-V225 WeakPolarHBondContact O-CG2 3.36Å; D221-V225 PolarHBondContact O-N 3.07Å
222	L	95.6	Very high	94.8	Very high	0 Å²	0	54.9 Å²	54.9	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-61.6	-41.8	172.6	-75.2	175.2	0	0	0	111.7	L216 E219 A226 Q273 L276 E277 L280 L297	L216-L222 HydrophobicContact CD1-CD1 4.26Å; L216-L222 HydrophobicContact CG-CD1 4.41Å; L216-L222 WeakPolarHBondContact O-CD1 3.39Å; E219-L222 HydrophobicContact CB-CD1 4.38Å; E219-L222 PolarHBondContact O-N 2.99Å; L222-A226 WeakPolarHBondContact O-CB 3.37Å; L222-A226 PolarHBondContact O-N 3.06Å; L222-Q273 HydrophobicContact CD1-CG 4.42Å; L222-L276 HydrophobicContact CD1-CB 4.18Å; L222-L276 HydrophobicContact CD1-CD1 3.99Å; L222-L276 HydrophobicContact CD2-CB 3.82Å; L222-E277 HydrophobicContact CD2-CB 4.47Å; L222-E277 HydrophobicContact CD2-CG 3.61Å; L222-L280 HydrophobicContact CD2-CD1 3.82Å; L222-L297 HydrophobicContact CB-CD1 4.15Å; L222-L297 HydrophobicContact CB-CD2 3.8Å; L222-L297 HydrophobicContact CD2-CD1 4.45Å
223	L	95.9	Very high	94.6	Very high	34 Å²	34	55.8 Å²	55.8	18%	0.178	31%	0.308	C	S	.	.	H	α-helix	trans	-66.7	-36.1	176.1	-66.2	178.2	0	0	0	112.4	S218 E219 P220 D221 L227 L297 R300 S301	S218-L223 WeakPolarHBondContact O-CD1 3.4Å; E219-L223 WeakPolarHBondContact O-CG 3.28Å; E219-L223 PolarHBondContact O-N 3.42Å; P220-L223 PolarHBondContact O-N 2.91Å; D221-L223 VanDerWaalsContact C-N 3.35Å; D221-L223 PolarHBondContact O-N 3.39Å; L223-L227 WeakPolarHBondContact O-CB 3.49Å; L223-L227 PolarHBondContact O-N 3.44Å; L223-L297 HydrophobicContact CD2-CB 4.48Å; L223-L297 HydrophobicContact CD2-CD2 3.75Å; L223-L297 WeakPolarHBondContact CD2-O 3.46Å; L223-L297 HydrophobicContact CG-CD2 4.38Å; L223-R300 HydrophobicContact CD2-CB 3.56Å; L223-S301 VanDerWaalsContact O-CB 3.26Å; L223-S301 WeakPolarHBondContact O-CB 3.39Å
224	A	95.3	Very high	94.5	Very high	59 Å²	59	54 Å²	54	49%	0.488	30%	0.302	S	S	.	.	H	α-helix	trans	-67.8	-44.1	176	0	0	0	0	0	112.1	P220 D221 L227 S228	P220-A224 WeakPolarHBondContact O-CB 3.22Å; P220-A224 PolarHBondContact O-N 3.47Å; D221-A224 PolarHBondContact O-N 3.48Å; A224-L227 PolarHBondContact O-N 3.23Å; A224-S228 PolarHBondContact O-N 2.8Å
225	V	95.5	Very high	94.2	Very high	58 Å²	58	57 Å²	57	35%	0.352	32%	0.322	S	S	.	.	H	α-helix	trans	-61.3	-47.4	173.2	174.6	0	0	0	0	110.5	D221 L227 S228 L229 L280	D221-V225 WeakPolarHBondContact O-CG2 3.36Å; D221-V225 PolarHBondContact O-N 3.07Å; V225-L227 VanDerWaalsContact C-N 3.32Å; V225-L227 PolarHBondContact O-N 3.3Å; V225-S228 PolarHBondContact O-N 3.3Å; V225-S228 VanDerWaalsContact O-N 3.14Å; V225-S228 PolarHBondContact O-OG 3.49Å; V225-L229 HydrophobicContact CG1-CD1 4.26Å; V225-L229 PolarHBondContact O-N 3.02Å; V225-L280 HydrophobicContact CB-CD1 4.18Å; V225-L280 HydrophobicContact CG1-CB 3.99Å; V225-L280 HydrophobicContact CG1-CD1 3.87Å; V225-L280 HydrophobicContact CG1-CG 4.47Å
226	A	95.8	Very high	93.9	Very high	0 Å²	0	55.4 Å²	55.4	0%	0	33%	0.329	C	S	.	.	H	α-helix	trans	-59.4	-40.2	175.6	0	0	0	0	0	112.4	L222 S228 L229 L280 L297 F298	L222-A226 WeakPolarHBondContact O-CB 3.37Å; L222-A226 PolarHBondContact O-N 3.06Å; A226-S228 VanDerWaalsContact C-N 3.33Å; A226-S228 PolarHBondContact O-N 3.38Å; A226-L229 PolarHBondContact O-N 3.03Å; A226-L280 HydrophobicContact CB-CD2 4.46Å; A226-L297 HydrophobicContact CB-CB 4.01Å; A226-F298 HydrophobicContact CB-CD1 4.03Å; A226-F298 HydrophobicContact CB-CE1 4.1Å; A226-F298 HydrophobicContact CB-CG 4.44Å; A226-F298 HydrophobicContact CB-CZ 4.48Å; A226-F298 WeakPolarHBondContact O-CD1 3.47Å; A226-F298 WeakPolarHBondContact O-CE1 3.47Å
227	L	95.2	Very high	93.6	Very high	79 Å²	79	57 Å²	57	41%	0.414	34%	0.34	S	S	.	.	H	α-helix	trans	-63.8	-38	175.9	-167.3	57.8	0	0	0	112.4	L223 A224 V225 L229 L230	L223-L227 WeakPolarHBondContact O-CB 3.49Å; L223-L227 PolarHBondContact O-N 3.44Å; A224-L227 PolarHBondContact O-N 3.23Å; V225-L227 VanDerWaalsContact C-N 3.32Å; V225-L227 PolarHBondContact O-N 3.3Å; L227-L229 VanDerWaalsContact C-N 3.27Å; L227-L229 PolarHBondContact O-N 3.16Å; L227-L230 PolarHBondContact O-N 3.36Å
228	S	95.1	Very high	93.1	Very high	95 Å²	95	59.3 Å²	59.3	66%	0.664	36%	0.358	S	S	*	.	H	α-helix	trans	-66.1	-25.4	179.3	77	0	0	0	0	114.5	A224 V225 A226	A224-S228 PolarHBondContact O-N 2.8Å; V225-S228 PolarHBondContact O-N 3.3Å; V225-S228 VanDerWaalsContact O-N 3.14Å; V225-S228 PolarHBondContact O-OG 3.49Å; A226-S228 VanDerWaalsContact C-N 3.33Å; A226-S228 PolarHBondContact O-N 3.38Å
229	L	94.8	Very high	92.4	Very high	65 Å²	65	63 Å²	63	34%	0.34	37%	0.366	S	S	.	.	H	α-helix	trans	-89.1	-11.3	-179.7	-67	171.5	0	0	0	112.6	V225 A226 L227 L280 L283 F298	V225-L229 HydrophobicContact CG1-CD1 4.26Å; V225-L229 PolarHBondContact O-N 3.02Å; A226-L229 PolarHBondContact O-N 3.03Å; L227-L229 VanDerWaalsContact C-N 3.27Å; L227-L229 PolarHBondContact O-N 3.16Å; L229-L280 HydrophobicContact CD1-CB 4.3Å; L229-L280 HydrophobicContact CD1-CD2 4.22Å; L229-L283 HydrophobicContact CD1-CD2 4.12Å; L229-L283 HydrophobicContact CD2-CD2 4.49Å; L229-F298 HydrophobicContact CB-CE1 3.99Å; L229-F298 HydrophobicContact CB-CZ 4.19Å; L229-F298 HydrophobicContact CD1-CZ 4.36Å
230	L	94.8	Very high	92	Very high	8 Å²	8	65.4 Å²	65.4	4%	0.042	38%	0.377	C	S	.	.	S	Bend	trans	-90	128.5	-168.6	-171.3	131.7	0	0	0	111.9	L227 F234 C235 L250 W253 F298 L302	L227-L230 PolarHBondContact O-N 3.36Å; L230-F234 HydrophobicContact CD2-CB 3.58Å; L230-F234 HydrophobicContact CG-CB 4.39Å; L230-C235 WeakPolarHBondContact CD2-SG 3.42Å; L230-L250 HydrophobicContact CD1-CD1 3.85Å; L230-W253 HydrophobicContact CD1-CZ3 4.25Å; L230-F298 HydrophobicContact CB-CD1 4.17Å; L230-F298 HydrophobicContact CB-CE1 4.34Å; L230-F298 HydrophobicContact CD1-CB 4.12Å; L230-F298 HydrophobicContact CD1-CD1 3.62Å; L230-F298 HydrophobicContact CD1-CG 4.29Å; L230-F298 HydrophobicContact CG-CD1 4.46Å; L230-L302 HydrophobicContact CD1-CD1 3.98Å; L230-L302 HydrophobicContact CD1-CG 4.14Å; L230-L302 HydrophobicContact CD2-CD1 4.44Å; L230-L302 HydrophobicContact CD2-CD2 3.84Å; L230-L302 HydrophobicContact CD2-CG 4.23Å
231	P	94.3	Very high	91.6	Very high	26 Å²	26	70.4 Å²	70.4	17%	0.169	39%	0.385	C	S	.	.			trans	-56.6	132.6	-176	-29.6	33.8	0	0	0	113.8	H233 F234 W253	P231-H233 VanDerWaalsContact CB-CE1 3.49Å; P231-H233 WeakPolarHBondContact CB-CE1 3.16Å; P231-H233 PolarHBondContact O-N 3.21Å; P231-F234 HydrophobicContact CB-CD2 3.93Å; P231-F234 HydrophobicContact CB-CE2 4.31Å; P231-F234 HydrophobicContact CG-CD2 4.09Å; P231-F234 HydrophobicContact CG-CE2 4.18Å; P231-F234 PolarHBondContact O-N 2.94Å; P231-W253 HydrophobicContact CG-CD2 4.07Å; P231-W253 HydrophobicContact CG-CG 4.26Å; P231-W253 HydrophobicContact CG-CZ2 4.06Å
232	P	91	Very high	91.4	Very high	103 Å²	103	65.8 Å²	65.8	67%	0.669	36%	0.36	S	S	*	.	H	α-helix	trans	-55.6	-28.2	-171.4	-30.6	35.4	0	0	0	115.9	F234 C235 T236	P232-F234 VanDerWaalsContact C-N 3.29Å; P232-F234 PolarHBondContact O-N 3.26Å; P232-C235 WeakPolarHBondContact O-CB 3.41Å; P232-C235 PolarHBondContact O-N 2.93Å; P232-T236 WeakPolarHBondContact O-CG2 3.04Å; P232-T236 PolarHBondContact O-N 3.02Å
233	H	90.6	Very high	91.2	Very high	113 Å²	113	67.4 Å²	67.4	52%	0.523	37%	0.369	S	S	.	.	H	α-helix	trans	-63.6	-33.7	179.1	64	-98.5	0	0	0	112.6	P231 T236	P231-H233 VanDerWaalsContact CB-CE1 3.49Å; P231-H233 WeakPolarHBondContact CB-CE1 3.16Å; P231-H233 PolarHBondContact O-N 3.21Å; H233-T236 PolarHBondContact O-N 3.39Å; H233-T236 PolarHBondContact O-OG1 3.18Å
234	F	92	Very high	91	Very high	16 Å²	16	69.1 Å²	69.1	7%	0.07	38%	0.376	C	S	.	.	H	α-helix	trans	-66.6	-45.1	172.9	-69.6	-60.4	0	0	0	111	L230 P231 P232 T236 V237 Y246 L250 W253	L230-F234 HydrophobicContact CD2-CB 3.58Å; L230-F234 HydrophobicContact CG-CB 4.39Å; P231-F234 HydrophobicContact CB-CD2 3.93Å; P231-F234 HydrophobicContact CB-CE2 4.31Å; P231-F234 HydrophobicContact CG-CD2 4.09Å; P231-F234 HydrophobicContact CG-CE2 4.18Å; P231-F234 PolarHBondContact O-N 2.94Å; P232-F234 VanDerWaalsContact C-N 3.29Å; P232-F234 PolarHBondContact O-N 3.26Å; F234-T236 PolarHBondContact O-N 2.79Å; F234-T236 VanDerWaalsContact O-N 3.14Å; F234-V237 PolarHBondContact O-N 3.5Å; F234-Y246 HydrophobicContact CB-CE2 4.43Å; F234-Y246 WeakPolarHBondContact CB-OH 3.41Å; F234-Y246 HydrophobicContact CD1-CD2 4.36Å; F234-Y246 AromaticContact CD1-CE2 3.74Å; F234-Y246 HydrophobicContact CD1-CE2 3.74Å; F234-Y246 AromaticContact CD1-CZ 3.86Å; F234-Y246 PolarHBondContact O-OH 3.46Å; F234-L250 HydrophobicContact CD1-CB 4.34Å; F234-L250 HydrophobicContact CD1-CD1 4.07Å; F234-L250 HydrophobicContact CD2-CD1 3.86Å; F234-L250 HydrophobicContact CE1-CB 3.96Å; F234-L250 HydrophobicContact CE1-CD1 4.21Å; F234-L250 HydrophobicContact CE2-CD1 4Å; F234-L250 HydrophobicContact CG-CD1 3.91Å; F234-L250 HydrophobicContact CZ-CB 4.27Å; F234-L250 HydrophobicContact CZ-CD1 4.19Å; F234-W253 HydrophobicContact CE2-CB 3.91Å; F234-W253 HydrophobicContact CE2-CD2 4.15Å; F234-W253 HydrophobicContact CE2-CE3 4.34Å; F234-W253 AromaticContact CE2-CG 3.92Å; F234-W253 HydrophobicContact CE2-CG 3.92Å; F234-W253 HydrophobicContact CZ-CB 4.06Å
235	C	89	Confident	90.9	Very high	64 Å²	64	72.1 Å²	72.1	43%	0.432	38%	0.384	S	S	.	.	H	α-helix	trans	-58.6	-26	176.7	-60.1	0	0	0	0	114.3	L230 P232	L230-C235 WeakPolarHBondContact CD2-SG 3.42Å; P232-C235 WeakPolarHBondContact O-CB 3.41Å; P232-C235 PolarHBondContact O-N 2.93Å
236	T	88.4	Confident	90.8	Very high	116 Å²	116	70.6 Å²	70.6	71%	0.712	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.6	-3.9	-177.9	57.4	0	0	0	0	115.3	P232 H233 F234	P232-T236 WeakPolarHBondContact O-CG2 3.04Å; P232-T236 PolarHBondContact O-N 3.02Å; H233-T236 PolarHBondContact O-N 3.39Å; H233-T236 PolarHBondContact O-OG1 3.18Å; F234-T236 PolarHBondContact O-N 2.79Å; F234-T236 VanDerWaalsContact O-N 3.14Å
237	V	88.1	Confident	90.7	Very high	50 Å²	50	70.6 Å²	70.6	30%	0.303	37%	0.372	S	S	.	.	S	Bend	trans	-86.2	117.1	-176.7	-177.3	0	0	0	0	111.1	F234 R241 I242 Y246	F234-V237 PolarHBondContact O-N 3.5Å; V237-R241 HydrophobicContact CG1-CB 4.05Å; V237-I242 HydrophobicContact CB-CG1 4.47Å; V237-I242 HydrophobicContact CG1-CG1 3.77Å; V237-Y246 HydrophobicContact CB-CD2 4.19Å; V237-Y246 HydrophobicContact CB-CE2 3.7Å; V237-Y246 HydrophobicContact CG1-CD2 4.1Å; V237-Y246 HydrophobicContact CG1-CE2 4.09Å; V237-Y246 HydrophobicContact CG2-CD2 4.01Å; V237-Y246 HydrophobicContact CG2-CE2 3.62Å
238	A	84.4	Confident	90.7	Very high	47 Å²	47	68.8 Å²	68.8	39%	0.388	37%	0.366	S	S	.	.			trans	-59.5	137.1	172.8	0	0	0	0	0	111.4	E240 R241	A238-E240 VanDerWaalsContact C-N 3.25Å; A238-E240 WeakPolarHBondContact CB-OE2 3.45Å; A238-E240 PolarHBondContact O-N 3.49Å; A238-E240 VanDerWaalsContact O-N 3.13Å; A238-R241 WeakPolarHBondContact O-CB 3.22Å; A238-R241 PolarHBondContact O-N 2.83Å
239	R	81.5	Confident	90.7	Very high	118 Å²	118	65.7 Å²	65.7	45%	0.445	35%	0.349	S	S	.	.	G	3₁₀ helix	trans	-56.1	-37.1	-167.2	-62.6	-171.6	-172.1	176.8	5.1	113.3	R241 I242 Q303	R239-R241 PolarHBondContact O-N 2.9Å; R239-R241 VanDerWaalsContact O-N 3.13Å; R239-I242 WeakPolarHBondContact O-CB 3.4Å; R239-I242 PolarHBondContact O-N 3.5Å; R239-Q303 VanDerWaalsContact NH2-CB 3.28Å
240	E	84.8	Confident	90.8	Very high	134 Å²	134	62.6 Å²	62.6	63%	0.626	33%	0.333	S	S	*	.	G	3₁₀ helix	trans	-66.6	-16.2	-179.1	-45.7	77.9	-174	0	0	112.9	A238	A238-E240 VanDerWaalsContact C-N 3.25Å; A238-E240 WeakPolarHBondContact CB-OE2 3.45Å; A238-E240 PolarHBondContact O-N 3.49Å; A238-E240 VanDerWaalsContact O-N 3.13Å
241	R	86.9	Confident	90.8	Very high	189 Å²	189	62.5 Å²	62.5	71%	0.713	33%	0.332	S	S	*	.	G	3₁₀ helix	trans	-93.7	-15	176.6	-59	-174.2	176.6	-159	-1.5	113.1	V237 A238 R239 D243	V237-R241 HydrophobicContact CG1-CB 4.05Å; A238-R241 WeakPolarHBondContact O-CB 3.22Å; A238-R241 PolarHBondContact O-N 2.83Å; R239-R241 PolarHBondContact O-N 2.9Å; R239-R241 VanDerWaalsContact O-N 3.13Å; R241-D243 PolarHBondContact O-N 2.99Å
242	I	90.8	Very high	90.9	Very high	7 Å²	7	68.6 Å²	68.6	4%	0.036	36%	0.356	C	S	.	.			trans	-66.2	130	-178.5	-64.8	-179.1	0	0	0	109.1	V237 R239 Y246 L304 L517	V237-I242 HydrophobicContact CB-CG1 4.47Å; V237-I242 HydrophobicContact CG1-CG1 3.77Å; R239-I242 WeakPolarHBondContact O-CB 3.4Å; R239-I242 PolarHBondContact O-N 3.5Å; I242-Y246 HydrophobicContact CB-CD1 4.4Å; I242-Y246 HydrophobicContact CD1-CE1 4.11Å; I242-Y246 HydrophobicContact CG1-CD1 4.25Å; I242-Y246 HydrophobicContact CG1-CD2 4.43Å; I242-Y246 HydrophobicContact CG1-CE1 4.29Å; I242-Y246 HydrophobicContact CG1-CE2 4.46Å; I242-Y246 HydrophobicContact CG1-CG 4.32Å; I242-Y246 HydrophobicContact CG2-CD1 3.58Å; I242-Y246 HydrophobicContact CG2-CE1 4.1Å; I242-Y246 HydrophobicContact CG2-CG 4.08Å; I242-L304 HydrophobicContact CD1-CD2 3.56Å; I242-L517 HydrophobicContact CG2-CD2 3.93Å
243	D	91.4	Very high	91.1	Very high	34 Å²	34	66 Å²	66	18%	0.182	33%	0.333	C	S	.	.			trans	-145.6	-176.1	-177.6	77.1	16.2	0	0	0	112.4	R241 N245 Y246 L247 K519	R241-D243 PolarHBondContact O-N 2.99Å; D243-N245 PolarHBondContact O-N 2.77Å; D243-N245 WeakPolarHBondContact OD1-CA 3.46Å; D243-N245 VanDerWaalsContact OD1-CB 3.24Å; D243-N245 WeakPolarHBondContact OD1-CB 3.07Å; D243-N245 PolarHBondContact OD1-N 2.98Å; D243-N245 PolarHBondContact OD1-ND2 3.33Å; D243-N245 PolarHBondContact OD2-ND2 3.32Å; D243-Y246 WeakPolarHBondContact O-CB 3.5Å; D243-Y246 PolarHBondContact O-N 2.88Å; D243-Y246 VanDerWaalsContact O-N 3.1Å; D243-Y246 PolarHBondContact OD1-N 2.99Å; D243-L247 PolarHBondContact O-N 3.24Å; D243-K519 HydrophobicContact CB-CD 3.69Å; D243-K519 IonicContact OD2-NZ 2.68Å; D243-K519 PolarHBondContact OD2-NZ 2.92Å
244	Q	91.6	Very high	91.4	Very high	70 Å²	70	60.6 Å²	60.6	33%	0.327	31%	0.308	S	S	.	.	H	α-helix	trans	-58.3	-30.4	-179.1	-62	175.1	-30.9	0	0	113.4	S248 L517 V524 V532 E533	Q244-S248 VanDerWaalsContact O-CB 3.24Å; Q244-S248 WeakPolarHBondContact O-CB 3.41Å; Q244-S248 PolarHBondContact O-N 3.34Å; Q244-S248 PolarHBondContact O-OG 2.83Å; Q244-L517 HydrophobicContact CG-CD1 3.8Å; Q244-V524 HydrophobicContact CG-CG2 4.38Å; Q244-V532 HydrophobicContact CB-CG1 4.48Å; Q244-E533 PolarHBondContact NE2-OE2 2.93Å
245	N	92.3	Very high	91.5	Very high	122 Å²	122	64.2 Å²	64.2	65%	0.652	32%	0.321	S	S	*	.	H	α-helix	trans	-74.7	-39.6	176.8	-52.6	-74.3	0	0	0	110.8	D243 S248 G249	D243-N245 PolarHBondContact O-N 2.77Å; D243-N245 WeakPolarHBondContact OD1-CA 3.46Å; D243-N245 VanDerWaalsContact OD1-CB 3.24Å; D243-N245 WeakPolarHBondContact OD1-CB 3.07Å; D243-N245 PolarHBondContact OD1-N 2.98Å; D243-N245 PolarHBondContact OD1-ND2 3.33Å; D243-N245 PolarHBondContact OD2-ND2 3.32Å; N245-S248 PolarHBondContact O-N 3.4Å; N245-G249 PolarHBondContact O-N 3.45Å
246	Y	93.9	Very high	91.7	Very high	26 Å²	26	65.4 Å²	65.4	10%	0.102	34%	0.335	C	S	.	.	H	α-helix	trans	-59.7	-50.8	171.5	177.6	-82	0	0	0	110.8	F234 V237 I242 D243 S248 G249 L250 L302	F234-Y246 HydrophobicContact CB-CE2 4.43Å; F234-Y246 WeakPolarHBondContact CB-OH 3.41Å; F234-Y246 HydrophobicContact CD1-CD2 4.36Å; F234-Y246 AromaticContact CD1-CE2 3.74Å; F234-Y246 HydrophobicContact CD1-CE2 3.74Å; F234-Y246 AromaticContact CD1-CZ 3.86Å; F234-Y246 PolarHBondContact O-OH 3.46Å; V237-Y246 HydrophobicContact CB-CD2 4.19Å; V237-Y246 HydrophobicContact CB-CE2 3.7Å; V237-Y246 HydrophobicContact CG1-CD2 4.1Å; V237-Y246 HydrophobicContact CG1-CE2 4.09Å; V237-Y246 HydrophobicContact CG2-CD2 4.01Å; V237-Y246 HydrophobicContact CG2-CE2 3.62Å; I242-Y246 HydrophobicContact CB-CD1 4.4Å; I242-Y246 HydrophobicContact CD1-CE1 4.11Å; I242-Y246 HydrophobicContact CG1-CD1 4.25Å; I242-Y246 HydrophobicContact CG1-CD2 4.43Å; I242-Y246 HydrophobicContact CG1-CE1 4.29Å; I242-Y246 HydrophobicContact CG1-CE2 4.46Å; I242-Y246 HydrophobicContact CG1-CG 4.32Å; I242-Y246 HydrophobicContact CG2-CD1 3.58Å; I242-Y246 HydrophobicContact CG2-CE1 4.1Å; I242-Y246 HydrophobicContact CG2-CG 4.08Å; D243-Y246 WeakPolarHBondContact O-CB 3.5Å; D243-Y246 PolarHBondContact O-N 2.88Å; D243-Y246 VanDerWaalsContact O-N 3.1Å; D243-Y246 PolarHBondContact OD1-N 2.99Å; Y246-S248 VanDerWaalsContact C-N 3.29Å; Y246-S248 PolarHBondContact O-N 2.74Å; Y246-G249 PolarHBondContact O-N 3.38Å; Y246-G249 VanDerWaalsContact O-N 3.13Å; Y246-L250 HydrophobicContact CE1-CD2 4.28Å; Y246-L250 WeakPolarHBondContact O-CB 3.46Å; Y246-L250 PolarHBondContact O-N 3.13Å; Y246-L302 HydrophobicContact CE1-CD1 4.27Å; Y246-L302 WeakPolarHBondContact OH-CD1 3.29Å
247	L	94.4	Very high	92	Very high	1 Å²	1	61.8 Å²	61.8	1%	0.005	31%	0.313	C	S	.	.	H	α-helix	trans	-60.1	-40	177.3	-68.2	-178.1	0	0	0	111.8	D243 L250 L251 L299 L304 V515 L517 V526 V532	D243-L247 PolarHBondContact O-N 3.24Å; L247-L250 PolarHBondContact O-N 3Å; L247-L251 VanDerWaalsContact O-CB 3.23Å; L247-L251 WeakPolarHBondContact O-CB 3.43Å; L247-L251 PolarHBondContact O-N 2.62Å; L247-L299 HydrophobicContact CD2-CD2 3.87Å; L247-L304 HydrophobicContact CD2-CD1 4.21Å; L247-V515 HydrophobicContact CD1-CB 4.01Å; L247-V515 HydrophobicContact CD1-CG1 4.17Å; L247-V515 HydrophobicContact CD1-CG2 4.31Å; L247-V515 HydrophobicContact CD2-CG1 4.31Å; L247-L517 HydrophobicContact CD1-CD1 4.29Å; L247-L517 HydrophobicContact CD1-CD2 3.87Å; L247-L517 HydrophobicContact CD1-CG 4.29Å; L247-L517 HydrophobicContact CG-CD2 4.33Å; L247-V526 HydrophobicContact CD1-CG2 4.37Å; L247-V532 HydrophobicContact CB-CG1 4.31Å; L247-V532 HydrophobicContact CB-CG2 4Å
248	S	94.6	Very high	92.3	Very high	40 Å²	40	59.7 Å²	59.7	28%	0.28	30%	0.3	S	S	.	.	H	α-helix	trans	-66.9	-35.1	176.4	-62.4	0	0	0	0	112.6	Q244 N245 Y246 K252	Q244-S248 VanDerWaalsContact O-CB 3.24Å; Q244-S248 WeakPolarHBondContact O-CB 3.41Å; Q244-S248 PolarHBondContact O-N 3.34Å; Q244-S248 PolarHBondContact O-OG 2.83Å; N245-S248 PolarHBondContact O-N 3.4Å; Y246-S248 VanDerWaalsContact C-N 3.29Å; Y246-S248 PolarHBondContact O-N 2.74Å; S248-K252 WeakPolarHBondContact O-CB 3.44Å; S248-K252 WeakPolarHBondContact O-CG 3.41Å; S248-K252 PolarHBondContact O-N 2.79Å
249	G	95.3	Very high	92.7	Very high	30 Å²	30	61.2 Å²	61.2	31%	0.309	31%	0.305	S	S	.	.	H	α-helix	trans	-68.6	-46.4	174.1	0	0	0	0	0	112.2	N245 Y246 L251 K252 W253	N245-G249 PolarHBondContact O-N 3.45Å; Y246-G249 PolarHBondContact O-N 3.38Å; Y246-G249 VanDerWaalsContact O-N 3.13Å; G249-L251 PolarHBondContact O-N 3.21Å; G249-K252 PolarHBondContact O-N 2.61Å; G249-W253 PolarHBondContact O-N 2.92Å
250	L	95.9	Very high	93.2	Very high	0 Å²	0	59.6 Å²	59.6	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-60.9	-43.8	176.2	-176.9	68.3	0	0	0	111.5	L230 F234 Y246 L247 W253 F254 F295 L299 L302	L230-L250 HydrophobicContact CD1-CD1 3.85Å; F234-L250 HydrophobicContact CD1-CB 4.34Å; F234-L250 HydrophobicContact CD1-CD1 4.07Å; F234-L250 HydrophobicContact CD2-CD1 3.86Å; F234-L250 HydrophobicContact CE1-CB 3.96Å; F234-L250 HydrophobicContact CE1-CD1 4.21Å; F234-L250 HydrophobicContact CE2-CD1 4Å; F234-L250 HydrophobicContact CG-CD1 3.91Å; F234-L250 HydrophobicContact CZ-CB 4.27Å; F234-L250 HydrophobicContact CZ-CD1 4.19Å; Y246-L250 HydrophobicContact CE1-CD2 4.28Å; Y246-L250 WeakPolarHBondContact O-CB 3.46Å; Y246-L250 PolarHBondContact O-N 3.13Å; L247-L250 PolarHBondContact O-N 3Å; L250-W253 HydrophobicContact CD1-CE3 3.82Å; L250-W253 HydrophobicContact CD1-CZ3 4.14Å; L250-W253 PolarHBondContact O-N 2.99Å; L250-F254 WeakPolarHBondContact O-CB 3.4Å; L250-F254 PolarHBondContact O-N 2.83Å; L250-F295 HydrophobicContact CD2-CE2 4.38Å; L250-F295 HydrophobicContact CD2-CZ 4.41Å; L250-F295 HydrophobicContact CG-CE2 4.14Å; L250-F295 HydrophobicContact CG-CZ 4.44Å; L250-L299 HydrophobicContact CD2-CD2 3.82Å; L250-L302 HydrophobicContact CD1-CD1 4.36Å; L250-L302 HydrophobicContact CD2-CD1 3.69Å
251	L	95.6	Very high	93.4	Very high	6 Å²	6	55.8 Å²	55.8	3%	0.031	29%	0.289	C	S	.	.	H	α-helix	trans	-67.1	-37.6	177.1	-179.4	58	0	0	0	112.7	L247 G249 F254 R255 F295 V526 V532	L247-L251 VanDerWaalsContact O-CB 3.23Å; L247-L251 WeakPolarHBondContact O-CB 3.43Å; L247-L251 PolarHBondContact O-N 2.62Å; G249-L251 PolarHBondContact O-N 3.21Å; L251-F254 HydrophobicContact CD1-CD1 4.4Å; L251-F254 PolarHBondContact O-N 3.22Å; L251-R255 HydrophobicContact CD1-CG 4.36Å; L251-R255 VanDerWaalsContact O-CG 3.29Å; L251-R255 WeakPolarHBondContact O-CG 3.45Å; L251-R255 PolarHBondContact O-N 2.74Å; L251-F295 HydrophobicContact CB-CE2 4.32Å; L251-F295 HydrophobicContact CB-CZ 3.86Å; L251-F295 HydrophobicContact CD1-CD1 4.34Å; L251-F295 HydrophobicContact CD1-CD2 4.43Å; L251-F295 HydrophobicContact CD1-CE1 4.03Å; L251-F295 HydrophobicContact CD1-CE2 4.11Å; L251-F295 HydrophobicContact CD1-CZ 3.91Å; L251-F295 HydrophobicContact CG-CZ 4.43Å; L251-V526 HydrophobicContact CD2-CG1 3.81Å; L251-V532 HydrophobicContact CD2-CG2 3.96Å
252	K	95.4	Very high	93.5	Very high	155 Å²	155	51.5 Å²	51.5	67%	0.674	29%	0.285	S	S	*	.	H	α-helix	trans	-62.8	-44.4	172.1	-78.7	171.3	-179.2	-175.9	0	111.8	S248 G249 A256	S248-K252 WeakPolarHBondContact O-CB 3.44Å; S248-K252 WeakPolarHBondContact O-CG 3.41Å; S248-K252 PolarHBondContact O-N 2.79Å; G249-K252 PolarHBondContact O-N 2.61Å; K252-A256 WeakPolarHBondContact O-CB 3.48Å; K252-A256 PolarHBondContact O-N 2.86Å; K252-A256 VanDerWaalsContact O-N 3.14Å
253	W	96	Very high	93.3	Very high	47 Å²	47	56 Å²	56	18%	0.178	32%	0.317	C	S	.	.	H	α-helix	trans	-61.4	-46.2	174.3	163.9	72.9	0	0	0	111.7	L230 P231 F234 G249 L250 R255 A256 T257 F298	L230-W253 HydrophobicContact CD1-CZ3 4.25Å; P231-W253 HydrophobicContact CG-CD2 4.07Å; P231-W253 HydrophobicContact CG-CG 4.26Å; P231-W253 HydrophobicContact CG-CZ2 4.06Å; F234-W253 HydrophobicContact CE2-CB 3.91Å; F234-W253 HydrophobicContact CE2-CD2 4.15Å; F234-W253 HydrophobicContact CE2-CE3 4.34Å; F234-W253 AromaticContact CE2-CG 3.92Å; F234-W253 HydrophobicContact CE2-CG 3.92Å; F234-W253 HydrophobicContact CZ-CB 4.06Å; G249-W253 PolarHBondContact O-N 2.92Å; L250-W253 HydrophobicContact CD1-CE3 3.82Å; L250-W253 HydrophobicContact CD1-CZ3 4.14Å; L250-W253 PolarHBondContact O-N 2.99Å; W253-R255 PolarHBondContact O-N 2.93Å; W253-A256 CarbonylContact O-C 3.46Å; W253-A256 PolarHBondContact O-N 3.33Å; W253-A256 VanDerWaalsContact O-N 3.11Å; W253-T257 HydrophobicContact CZ2-CG2 4.05Å; W253-T257 PolarHBondContact NE1-OG1 3.42Å; W253-T257 WeakPolarHBondContact O-CB 3.34Å; W253-T257 PolarHBondContact O-N 2.93Å; W253-T257 PolarHBondContact O-OG1 3.06Å; W253-F298 HydrophobicContact CH2-CD1 4.1Å; W253-F298 AromaticContact CH2-CE1 3.7Å; W253-F298 HydrophobicContact CH2-CE1 3.7Å; W253-F298 HydrophobicContact CH2-CZ 4.03Å; W253-F298 HydrophobicContact CZ3-CD1 4.16Å; W253-F298 HydrophobicContact CZ3-CE1 4.21Å; W253-F298 HydrophobicContact CZ3-CG 4.41Å
254	F	96.2	Very high	93.1	Very high	0 Å²	0	55.8 Å²	55.8	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-58.1	-48.2	179.2	175.5	-102.1	0	0	0	111.5	L250 L251 A256 T257 F258 M291 L294 F295 F298 V528	L250-F254 WeakPolarHBondContact O-CB 3.4Å; L250-F254 PolarHBondContact O-N 2.83Å; L251-F254 HydrophobicContact CD1-CD1 4.4Å; L251-F254 PolarHBondContact O-N 3.22Å; F254-A256 VanDerWaalsContact C-N 3.26Å; F254-A256 PolarHBondContact O-N 3.37Å; F254-T257 PolarHBondContact O-N 3.27Å; F254-F258 HydrophobicContact CD2-CB 4.48Å; F254-F258 AromaticContact CD2-CD2 3.44Å; F254-F258 HydrophobicContact CD2-CD2 3.44Å; F254-F258 VanDerWaalsContact CD2-CD2 3.44Å; F254-F258 AromaticContact CD2-CE2 3.92Å; F254-F258 HydrophobicContact CD2-CE2 3.92Å; F254-F258 HydrophobicContact CD2-CG 4.08Å; F254-F258 HydrophobicContact CE2-CB 4.09Å; F254-F258 HydrophobicContact CE2-CD1 4.2Å; F254-F258 AromaticContact CE2-CD2 3.37Å; F254-F258 HydrophobicContact CE2-CD2 3.37Å; F254-F258 AromaticContact CE2-CE2 3.82Å; F254-F258 HydrophobicContact CE2-CE2 3.82Å; F254-F258 AromaticContact CE2-CG 3.6Å; F254-F258 HydrophobicContact CE2-CG 3.6Å; F254-F258 HydrophobicContact CE2-CZ 4.39Å; F254-F258 HydrophobicContact CG-CD2 4.35Å; F254-F258 HydrophobicContact CZ-CB 4.11Å; F254-F258 HydrophobicContact CZ-CD2 4.23Å; F254-F258 HydrophobicContact CZ-CG 4.03Å; F254-F258 PolarHBondContact O-N 3.47Å; F254-M291 HydrophobicContact CD1-CE 4.36Å; F254-M291 HydrophobicContact CE1-CE 3.62Å; F254-M291 HydrophobicContact CE1-SD 4.01Å; F254-M291 HydrophobicContact CZ-CE 4.2Å; F254-M291 HydrophobicContact CZ-SD 4Å; F254-L294 HydrophobicContact CE2-CB 4.09Å; F254-L294 HydrophobicContact CZ-CB 3.95Å; F254-F295 HydrophobicContact CB-CD2 3.8Å; F254-F295 HydrophobicContact CB-CE2 3.86Å; F254-F295 HydrophobicContact CD1-CB 4.19Å; F254-F295 AromaticContact CD1-CD2 3.62Å; F254-F295 HydrophobicContact CD1-CD2 3.62Å; F254-F295 HydrophobicContact CD1-CE2 4.36Å; F254-F295 HydrophobicContact CD1-CG 4.14Å; F254-F295 AromaticContact CD2-CD2 3.82Å; F254-F295 HydrophobicContact CD2-CD2 3.82Å; F254-F295 HydrophobicContact CE1-CB 3.8Å; F254-F295 HydrophobicContact CE1-CD2 4.12Å; F254-F295 HydrophobicContact CE1-CG 4.25Å; F254-F295 HydrophobicContact CE2-CB 4.23Å; F254-F295 HydrophobicContact CE2-CD2 4.3Å; F254-F295 AromaticContact CG-CD2 3.46Å; F254-F295 HydrophobicContact CG-CD2 3.46Å; F254-F295 VanDerWaalsContact CG-CD2 3.46Å; F254-F295 HydrophobicContact CG-CE2 4.05Å; F254-F295 HydrophobicContact CG-CG 4.36Å; F254-F295 HydrophobicContact CZ-CB 3.82Å; F254-F295 HydrophobicContact CZ-CD2 4.44Å; F254-F298 AromaticContact CD2-CD2 3.81Å; F254-F298 HydrophobicContact CD2-CD2 3.81Å; F254-F298 AromaticContact CD2-CE2 3.91Å; F254-F298 HydrophobicContact CD2-CE2 3.91Å; F254-F298 AromaticContact CE2-CD2 3.83Å; F254-F298 HydrophobicContact CE2-CD2 3.83Å; F254-F298 AromaticContact CE2-CE2 3.79Å; F254-F298 HydrophobicContact CE2-CE2 3.79Å; F254-V528 HydrophobicContact CE1-CG1 4.46Å
255	R	94.1	Very high	92.6	Very high	93 Å²	93	56.4 Å²	56.4	35%	0.351	33%	0.326	S	S	.	.	H	α-helix	trans	-64.2	-25.3	176.1	-68.6	171.8	-172.9	-160.1	2.5	114.7	L251 W253 T257 D527 V528 E529 H530	L251-R255 HydrophobicContact CD1-CG 4.36Å; L251-R255 VanDerWaalsContact O-CG 3.29Å; L251-R255 WeakPolarHBondContact O-CG 3.45Å; L251-R255 PolarHBondContact O-N 2.74Å; W253-R255 PolarHBondContact O-N 2.93Å; R255-T257 VanDerWaalsContact C-N 3.34Å; R255-D527 PolarHBondContact NH2-O 3.41Å; R255-V528 PolarHBondContact NE-O 3.39Å; R255-V528 VanDerWaalsContact NH2-C 3.32Å; R255-V528 PolarHBondContact NH2-O 2.98Å; R255-E529 VanDerWaalsContact CZ-C 3.44Å; R255-E529 PolarHBondContact NH1-O 3.35Å; R255-E529 PolarHBondContact NH2-O 3.18Å; R255-H530 VanDerWaalsContact NH2-N 3.17Å
256	A	94.3	Very high	91.9	Very high	88 Å²	88	55.4 Å²	55.4	73%	0.727	32%	0.324	S	S	*	.	H	α-helix	trans	-84.8	-10.6	174.4	0	0	0	0	0	112.9	K252 W253 F254	K252-A256 WeakPolarHBondContact O-CB 3.48Å; K252-A256 PolarHBondContact O-N 2.86Å; K252-A256 VanDerWaalsContact O-N 3.14Å; W253-A256 CarbonylContact O-C 3.46Å; W253-A256 PolarHBondContact O-N 3.33Å; W253-A256 VanDerWaalsContact O-N 3.11Å; F254-A256 VanDerWaalsContact C-N 3.26Å; F254-A256 PolarHBondContact O-N 3.37Å
257	T	94.5	Very high	91	Very high	41 Å²	41	58 Å²	58	25%	0.252	34%	0.337	S	S	.	.	H	α-helix	trans	-109.1	-38.6	-176.4	-53.5	0	0	0	0	111.8	W253 F254 R255 L283	W253-T257 HydrophobicContact CZ2-CG2 4.05Å; W253-T257 PolarHBondContact NE1-OG1 3.42Å; W253-T257 WeakPolarHBondContact O-CB 3.34Å; W253-T257 PolarHBondContact O-N 2.93Å; W253-T257 PolarHBondContact O-OG1 3.06Å; F254-T257 PolarHBondContact O-N 3.27Å; R255-T257 VanDerWaalsContact C-N 3.34Å; T257-L283 HydrophobicContact CG2-CD1 4.15Å; T257-L283 HydrophobicContact CG2-CD2 4.29Å
258	F	95.1	Very high	89.8	Confident	5 Å²	5	67.4 Å²	67.4	2%	0.022	38%	0.381	C	S	.	.	S	Bend	trans	-101.3	123.2	-179.3	-77.7	-97.6	0	0	0	111.5	F254 L280 L283 M291 L294 F298	F254-F258 HydrophobicContact CD2-CB 4.48Å; F254-F258 AromaticContact CD2-CD2 3.44Å; F254-F258 HydrophobicContact CD2-CD2 3.44Å; F254-F258 VanDerWaalsContact CD2-CD2 3.44Å; F254-F258 AromaticContact CD2-CE2 3.92Å; F254-F258 HydrophobicContact CD2-CE2 3.92Å; F254-F258 HydrophobicContact CD2-CG 4.08Å; F254-F258 HydrophobicContact CE2-CB 4.09Å; F254-F258 HydrophobicContact CE2-CD1 4.2Å; F254-F258 AromaticContact CE2-CD2 3.37Å; F254-F258 HydrophobicContact CE2-CD2 3.37Å; F254-F258 AromaticContact CE2-CE2 3.82Å; F254-F258 HydrophobicContact CE2-CE2 3.82Å; F254-F258 AromaticContact CE2-CG 3.6Å; F254-F258 HydrophobicContact CE2-CG 3.6Å; F254-F258 HydrophobicContact CE2-CZ 4.39Å; F254-F258 HydrophobicContact CG-CD2 4.35Å; F254-F258 HydrophobicContact CZ-CB 4.11Å; F254-F258 HydrophobicContact CZ-CD2 4.23Å; F254-F258 HydrophobicContact CZ-CG 4.03Å; F254-F258 PolarHBondContact O-N 3.47Å; F258-L280 HydrophobicContact CZ-CD2 4.22Å; F258-L283 WeakPolarHBondContact CA-O 3.4Å; F258-L283 HydrophobicContact CE1-CD2 3.93Å; F258-L283 HydrophobicContact CE2-CD2 3.81Å; F258-L283 HydrophobicContact CZ-CD2 3.45Å; F258-L283 VanDerWaalsContact CZ-CD2 3.45Å; F258-M291 HydrophobicContact CB-CE 4.11Å; F258-M291 HydrophobicContact CB-SD 4Å; F258-L294 HydrophobicContact CD1-CD1 4.03Å; F258-L294 HydrophobicContact CE1-CD1 4.16Å; F258-L294 HydrophobicContact CE1-CD2 4.35Å; F258-F298 HydrophobicContact CD2-CE2 4.32Å; F258-F298 AromaticContact CE2-CE2 3.39Å; F258-F298 HydrophobicContact CE2-CE2 3.39Å; F258-F298 AromaticContact CE2-CZ 3.5Å; F258-F298 HydrophobicContact CE2-CZ 3.5Å; F258-F298 VanDerWaalsContact CE2-CZ 3.5Å; F258-F298 AromaticContact CZ-CE2 3.51Å; F258-F298 HydrophobicContact CZ-CE2 3.51Å; F258-F298 AromaticContact CZ-CZ 3.61Å; F258-F298 HydrophobicContact CZ-CZ 3.61Å
259	T	92.8	Very high	88.4	Confident	80 Å²	80	76.6 Å²	76.6	49%	0.491	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	131.9	-179.8	48.3	0	0	0	0	111.5	L283 S284 A285	T259-L283 PolarHBondContact N-O 3.41Å; T259-L283 PolarHBondContact OG1-O 3.28Å; T259-L283 VanDerWaalsContact OG1-O 3.1Å; T259-S284 CarbonylContact O-C 3.58Å; T259-S284 VanDerWaalsContact O-CA 3.26Å; T259-S284 WeakPolarHBondContact O-CA 3.47Å; T259-S284 WeakPolarHBondContact OG1-CB 3.32Å; T259-S284 PolarHBondContact OG1-OG 3.09Å; T259-A285 PolarHBondContact O-N 2.94Å
260	L	91.4	Very high	87.4	Confident	83 Å²	83	77.4 Å²	77.4	44%	0.435	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	109.6	170.4	-176.7	66.4	0	0	0	108.9	A285 M291	L260-A285 CarbonylContact C-O 3.52Å; L260-A285 WeakPolarHBondContact CA-O 3.45Å; L260-M291 HydrophobicContact CD1-CG 4.12Å
261	D	89.9	Confident	87	Confident	55 Å²	55	81.9 Å²	81.9	29%	0.294	43%	0.433	S	S	.	.			trans	-123.1	93.2	-178.7	177.9	10.8	0	0	0	111.5	S263 L264 A285 R286	D261-S263 VanDerWaalsContact CG-OG 3.29Å; D261-S263 PolarHBondContact O-N 3.34Å; D261-S263 VanDerWaalsContact O-N 3.08Å; D261-S263 WeakPolarHBondContact OD1-CA 3.49Å; D261-S263 VanDerWaalsContact OD1-CB 3.23Å; D261-S263 WeakPolarHBondContact OD1-CB 3.3Å; D261-S263 PolarHBondContact OD1-N 3.32Å; D261-S263 PolarHBondContact OD1-OG 2.84Å; D261-S263 PolarHBondContact OD2-OG 3.38Å; D261-L264 HydrophobicContact CB-CD1 4.01Å; D261-L264 HydrophobicContact CB-CG 4Å; D261-L264 WeakPolarHBondContact O-CB 3.44Å; D261-L264 WeakPolarHBondContact O-CG 3.45Å; D261-L264 PolarHBondContact O-N 2.9Å; D261-A285 PolarHBondContact N-O 2.93Å; D261-R286 WeakPolarHBondContact O-CA 3.27Å
262	P	88	Confident	86.6	Confident	99 Å²	99	83.5 Å²	83.5	64%	0.643	45%	0.445	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.8	-11.1	176.6	-24	35.5	0	0	0	115.2	L264 R286	P262-L264 VanDerWaalsContact C-N 3.3Å; P262-R286 WeakPolarHBondContact CA-O 3.46Å
263	S	87.3	Confident	86.3	Confident	100 Å²	100	79 Å²	79	70%	0.699	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.1	-13.2	177.6	80.8	0	0	0	0	113.3	D261	D261-S263 VanDerWaalsContact CG-OG 3.29Å; D261-S263 PolarHBondContact O-N 3.34Å; D261-S263 VanDerWaalsContact O-N 3.08Å; D261-S263 WeakPolarHBondContact OD1-CA 3.49Å; D261-S263 VanDerWaalsContact OD1-CB 3.23Å; D261-S263 WeakPolarHBondContact OD1-CB 3.3Å; D261-S263 PolarHBondContact OD1-N 3.32Å; D261-S263 PolarHBondContact OD1-OG 2.84Å; D261-S263 PolarHBondContact OD2-OG 3.38Å
264	L	86.1	Confident	86	Confident	30 Å²	30	78.9 Å²	78.9	16%	0.157	44%	0.435	C	S	.	.	S	Bend	trans	-56.2	137.9	178	-71.5	170.2	0	0	0	111.6	D261 P262 R286	D261-L264 HydrophobicContact CB-CD1 4.01Å; D261-L264 HydrophobicContact CB-CG 4Å; D261-L264 WeakPolarHBondContact O-CB 3.44Å; D261-L264 WeakPolarHBondContact O-CG 3.45Å; D261-L264 PolarHBondContact O-N 2.9Å; P262-L264 VanDerWaalsContact C-N 3.3Å; L264-R286 HydrophobicContact CB-CB 3.96Å; L264-R286 HydrophobicContact CB-CG 4.05Å; L264-R286 HydrophobicContact CD1-CB 4.23Å; L264-R286 VanDerWaalsContact O-CD 3.24Å; L264-R286 WeakPolarHBondContact O-CD 3.2Å; L264-R286 PolarHBondContact O-NE 3.11Å
265	P	81.1	Confident	85.8	Confident	84 Å²	84	80.2 Å²	80.2	55%	0.545	44%	0.442	S	S	.	.	P	Polyproline II helix	trans	-64.1	144.8	-171.2	24.7	-34.6	0	0	0	112.3
266	T	78.3	Confident	85.7	Confident	100 Å²	100	76 Å²	76	61%	0.613	43%	0.426	S	S	*	.	P	Polyproline II helix	trans	-88.9	121.5	168.2	-44.6	0	0	0	0	108.1	R286	T266-R286 VanDerWaalsContact OG1-CZ 3.3Å; T266-R286 PolarHBondContact OG1-NE 3.41Å; T266-R286 PolarHBondContact OG1-NH2 3.32Å
267	E	75.3	Confident	85.6	Confident	80 Å²	80	75.6 Å²	75.6	37%	0.374	41%	0.409	S	S	.	.	P	Polyproline II helix	trans	-89.7	139.1	167.2	-75.1	166.3	-153.3	0	0	108.9	R269 P270 R278	E267-R269 VanDerWaalsContact C-N 3.25Å; E267-R269 PolarHBondContact O-N 2.83Å; E267-P270 HydrophobicContact CB-CB 4.02Å; E267-P270 HydrophobicContact CB-CG 4.35Å; E267-P270 WeakPolarHBondContact O-CD 3.43Å; E267-P270 WeakPolarHBondContact OE2-CA 3.13Å; E267-P270 WeakPolarHBondContact OE2-CB 3.36Å; E267-R278 IonicContact OE1-CZ 2.61Å; E267-R278 IonicContact OE1-NH1 2.69Å; E267-R278 PolarHBondContact OE1-NH1 2.85Å; E267-R278 IonicContact OE1-NH2 3.2Å; E267-R278 PolarHBondContact OE1-NH2 3.42Å; E267-R278 IonicContact OE2-NH2 2.89Å
268	E	67.9	Low	85.5	Confident	199 Å²	199	78.4 Å²	78.4	93%	0.93	42%	0.415	S	S	*	.	S	Bend	trans	-71.2	-24.9	178	-62.6	-173.1	156.2	0	0	112.3
269	R	65.8	Low	85.4	Confident	234 Å²	234	78.5 Å²	78.5	88%	0.883	42%	0.415	S	S	*	.	S	Bend	trans	-149.8	69.5	177.6	-62.2	-173.7	-173.9	173.4	2.8	110.5	E267	E267-R269 VanDerWaalsContact C-N 3.25Å; E267-R269 PolarHBondContact O-N 2.83Å
270	P	75.6	Confident	85.4	Confident	46 Å²	46	74.7 Å²	74.7	30%	0.299	39%	0.392	S	S	.	.			trans	-61.6	145.7	171	27.8	-33.7	0	0	0	109.4	E267 P272 L275	E267-P270 HydrophobicContact CB-CB 4.02Å; E267-P270 HydrophobicContact CB-CG 4.35Å; E267-P270 WeakPolarHBondContact O-CD 3.43Å; E267-P270 WeakPolarHBondContact OE2-CA 3.13Å; E267-P270 WeakPolarHBondContact OE2-CB 3.36Å; P270-P272 VanDerWaalsContact O-CD 3.31Å; P270-P272 WeakPolarHBondContact O-CD 3.2Å; P270-L275 HydrophobicContact CB-CB 4.29Å; P270-L275 HydrophobicContact CB-CD2 4.13Å; P270-L275 HydrophobicContact CG-CD2 4.22Å
271	D	87.3	Confident	85.5	Confident	94 Å²	94	74 Å²	74	50%	0.503	40%	0.404	S	S	.	.			trans	-68.8	119.8	154.3	169.6	44.5	0	0	0	107.9	Q273 A274 L275	D271-Q273 PolarHBondContact O-N 3.09Å; D271-A274 HydrophobicContact CB-CB 4.12Å; D271-A274 PolarHBondContact O-N 3.4Å; D271-A274 VanDerWaalsContact OD2-CB 3.25Å; D271-A274 WeakPolarHBondContact OD2-CB 3.41Å; D271-A274 PolarHBondContact OD2-N 2.89Å; D271-L275 VanDerWaalsContact O-CB 3.3Å; D271-L275 WeakPolarHBondContact O-CB 3.49Å; D271-L275 PolarHBondContact O-N 3.43Å
272	P	86.1	Confident	85.6	Confident	41 Å²	41	74.1 Å²	74.1	27%	0.266	41%	0.41	S	S	.	.	H	α-helix	trans	-62.2	-28.9	-174.9	-26.3	38.1	0	0	0	113.7	F212 L216 P270 L276	F212-P272 HydrophobicContact CE1-CB 4.06Å; F212-P272 HydrophobicContact CE1-CG 3.82Å; F212-P272 HydrophobicContact CZ-CB 4.33Å; F212-P272 HydrophobicContact CZ-CG 4.01Å; L216-P272 HydrophobicContact CD1-CB 4.39Å; L216-P272 HydrophobicContact CD2-CB 3.47Å; L216-P272 VanDerWaalsContact CD2-CB 3.47Å; P270-P272 VanDerWaalsContact O-CD 3.31Å; P270-P272 WeakPolarHBondContact O-CD 3.2Å; P272-L276 PolarHBondContact O-N 3.17Å
273	Q	89.6	Confident	85.9	Confident	60 Å²	60	72.1 Å²	72.1	28%	0.28	39%	0.394	S	S	.	.	H	α-helix	trans	-73.5	-57.9	176.8	-179.9	174.6	-22.2	0	0	111.2	L216 L222 D271 L275 L276 E277	L216-Q273 HydrophobicContact CD1-CB 3.95Å; L222-Q273 HydrophobicContact CD1-CG 4.42Å; D271-Q273 PolarHBondContact O-N 3.09Å; Q273-L275 PolarHBondContact O-N 3.36Å; Q273-L275 VanDerWaalsContact O-N 3.13Å; Q273-L276 PolarHBondContact O-N 3.36Å; Q273-E277 HydrophobicContact CG-CG 4.33Å; Q273-E277 WeakPolarHBondContact CG-OE1 3.46Å; Q273-E277 PolarHBondContact NE2-OE1 3.33Å; Q273-E277 WeakPolarHBondContact O-CG 3.34Å; Q273-E277 PolarHBondContact O-N 2.99Å
274	A	89.8	Confident	86.2	Confident	44 Å²	44	68.3 Å²	68.3	36%	0.364	37%	0.367	S	S	.	.	H	α-helix	trans	-58.3	-28.4	177.9	0	0	0	0	0	112.8	D271 R278	D271-A274 HydrophobicContact CB-CB 4.12Å; D271-A274 PolarHBondContact O-N 3.4Å; D271-A274 VanDerWaalsContact OD2-CB 3.25Å; D271-A274 WeakPolarHBondContact OD2-CB 3.41Å; D271-A274 PolarHBondContact OD2-N 2.89Å; A274-R278 VanDerWaalsContact O-CB 3.24Å; A274-R278 WeakPolarHBondContact O-CB 3.41Å; A274-R278 PolarHBondContact O-N 3.02Å
275	L	91.3	Very high	86.5	Confident	29 Å²	29	66.9 Å²	66.9	15%	0.152	36%	0.359	C	S	.	.	H	α-helix	trans	-60.4	-54.5	169.9	178.4	62	0	0	0	111.5	P270 D271 Q273 R278 R279	P270-L275 HydrophobicContact CB-CB 4.29Å; P270-L275 HydrophobicContact CB-CD2 4.13Å; P270-L275 HydrophobicContact CG-CD2 4.22Å; D271-L275 VanDerWaalsContact O-CB 3.3Å; D271-L275 WeakPolarHBondContact O-CB 3.49Å; D271-L275 PolarHBondContact O-N 3.43Å; Q273-L275 PolarHBondContact O-N 3.36Å; Q273-L275 VanDerWaalsContact O-N 3.13Å; L275-R278 VanDerWaalsContact CD1-NH2 3.32Å; L275-R278 PolarHBondContact O-N 2.98Å; L275-R279 WeakPolarHBondContact O-CG 3.37Å; L275-R279 PolarHBondContact O-N 2.72Å
276	L	92.6	Very high	87	Confident	3 Å²	3	66.3 Å²	66.3	2%	0.016	35%	0.346	C	S	.	.	H	α-helix	trans	-66	-39.5	179.8	-70.4	177.5	0	0	0	112.3	L216 L222 P272 Q273 R278 R279 L280 H293 L294 L297	L216-L276 HydrophobicContact CD2-CD1 3.63Å; L216-L276 HydrophobicContact CG-CD1 3.84Å; L222-L276 HydrophobicContact CD1-CB 4.18Å; L222-L276 HydrophobicContact CD1-CD1 3.99Å; L222-L276 HydrophobicContact CD2-CB 3.82Å; P272-L276 PolarHBondContact O-N 3.17Å; Q273-L276 PolarHBondContact O-N 3.36Å; L276-R278 VanDerWaalsContact C-N 3.31Å; L276-R278 PolarHBondContact O-N 2.99Å; L276-R279 PolarHBondContact O-N 3.3Å; L276-L280 WeakPolarHBondContact O-CG 3.28Å; L276-L280 PolarHBondContact O-N 3.38Å; L276-H293 HydrophobicContact CD2-CB 3.99Å; L276-L294 HydrophobicContact CD2-CD2 4.3Å; L276-L294 HydrophobicContact CD2-CG 4.44Å; L276-L297 HydrophobicContact CD1-CD1 4.45Å
277	E	91.9	Very high	87.6	Confident	81 Å²	81	63.9 Å²	63.9	38%	0.379	33%	0.33	S	S	.	.	H	α-helix	trans	-56.8	-45.2	173.2	-69.5	177.9	-174.7	0	0	111.3	L222 Q273 L280 G281	L222-E277 HydrophobicContact CD2-CB 4.47Å; L222-E277 HydrophobicContact CD2-CG 3.61Å; Q273-E277 HydrophobicContact CG-CG 4.33Å; Q273-E277 WeakPolarHBondContact CG-OE1 3.46Å; Q273-E277 PolarHBondContact NE2-OE1 3.33Å; Q273-E277 WeakPolarHBondContact O-CG 3.34Å; Q273-E277 PolarHBondContact O-N 2.99Å; E277-L280 PolarHBondContact O-N 2.72Å; E277-G281 PolarHBondContact O-N 2.86Å
278	R	91.4	Very high	88.3	Confident	100 Å²	100	61.2 Å²	61.2	38%	0.377	32%	0.317	S	S	.	.	H	α-helix	trans	-65.6	-39.4	176.6	179.8	176.3	59.7	-168.3	-2.9	112.8	E267 A274 L275 L276 G281 S282	E267-R278 IonicContact OE1-CZ 2.61Å; E267-R278 IonicContact OE1-NH1 2.69Å; E267-R278 PolarHBondContact OE1-NH1 2.85Å; E267-R278 IonicContact OE1-NH2 3.2Å; E267-R278 PolarHBondContact OE1-NH2 3.42Å; E267-R278 IonicContact OE2-NH2 2.89Å; A274-R278 VanDerWaalsContact O-CB 3.24Å; A274-R278 WeakPolarHBondContact O-CB 3.41Å; A274-R278 PolarHBondContact O-N 3.02Å; L275-R278 VanDerWaalsContact CD1-NH2 3.32Å; L275-R278 PolarHBondContact O-N 2.98Å; L276-R278 VanDerWaalsContact C-N 3.31Å; L276-R278 PolarHBondContact O-N 2.99Å; R278-G281 PolarHBondContact O-N 3.19Å; R278-S282 PolarHBondContact O-N 2.96Å; R278-S282 PolarHBondContact O-OG 3.29Å
279	R	93.1	Very high	89.5	Confident	6 Å²	6	54.5 Å²	54.5	2%	0.023	29%	0.286	C	S	.	.	H	α-helix	trans	-69	-37.5	177	-65.1	-42	-170.6	-148	-5	112.6	L275 L276 L283 S284 E290 L294	L275-R279 WeakPolarHBondContact O-CG 3.37Å; L275-R279 PolarHBondContact O-N 2.72Å; L276-R279 PolarHBondContact O-N 3.3Å; R279-L283 PolarHBondContact O-N 3.37Å; R279-S284 WeakPolarHBondContact CB-O 3.14Å; R279-S284 VanDerWaalsContact CD-O 3.3Å; R279-S284 WeakPolarHBondContact CD-O 3.37Å; R279-S284 PolarHBondContact O-N 3.08Å; R279-E290 WeakPolarHBondContact CD-OE2 3.43Å; R279-E290 IonicContact CZ-OE1 2.66Å; R279-E290 IonicContact CZ-OE2 3.7Å; R279-E290 VanDerWaalsContact NE-CD 3.29Å; R279-E290 IonicContact NE-OE1 3.3Å; R279-E290 PolarHBondContact NE-OE1 3.45Å; R279-E290 IonicContact NE-OE2 2.85Å; R279-E290 PolarHBondContact NE-OE2 3.21Å; R279-E290 IonicContact NH2-OE1 2.7Å; R279-E290 PolarHBondContact NH2-OE1 3.02Å; R279-E290 IonicContact NH2-OE2 2.73Å; R279-E290 PolarHBondContact NH2-OE2 2.63Å; R279-L294 HydrophobicContact CB-CD1 3.93Å; R279-L294 HydrophobicContact CB-CD2 4.02Å; R279-L294 HydrophobicContact CB-CG 4.5Å
280	L	94	Very high	90.7	Very high	1 Å²	1	44 Å²	44	1%	0.005	25%	0.247	C	C	.	.	H	α-helix	trans	-62.1	-43.3	169.3	-72	169.3	0	0	0	111	L222 V225 A226 L229 F258 L276 E277 L283 L294 L297 F298	L222-L280 HydrophobicContact CD2-CD1 3.82Å; V225-L280 HydrophobicContact CB-CD1 4.18Å; V225-L280 HydrophobicContact CG1-CB 3.99Å; V225-L280 HydrophobicContact CG1-CD1 3.87Å; V225-L280 HydrophobicContact CG1-CG 4.47Å; A226-L280 HydrophobicContact CB-CD2 4.46Å; L229-L280 HydrophobicContact CD1-CB 4.3Å; L229-L280 HydrophobicContact CD1-CD2 4.22Å; F258-L280 HydrophobicContact CZ-CD2 4.22Å; L276-L280 WeakPolarHBondContact O-CG 3.28Å; L276-L280 PolarHBondContact O-N 3.38Å; E277-L280 PolarHBondContact O-N 2.72Å; L280-L283 WeakPolarHBondContact O-CD2 3.39Å; L280-L294 HydrophobicContact CD2-CD2 3.68Å; L280-L294 HydrophobicContact CG-CD2 3.72Å; L280-L297 HydrophobicContact CD1-CD1 4.12Å; L280-F298 HydrophobicContact CD2-CE2 4.21Å; L280-F298 HydrophobicContact CD2-CZ 4.22Å
281	G	92.3	Very high	91.6	Very high	67 Å²	67	42.6 Å²	42.6	69%	0.691	24%	0.236	S	C	*	.	H	α-helix	trans	-68.8	-30	178.7	0	0	0	0	0	114.8	E277 R278	E277-G281 PolarHBondContact O-N 2.86Å; R278-G281 PolarHBondContact O-N 3.19Å
282	S	92.9	Very high	92	Very high	58 Å²	58	38.1 Å²	38.1	41%	0.406	21%	0.212	S	C	.	.	H	α-helix	trans	-92.2	-13	177.5	77.6	0	0	0	0	114.4	R278 S284	R278-S282 PolarHBondContact O-N 2.96Å; R278-S282 PolarHBondContact O-OG 3.29Å; S282-S284 PolarHBondContact O-N 3.08Å; S282-S284 PolarHBondContact O-OG 3.17Å; S282-S284 PolarHBondContact OG-N 2.95Å
283	L	94.3	Very high	92.4	Very high	58 Å²	58	36.7 Å²	36.7	30%	0.304	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	52.5	39.6	-169.7	-55.2	176.2	0	0	0	112.7	L229 T257 F258 T259 R279 L280	L229-L283 HydrophobicContact CD1-CD2 4.12Å; L229-L283 HydrophobicContact CD2-CD2 4.49Å; T257-L283 HydrophobicContact CG2-CD1 4.15Å; T257-L283 HydrophobicContact CG2-CD2 4.29Å; F258-L283 WeakPolarHBondContact CA-O 3.4Å; F258-L283 HydrophobicContact CE1-CD2 3.93Å; F258-L283 HydrophobicContact CE2-CD2 3.81Å; F258-L283 HydrophobicContact CZ-CD2 3.45Å; F258-L283 VanDerWaalsContact CZ-CD2 3.45Å; T259-L283 PolarHBondContact N-O 3.41Å; T259-L283 PolarHBondContact OG1-O 3.28Å; T259-L283 VanDerWaalsContact OG1-O 3.1Å; R279-L283 PolarHBondContact O-N 3.37Å; L280-L283 WeakPolarHBondContact O-CD2 3.39Å
284	S	93.4	Very high	92.8	Very high	20 Å²	20	33.8 Å²	33.8	14%	0.14	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	151.1	178.9	-49.7	0	0	0	0	110.5	T259 R279 S282	T259-S284 CarbonylContact O-C 3.58Å; T259-S284 VanDerWaalsContact O-CA 3.26Å; T259-S284 WeakPolarHBondContact O-CA 3.47Å; T259-S284 WeakPolarHBondContact OG1-CB 3.32Å; T259-S284 PolarHBondContact OG1-OG 3.09Å; R279-S284 WeakPolarHBondContact CB-O 3.14Å; R279-S284 VanDerWaalsContact CD-O 3.3Å; R279-S284 WeakPolarHBondContact CD-O 3.37Å; R279-S284 PolarHBondContact O-N 3.08Å; S282-S284 PolarHBondContact O-N 3.08Å; S282-S284 PolarHBondContact O-OG 3.17Å; S282-S284 PolarHBondContact OG-N 2.95Å
285	A	92.7	Very high	93.1	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	146.9	175.5	0	0	0	0	0	109.5	T259 L260 D261 E290 M291 L294	T259-A285 PolarHBondContact O-N 2.94Å; L260-A285 CarbonylContact C-O 3.52Å; L260-A285 WeakPolarHBondContact CA-O 3.45Å; D261-A285 PolarHBondContact N-O 2.93Å; A285-E290 WeakPolarHBondContact CA-OE2 3.29Å; A285-E290 HydrophobicContact CB-CB 3.94Å; A285-M291 HydrophobicContact CB-CG 3.56Å; A285-M291 HydrophobicContact CB-SD 3.48Å; A285-M291 WeakPolarHBondContact CB-SD 3.39Å; A285-L294 HydrophobicContact CB-CD1 3.77Å
286	R	91.1	Very high	93.4	Very high	71 Å²	71	30.4 Å²	30.4	27%	0.268	17%	0.165	S	C	.	.	S	Bend	trans	-80.1	-38.7	-175.7	-177.7	176.4	169	-93	-2.7	113.3	D261 P262 L264 T266 E290	D261-R286 WeakPolarHBondContact O-CA 3.27Å; P262-R286 WeakPolarHBondContact CA-O 3.46Å; L264-R286 HydrophobicContact CB-CB 3.96Å; L264-R286 HydrophobicContact CB-CG 4.05Å; L264-R286 HydrophobicContact CD1-CB 4.23Å; L264-R286 VanDerWaalsContact O-CD 3.24Å; L264-R286 WeakPolarHBondContact O-CD 3.2Å; L264-R286 PolarHBondContact O-NE 3.11Å; T266-R286 VanDerWaalsContact OG1-CZ 3.3Å; T266-R286 PolarHBondContact OG1-NE 3.41Å; T266-R286 PolarHBondContact OG1-NH2 3.32Å; R286-E290 WeakPolarHBondContact CB-OE2 3.28Å; R286-E290 PolarHBondContact N-OE2 2.81Å
287	D	90.3	Very high	93.6	Very high	50 Å²	50	30.3 Å²	30.3	27%	0.267	16%	0.164	S	C	.	.	S	Bend	trans	-146.8	174.5	-171.9	54.5	53.7	0	0	0	111.6	Q289 E290 M291	D287-Q289 PolarHBondContact O-N 3.5Å; D287-Q289 WeakPolarHBondContact OD1-CA 3.46Å; D287-Q289 VanDerWaalsContact OD1-CB 3.25Å; D287-Q289 WeakPolarHBondContact OD1-CB 3.28Å; D287-Q289 PolarHBondContact OD1-N 2.64Å; D287-E290 PolarHBondContact O-N 3.08Å; D287-E290 PolarHBondContact OD1-N 2.69Å; D287-M291 PolarHBondContact O-N 3.48Å; D287-M291 VanDerWaalsContact O-N 3.09Å
288	H	90.9	Very high	93.8	Very high	23 Å²	23	26.4 Å²	26.4	11%	0.106	15%	0.146	C	C	.	.	H	α-helix	trans	-54.6	-34.1	177.5	-170.1	93.2	0	0	0	112.6	M291 T292 E511 D527 E529	H288-M291 PolarHBondContact O-N 2.84Å; H288-T292 WeakPolarHBondContact O-CB 3.27Å; H288-T292 PolarHBondContact O-N 3Å; H288-T292 PolarHBondContact O-OG1 2.74Å; H288-E511 PolarHBondContact CD2-O 3.23Å; H288-E511 PolarHBondContact NE2-O 2.68Å; H288-D527 IonicContact CE1-OD1 2.7Å; H288-E529 IonicContact CE1-OE1 2.79Å; H288-E529 IonicContact CG-OE1 3.18Å; H288-E529 IonicContact ND1-OE1 3.42Å; H288-E529 PolarHBondContact ND1-OE1 3.31Å
289	Q	91.9	Very high	94	Very high	58 Å²	58	21.7 Å²	21.7	27%	0.271	13%	0.128	S	C	.	.	H	α-helix	trans	-73.9	-45.1	-173.3	-151.2	-134.8	-78.8	0	0	110.6	R213 D287 M291 T292 H293 E511	R213-Q289 VanDerWaalsContact CZ-OE1 3.28Å; R213-Q289 VanDerWaalsContact NH1-NE2 3.15Å; D287-Q289 PolarHBondContact O-N 3.5Å; D287-Q289 WeakPolarHBondContact OD1-CA 3.46Å; D287-Q289 VanDerWaalsContact OD1-CB 3.25Å; D287-Q289 WeakPolarHBondContact OD1-CB 3.28Å; D287-Q289 PolarHBondContact OD1-N 2.64Å; Q289-M291 VanDerWaalsContact C-N 3.35Å; Q289-T292 PolarHBondContact O-N 2.86Å; Q289-H293 PolarHBondContact NE2-CE1 2.8Å; Q289-H293 PolarHBondContact NE2-NE2 2.68Å; Q289-H293 PolarHBondContact O-N 2.75Å; Q289-E511 HydrophobicContact CG-CG 4.1Å; Q289-E511 WeakPolarHBondContact CG-OE2 3.45Å
290	E	92.7	Very high	94.1	Very high	15 Å²	15	22.3 Å²	22.3	7%	0.07	13%	0.13	C	C	.	.	H	α-helix	trans	-60.3	-41.9	169.6	-71.5	-172.8	177.6	0	0	111.7	R279 A285 R286 D287 H293 L294	R279-E290 WeakPolarHBondContact CD-OE2 3.43Å; R279-E290 IonicContact CZ-OE1 2.66Å; R279-E290 IonicContact CZ-OE2 3.7Å; R279-E290 VanDerWaalsContact NE-CD 3.29Å; R279-E290 IonicContact NE-OE1 3.3Å; R279-E290 PolarHBondContact NE-OE1 3.45Å; R279-E290 IonicContact NE-OE2 2.85Å; R279-E290 PolarHBondContact NE-OE2 3.21Å; R279-E290 IonicContact NH2-OE1 2.7Å; R279-E290 PolarHBondContact NH2-OE1 3.02Å; R279-E290 IonicContact NH2-OE2 2.73Å; R279-E290 PolarHBondContact NH2-OE2 2.63Å; A285-E290 WeakPolarHBondContact CA-OE2 3.29Å; A285-E290 HydrophobicContact CB-CB 3.94Å; R286-E290 WeakPolarHBondContact CB-OE2 3.28Å; R286-E290 PolarHBondContact N-OE2 2.81Å; D287-E290 PolarHBondContact O-N 3.08Å; D287-E290 PolarHBondContact OD1-N 2.69Å; E290-H293 PolarHBondContact O-N 2.95Å; E290-L294 WeakPolarHBondContact O-CB 3.46Å; E290-L294 WeakPolarHBondContact O-CD1 3.39Å; E290-L294 VanDerWaalsContact O-CG 3.22Å; E290-L294 WeakPolarHBondContact O-CG 3.41Å; E290-L294 PolarHBondContact O-N 3.34Å
291	M	94	Very high	94.1	Very high	15 Å²	15	23 Å²	23	7%	0.074	14%	0.135	C	C	.	.	H	α-helix	trans	-60.7	-44.8	175.7	-76.4	-67.2	-90.5	0	0	112.7	F254 F258 L260 A285 D287 H288 Q289 L294 F295 V528	F254-M291 HydrophobicContact CD1-CE 4.36Å; F254-M291 HydrophobicContact CE1-CE 3.62Å; F254-M291 HydrophobicContact CE1-SD 4.01Å; F254-M291 HydrophobicContact CZ-CE 4.2Å; F254-M291 HydrophobicContact CZ-SD 4Å; F258-M291 HydrophobicContact CB-CE 4.11Å; F258-M291 HydrophobicContact CB-SD 4Å; L260-M291 HydrophobicContact CD1-CG 4.12Å; A285-M291 HydrophobicContact CB-CG 3.56Å; A285-M291 HydrophobicContact CB-SD 3.48Å; A285-M291 WeakPolarHBondContact CB-SD 3.39Å; D287-M291 PolarHBondContact O-N 3.48Å; D287-M291 VanDerWaalsContact O-N 3.09Å; H288-M291 PolarHBondContact O-N 2.84Å; Q289-M291 VanDerWaalsContact C-N 3.35Å; M291-L294 PolarHBondContact O-N 2.94Å; M291-F295 WeakPolarHBondContact O-CB 3.31Å; M291-F295 PolarHBondContact O-N 3.3Å; M291-V528 HydrophobicContact CB-CB 4.26Å; M291-V528 HydrophobicContact CB-CG2 3.77Å
292	T	95.4	Very high	94.2	Very high	0 Å²	0	20.9 Å²	20.9	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-62.8	-42.9	177.6	-76.5	0	0	0	0	111.7	H288 Q289 L296 L308 E511 L513 V528	H288-T292 WeakPolarHBondContact O-CB 3.27Å; H288-T292 PolarHBondContact O-N 3Å; H288-T292 PolarHBondContact O-OG1 2.74Å; Q289-T292 PolarHBondContact O-N 2.86Å; T292-L296 WeakPolarHBondContact O-CB 3.36Å; T292-L296 PolarHBondContact O-N 2.99Å; T292-L308 HydrophobicContact CG2-CD1 3.96Å; T292-E511 HydrophobicContact CG2-CB 4.23Å; T292-E511 PolarHBondContact OG1-O 3.07Å; T292-E511 VanDerWaalsContact OG1-O 3.13Å; T292-L513 HydrophobicContact CG2-CD2 3.65Å; T292-L513 HydrophobicContact CG2-CG 4.07Å; T292-V528 WeakPolarHBondContact OG1-CG2 3.4Å
293	H	95.6	Very high	94.2	Very high	11 Å²	11	24.2 Å²	24.2	5%	0.051	12%	0.117	C	C	.	.	H	α-helix	trans	-61.3	-47.4	173.3	-73.6	-179	0	0	0	112.7	L276 Q289 E290 F295 L296 L297 E511	L276-H293 HydrophobicContact CD2-CB 3.99Å; Q289-H293 PolarHBondContact NE2-CE1 2.8Å; Q289-H293 PolarHBondContact NE2-NE2 2.68Å; Q289-H293 PolarHBondContact O-N 2.75Å; E290-H293 PolarHBondContact O-N 2.95Å; H293-F295 PolarHBondContact O-N 3.36Å; H293-L296 WeakPolarHBondContact O-CB 3.37Å; H293-L296 PolarHBondContact O-N 3.14Å; H293-L297 PolarHBondContact O-N 3.34Å; H293-L297 VanDerWaalsContact O-N 3.14Å; H293-E511 IonicContact CD2-OE2 3.44Å; H293-E511 IonicContact NE2-OE2 3.75Å; H293-E511 PolarHBondContact NE2-OE2 3.37Å
294	L	96.2	Very high	94.1	Very high	0 Å²	0	22.4 Å²	22.4	0%	0	11%	0.107	C	C	.	.	H	α-helix	trans	-62.9	-42.9	-179.2	-70.6	163	0	0	0	111.4	F254 F258 L276 R279 L280 A285 E290 M291 L296 L297 F298	F254-L294 HydrophobicContact CE2-CB 4.09Å; F254-L294 HydrophobicContact CZ-CB 3.95Å; F258-L294 HydrophobicContact CD1-CD1 4.03Å; F258-L294 HydrophobicContact CE1-CD1 4.16Å; F258-L294 HydrophobicContact CE1-CD2 4.35Å; L276-L294 HydrophobicContact CD2-CD2 4.3Å; L276-L294 HydrophobicContact CD2-CG 4.44Å; R279-L294 HydrophobicContact CB-CD1 3.93Å; R279-L294 HydrophobicContact CB-CD2 4.02Å; R279-L294 HydrophobicContact CB-CG 4.5Å; L280-L294 HydrophobicContact CD2-CD2 3.68Å; L280-L294 HydrophobicContact CG-CD2 3.72Å; A285-L294 HydrophobicContact CB-CD1 3.77Å; E290-L294 WeakPolarHBondContact O-CB 3.46Å; E290-L294 WeakPolarHBondContact O-CD1 3.39Å; E290-L294 VanDerWaalsContact O-CG 3.22Å; E290-L294 WeakPolarHBondContact O-CG 3.41Å; E290-L294 PolarHBondContact O-N 3.34Å; M291-L294 PolarHBondContact O-N 2.94Å; L294-L296 VanDerWaalsContact C-N 3.33Å; L294-L296 PolarHBondContact O-N 3.49Å; L294-L297 WeakPolarHBondContact O-CB 3.33Å; L294-L297 PolarHBondContact O-N 3.02Å; L294-F298 WeakPolarHBondContact O-CD2 3.48Å; L294-F298 PolarHBondContact O-N 2.9Å
295	F	97	Very high	94.1	Very high	2 Å²	2	23.5 Å²	23.5	1%	0.009	11%	0.11	C	C	.	.	H	α-helix	trans	-66.5	-34.7	177	-166.7	-120.1	0	0	0	112.5	L250 L251 F254 M291 H293 L297 F298 L299 L513 V526 V528	L250-F295 HydrophobicContact CD2-CE2 4.38Å; L250-F295 HydrophobicContact CD2-CZ 4.41Å; L250-F295 HydrophobicContact CG-CE2 4.14Å; L250-F295 HydrophobicContact CG-CZ 4.44Å; L251-F295 HydrophobicContact CB-CE2 4.32Å; L251-F295 HydrophobicContact CB-CZ 3.86Å; L251-F295 HydrophobicContact CD1-CD1 4.34Å; L251-F295 HydrophobicContact CD1-CD2 4.43Å; L251-F295 HydrophobicContact CD1-CE1 4.03Å; L251-F295 HydrophobicContact CD1-CE2 4.11Å; L251-F295 HydrophobicContact CD1-CZ 3.91Å; L251-F295 HydrophobicContact CG-CZ 4.43Å; F254-F295 HydrophobicContact CB-CD2 3.8Å; F254-F295 HydrophobicContact CB-CE2 3.86Å; F254-F295 HydrophobicContact CD1-CB 4.19Å; F254-F295 AromaticContact CD1-CD2 3.62Å; F254-F295 HydrophobicContact CD1-CD2 3.62Å; F254-F295 HydrophobicContact CD1-CE2 4.36Å; F254-F295 HydrophobicContact CD1-CG 4.14Å; F254-F295 AromaticContact CD2-CD2 3.82Å; F254-F295 HydrophobicContact CD2-CD2 3.82Å; F254-F295 HydrophobicContact CE1-CB 3.8Å; F254-F295 HydrophobicContact CE1-CD2 4.12Å; F254-F295 HydrophobicContact CE1-CG 4.25Å; F254-F295 HydrophobicContact CE2-CB 4.23Å; F254-F295 HydrophobicContact CE2-CD2 4.3Å; F254-F295 AromaticContact CG-CD2 3.46Å; F254-F295 HydrophobicContact CG-CD2 3.46Å; F254-F295 VanDerWaalsContact CG-CD2 3.46Å; F254-F295 HydrophobicContact CG-CE2 4.05Å; F254-F295 HydrophobicContact CG-CG 4.36Å; F254-F295 HydrophobicContact CZ-CB 3.82Å; F254-F295 HydrophobicContact CZ-CD2 4.44Å; M291-F295 WeakPolarHBondContact O-CB 3.31Å; M291-F295 PolarHBondContact O-N 3.3Å; H293-F295 PolarHBondContact O-N 3.36Å; F295-L297 VanDerWaalsContact C-N 3.33Å; F295-L297 PolarHBondContact O-N 2.83Å; F295-F298 PolarHBondContact O-N 2.74Å; F295-L299 HydrophobicContact CD1-CD1 3.82Å; F295-L299 HydrophobicContact CD1-CG 4.35Å; F295-L299 HydrophobicContact CE1-CD1 3.69Å; F295-L299 HydrophobicContact CE1-CD2 4.21Å; F295-L299 HydrophobicContact CE1-CG 4.08Å; F295-L299 HydrophobicContact CZ-CD1 4.39Å; F295-L299 HydrophobicContact CZ-CD2 4.14Å; F295-L299 HydrophobicContact CZ-CG 4.31Å; F295-L299 WeakPolarHBondContact O-CG 3.48Å; F295-L299 PolarHBondContact O-N 2.72Å; F295-L299 VanDerWaalsContact O-N 3.09Å; F295-L513 HydrophobicContact CD1-CD1 3.89Å; F295-V526 HydrophobicContact CD1-CG1 4.49Å; F295-V526 HydrophobicContact CE1-CG1 3.78Å; F295-V528 HydrophobicContact CB-CG1 3.7Å; F295-V528 HydrophobicContact CD1-CG1 4.06Å; F295-V528 HydrophobicContact CG-CG1 4.11Å
296	L	97.1	Very high	94.2	Very high	0 Å²	0	23.5 Å²	23.5	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-61.8	-38.4	174	-177.7	56.3	0	0	0	112.4	C217 T292 H293 L294 L299 R300 C306 L308 L513	C217-L296 HydrophobicContact CB-CD2 3.7Å; C217-L296 HydrophobicContact CB-CG 4.07Å; T292-L296 WeakPolarHBondContact O-CB 3.36Å; T292-L296 PolarHBondContact O-N 2.99Å; H293-L296 WeakPolarHBondContact O-CB 3.37Å; H293-L296 PolarHBondContact O-N 3.14Å; L294-L296 VanDerWaalsContact C-N 3.33Å; L294-L296 PolarHBondContact O-N 3.49Å; L296-L299 PolarHBondContact O-N 2.88Å; L296-R300 HydrophobicContact CD1-CG 4.15Å; L296-R300 WeakPolarHBondContact O-CB 3.31Å; L296-R300 WeakPolarHBondContact O-CG 3.5Å; L296-R300 PolarHBondContact O-N 3.08Å; L296-C306 HydrophobicContact CD1-CB 3.77Å; L296-L308 HydrophobicContact CD2-CB 3.88Å; L296-L308 HydrophobicContact CD2-CD1 4.31Å; L296-L308 HydrophobicContact CD2-CD2 4.47Å; L296-L308 HydrophobicContact CD2-CG 4.44Å; L296-L513 HydrophobicContact CB-CD1 3.84Å; L296-L513 HydrophobicContact CB-CD2 4Å; L296-L513 HydrophobicContact CD1-CD1 4.22Å; L296-L513 HydrophobicContact CD1-CD2 4.09Å; L296-L513 HydrophobicContact CD2-CD2 4.07Å; L296-L513 HydrophobicContact CG-CD2 4.28Å
297	L	97	Very high	94.5	Very high	0 Å²	0	20.5 Å²	20.5	0%	0	10%	0.099	C	C	.	.	H	α-helix	trans	-61	-42.3	174.1	-71.3	171.3	0	0	0	112.1	C217 L222 L223 A226 L276 L280 H293 L294 F295 R300 S301	C217-L297 HydrophobicContact CB-CD2 4.38Å; L222-L297 HydrophobicContact CB-CD1 4.15Å; L222-L297 HydrophobicContact CB-CD2 3.8Å; L222-L297 HydrophobicContact CD2-CD1 4.45Å; L223-L297 HydrophobicContact CD2-CB 4.48Å; L223-L297 HydrophobicContact CD2-CD2 3.75Å; L223-L297 WeakPolarHBondContact CD2-O 3.46Å; L223-L297 HydrophobicContact CG-CD2 4.38Å; A226-L297 HydrophobicContact CB-CB 4.01Å; L276-L297 HydrophobicContact CD1-CD1 4.45Å; L280-L297 HydrophobicContact CD1-CD1 4.12Å; H293-L297 PolarHBondContact O-N 3.34Å; H293-L297 VanDerWaalsContact O-N 3.14Å; L294-L297 WeakPolarHBondContact O-CB 3.33Å; L294-L297 PolarHBondContact O-N 3.02Å; F295-L297 VanDerWaalsContact C-N 3.33Å; F295-L297 PolarHBondContact O-N 2.83Å; L297-R300 PolarHBondContact O-N 3.18Å; L297-S301 WeakPolarHBondContact O-CB 3.37Å; L297-S301 PolarHBondContact O-N 2.68Å; L297-S301 PolarHBondContact O-OG 2.94Å
298	F	96.3	Very high	94.8	Very high	0 Å²	0	18.1 Å²	18.1	0%	0	9%	0.086	C	C	.	.	H	α-helix	trans	-66.7	-37.3	176.3	-72.7	-72.6	0	0	0	113.3	A226 L229 L230 W253 F254 F258 L280 L294 F295 S301 L302	A226-F298 HydrophobicContact CB-CD1 4.03Å; A226-F298 HydrophobicContact CB-CE1 4.1Å; A226-F298 HydrophobicContact CB-CG 4.44Å; A226-F298 HydrophobicContact CB-CZ 4.48Å; A226-F298 WeakPolarHBondContact O-CD1 3.47Å; A226-F298 WeakPolarHBondContact O-CE1 3.47Å; L229-F298 HydrophobicContact CB-CE1 3.99Å; L229-F298 HydrophobicContact CB-CZ 4.19Å; L229-F298 HydrophobicContact CD1-CZ 4.36Å; L230-F298 HydrophobicContact CB-CD1 4.17Å; L230-F298 HydrophobicContact CB-CE1 4.34Å; L230-F298 HydrophobicContact CD1-CB 4.12Å; L230-F298 HydrophobicContact CD1-CD1 3.62Å; L230-F298 HydrophobicContact CD1-CG 4.29Å; L230-F298 HydrophobicContact CG-CD1 4.46Å; W253-F298 HydrophobicContact CH2-CD1 4.1Å; W253-F298 AromaticContact CH2-CE1 3.7Å; W253-F298 HydrophobicContact CH2-CE1 3.7Å; W253-F298 HydrophobicContact CH2-CZ 4.03Å; W253-F298 HydrophobicContact CZ3-CD1 4.16Å; W253-F298 HydrophobicContact CZ3-CE1 4.21Å; W253-F298 HydrophobicContact CZ3-CG 4.41Å; F254-F298 AromaticContact CD2-CD2 3.81Å; F254-F298 HydrophobicContact CD2-CD2 3.81Å; F254-F298 AromaticContact CD2-CE2 3.91Å; F254-F298 HydrophobicContact CD2-CE2 3.91Å; F254-F298 AromaticContact CE2-CD2 3.83Å; F254-F298 HydrophobicContact CE2-CD2 3.83Å; F254-F298 AromaticContact CE2-CE2 3.79Å; F254-F298 HydrophobicContact CE2-CE2 3.79Å; F258-F298 HydrophobicContact CD2-CE2 4.32Å; F258-F298 AromaticContact CE2-CE2 3.39Å; F258-F298 HydrophobicContact CE2-CE2 3.39Å; F258-F298 AromaticContact CE2-CZ 3.5Å; F258-F298 HydrophobicContact CE2-CZ 3.5Å; F258-F298 VanDerWaalsContact CE2-CZ 3.5Å; F258-F298 AromaticContact CZ-CE2 3.51Å; F258-F298 HydrophobicContact CZ-CE2 3.51Å; F258-F298 AromaticContact CZ-CZ 3.61Å; F258-F298 HydrophobicContact CZ-CZ 3.61Å; L280-F298 HydrophobicContact CD2-CE2 4.21Å; L280-F298 HydrophobicContact CD2-CZ 4.22Å; L294-F298 WeakPolarHBondContact O-CD2 3.48Å; L294-F298 PolarHBondContact O-N 2.9Å; F295-F298 PolarHBondContact O-N 2.74Å; F298-S301 PolarHBondContact O-OG 3.31Å; F298-L302 WeakPolarHBondContact O-CG 3.11Å; F298-L302 PolarHBondContact O-N 3.43Å
299	L	96	Very high	95.1	Very high	0 Å²	0	17 Å²	17	0%	0	8%	0.081	C	C	.	.	H	α-helix	trans	-68.5	-37.8	175.7	-66.1	168.2	0	0	0	111.8	L247 L250 F295 L296 Q303 L304 L513 V515	L247-L299 HydrophobicContact CD2-CD2 3.87Å; L250-L299 HydrophobicContact CD2-CD2 3.82Å; F295-L299 HydrophobicContact CD1-CD1 3.82Å; F295-L299 HydrophobicContact CD1-CG 4.35Å; F295-L299 HydrophobicContact CE1-CD1 3.69Å; F295-L299 HydrophobicContact CE1-CD2 4.21Å; F295-L299 HydrophobicContact CE1-CG 4.08Å; F295-L299 HydrophobicContact CZ-CD1 4.39Å; F295-L299 HydrophobicContact CZ-CD2 4.14Å; F295-L299 HydrophobicContact CZ-CG 4.31Å; F295-L299 WeakPolarHBondContact O-CG 3.48Å; F295-L299 PolarHBondContact O-N 2.72Å; F295-L299 VanDerWaalsContact O-N 3.09Å; L296-L299 PolarHBondContact O-N 2.88Å; L299-Q303 PolarHBondContact O-N 3.07Å; L299-L304 HydrophobicContact CB-CD1 4.49Å; L299-L304 HydrophobicContact CD2-CD1 3.81Å; L299-L304 VanDerWaalsContact O-CB 3.31Å; L299-L304 WeakPolarHBondContact O-CB 3.32Å; L299-L304 WeakPolarHBondContact O-CG 3.01Å; L299-L304 PolarHBondContact O-N 2.57Å; L299-L304 VanDerWaalsContact O-N 3.1Å; L299-L513 HydrophobicContact CD1-CD1 3.6Å; L299-V515 HydrophobicContact CD1-CG2 3.83Å; L299-V515 HydrophobicContact CD2-CG2 4.3Å
300	R	95.3	Very high	95.2	Very high	20 Å²	20	14.4 Å²	14.4	8%	0.075	7%	0.069	C	C	.	.	H	α-helix	trans	-77.5	-30.3	178	-75.4	177.3	174	175	2.3	113.5	N214 C217 S218 L223 L296 L297 L302 Q303 C306	N214-R300 PolarHBondContact O-NH1 3.02Å; N214-R300 PolarHBondContact OD1-NH2 2.99Å; C217-R300 WeakPolarHBondContact O-CD 3.36Å; C217-R300 PolarHBondContact O-NH1 3.25Å; S218-R300 PolarHBondContact OG-NH1 3.14Å; L223-R300 HydrophobicContact CD2-CB 3.56Å; L296-R300 HydrophobicContact CD1-CG 4.15Å; L296-R300 WeakPolarHBondContact O-CB 3.31Å; L296-R300 WeakPolarHBondContact O-CG 3.5Å; L296-R300 PolarHBondContact O-N 3.08Å; L297-R300 PolarHBondContact O-N 3.18Å; R300-L302 VanDerWaalsContact C-N 3.3Å; R300-Q303 VanDerWaalsContact O-CA 3.29Å; R300-Q303 WeakPolarHBondContact O-CA 3.38Å; R300-Q303 PolarHBondContact O-N 3.38Å; R300-C306 HydrophobicContact CG-CB 4.48Å; R300-C306 PolarHBondContact NH2-O 3.23Å
301	S	94.9	Very high	95.4	Very high	14 Å²	14	14.1 Å²	14.1	10%	0.098	7%	0.068	C	C	.	.	H	α-helix	trans	-69.6	-30.6	173.5	74.2	0	0	0	0	112	L223 L297 F298 Q303	L223-S301 VanDerWaalsContact O-CB 3.26Å; L223-S301 WeakPolarHBondContact O-CB 3.39Å; L297-S301 WeakPolarHBondContact O-CB 3.37Å; L297-S301 PolarHBondContact O-N 2.68Å; L297-S301 PolarHBondContact O-OG 2.94Å; F298-S301 PolarHBondContact O-OG 3.31Å; S301-Q303 PolarHBondContact O-N 3.01Å
302	L	93.9	Very high	95.4	Very high	24 Å²	24	13.9 Å²	13.9	13%	0.126	7%	0.067	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72	0.9	163.9	-74.5	171.3	0	0	0	114.2	L230 Y246 L250 F298 R300 L304	L230-L302 HydrophobicContact CD1-CD1 3.98Å; L230-L302 HydrophobicContact CD1-CG 4.14Å; L230-L302 HydrophobicContact CD2-CD1 4.44Å; L230-L302 HydrophobicContact CD2-CD2 3.84Å; L230-L302 HydrophobicContact CD2-CG 4.23Å; Y246-L302 HydrophobicContact CE1-CD1 4.27Å; Y246-L302 WeakPolarHBondContact OH-CD1 3.29Å; L250-L302 HydrophobicContact CD1-CD1 4.36Å; L250-L302 HydrophobicContact CD2-CD1 3.69Å; F298-L302 WeakPolarHBondContact O-CG 3.11Å; F298-L302 PolarHBondContact O-N 3.43Å; R300-L302 VanDerWaalsContact C-N 3.3Å; L302-L304 VanDerWaalsContact C-N 3.27Å; L302-L304 HydrophobicContact CB-CD1 4.29Å; L302-L304 HydrophobicContact CB-CD2 4.5Å; L302-L304 HydrophobicContact CB-CG 3.95Å; L302-L304 HydrophobicContact CD1-CD1 4.49Å; L302-L304 PolarHBondContact O-N 3.44Å
303	Q	92.3	Very high	95.2	Very high	128 Å²	128	16.5 Å²	16.5	60%	0.598	8%	0.079	S	C	*	.	T	Hydrogen-bonded Turn	trans	58.3	34.3	179.1	-53.1	176.3	-13.4	0	0	113.8	R239 L299 R300 S301	R239-Q303 VanDerWaalsContact NH2-CB 3.28Å; L299-Q303 PolarHBondContact O-N 3.07Å; R300-Q303 VanDerWaalsContact O-CA 3.29Å; R300-Q303 WeakPolarHBondContact O-CA 3.38Å; R300-Q303 PolarHBondContact O-N 3.38Å; S301-Q303 PolarHBondContact O-N 3.01Å
304	L	93.1	Very high	95.1	Very high	19 Å²	19	16.4 Å²	16.4	10%	0.099	8%	0.08	C	C	.	.			trans	-81.1	146.5	173.8	-51.7	-179.4	0	0	0	110.6	I242 L247 L299 L302 C306 V515	I242-L304 HydrophobicContact CD1-CD2 3.56Å; L247-L304 HydrophobicContact CD2-CD1 4.21Å; L299-L304 HydrophobicContact CB-CD1 4.49Å; L299-L304 HydrophobicContact CD2-CD1 3.81Å; L299-L304 VanDerWaalsContact O-CB 3.31Å; L299-L304 WeakPolarHBondContact O-CB 3.32Å; L299-L304 WeakPolarHBondContact O-CG 3.01Å; L299-L304 PolarHBondContact O-N 2.57Å; L299-L304 VanDerWaalsContact O-N 3.1Å; L302-L304 VanDerWaalsContact C-N 3.27Å; L302-L304 HydrophobicContact CB-CD1 4.29Å; L302-L304 HydrophobicContact CB-CD2 4.5Å; L302-L304 HydrophobicContact CB-CG 3.95Å; L302-L304 HydrophobicContact CD1-CD1 4.49Å; L302-L304 PolarHBondContact O-N 3.44Å; L304-C306 PolarHBondContact O-N 3.33Å; L304-C306 PolarHBondContact O-SG 3.34Å; L304-V515 HydrophobicContact CB-CG1 4.28Å; L304-V515 HydrophobicContact CD1-CG1 4.41Å
305	F	92.9	Very high	94.9	Very high	43 Å²	43	19.9 Å²	19.9	19%	0.189	10%	0.101	C	C	.	.			trans	-81.3	103.4	178.6	-168.5	-127.2	0	0	0	109.7	Y516 W523 D553	F305-Y516 HydrophobicContact CD1-CG 4.49Å; F305-Y516 PolarHBondContact O-N 2.99Å; F305-W523 AromaticContact CD1-CH2 3.36Å; F305-W523 HydrophobicContact CD1-CH2 3.36Å; F305-W523 AromaticContact CD1-CZ2 3.7Å; F305-W523 HydrophobicContact CD1-CZ2 3.7Å; F305-W523 HydrophobicContact CD1-CZ3 4.32Å; F305-W523 AromaticContact CE1-CH2 3.44Å; F305-W523 HydrophobicContact CE1-CH2 3.44Å; F305-W523 VanDerWaalsContact CE1-CH2 3.44Å; F305-W523 AromaticContact CE1-CZ2 3.46Å; F305-W523 HydrophobicContact CE1-CZ2 3.46Å; F305-W523 VanDerWaalsContact CE1-CZ2 3.46Å; F305-W523 HydrophobicContact CG-CH2 4.19Å; F305-W523 HydrophobicContact CZ-CH2 4.3Å; F305-W523 HydrophobicContact CZ-CZ2 4.47Å; F305-W523 WeakPolarHBondContact O-CZ3 3.03Å; F305-D553 HydrophobicContact CE2-CB 4.46Å; F305-D553 HydrophobicContact CZ-CB 4.41Å
306	C	95.3	Very high	94.6	Very high	1 Å²	1	24.2 Å²	24.2	1%	0.007	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	134.8	-167	-61.5	0	0	0	0	113.2	L296 R300 L304 E514 G554	L296-C306 HydrophobicContact CD1-CB 3.77Å; R300-C306 HydrophobicContact CG-CB 4.48Å; R300-C306 PolarHBondContact NH2-O 3.23Å; L304-C306 PolarHBondContact O-N 3.33Å; L304-C306 PolarHBondContact O-SG 3.34Å; C306-E514 CarbonylContact C-O 3.56Å; C306-E514 VanDerWaalsContact CA-O 3.32Å; C306-E514 WeakPolarHBondContact CA-O 3.42Å; C306-G554 PolarHBondContact O-N 3.17Å
307	R	95.8	Very high	94.2	Very high	8 Å²	8	25.8 Å²	25.8	3%	0.03	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	134.4	173.2	-76.4	165.6	174.9	174	2.4	110.5	L513 E514 W523 A551 V552 D553 D598 E601	R307-L513 WeakPolarHBondContact O-CA 3.15Å; R307-E514 HydrophobicContact CB-CB 4.25Å; R307-E514 PolarHBondContact N-O 2.92Å; R307-E514 PolarHBondContact O-N 3.47Å; R307-W523 HydrophobicContact CB-CZ3 4.28Å; R307-W523 HydrophobicContact CG-CH2 3.73Å; R307-W523 HydrophobicContact CG-CZ2 4.42Å; R307-W523 HydrophobicContact CG-CZ3 3.85Å; R307-W523 VanDerWaalsContact CZ-CE2 3.44Å; R307-W523 VanDerWaalsContact NE-CZ2 3.28Å; R307-W523 VanDerWaalsContact NH1-CE2 3.26Å; R307-W523 VanDerWaalsContact NH1-NE1 3.2Å; R307-A551 HydrophobicContact CB-CB 4.08Å; R307-A551 HydrophobicContact CG-CB 4.14Å; R307-V552 CarbonylContact C-O 3.06Å; R307-V552 VanDerWaalsContact CA-O 3.22Å; R307-V552 WeakPolarHBondContact CA-O 3.43Å; R307-D553 HydrophobicContact CG-CB 3.7Å; R307-D598 IonicContact CZ-OD1 3Å; R307-D598 IonicContact NH2-OD1 2.81Å; R307-D598 PolarHBondContact NH2-OD1 2.99Å; R307-E601 IonicContact CZ-OE2 3.43Å; R307-E601 IonicContact NH1-OE1 2.87Å; R307-E601 IonicContact NH1-OE2 2.73Å; R307-E601 PolarHBondContact NH1-OE2 3.48Å; R307-E601 IonicContact NH2-OE2 3.26Å
308	L	97.1	Very high	93.5	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	120.9	161.1	177.4	59	0	0	0	107.6	R213 N214 T292 L296 L310 L513 A551 V552	R213-L308 HydrophobicContact CB-CD2 4.26Å; N214-L308 HydrophobicContact CB-CD2 4.27Å; T292-L308 HydrophobicContact CG2-CD1 3.96Å; L296-L308 HydrophobicContact CD2-CB 3.88Å; L296-L308 HydrophobicContact CD2-CD1 4.31Å; L296-L308 HydrophobicContact CD2-CD2 4.47Å; L296-L308 HydrophobicContact CD2-CG 4.44Å; L308-L310 HydrophobicContact CD1-CD2 4.09Å; L308-L310 HydrophobicContact CD2-CD2 4.05Å; L308-L310 HydrophobicContact CG-CD2 3.76Å; L308-L310 HydrophobicContact CG-CG 4.19Å; L308-L513 HydrophobicContact CD1-CD2 3.76Å; L308-A551 CarbonylContact O-C 3.52Å; L308-A551 WeakPolarHBondContact O-CA 3.3Å; L308-V552 PolarHBondContact N-O 3.44Å; L308-V552 PolarHBondContact O-N 2.89Å
309	V	96.9	Very high	91.9	Very high	0 Å²	0	36 Å²	36	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	129.9	-179.4	-170.8	0	0	0	0	109.7	E511 W512 E514 V549 A551 L561 Y565	V309-E511 WeakPolarHBondContact O-CA 3.45Å; V309-W512 WeakPolarHBondContact CA-O 3.46Å; V309-W512 HydrophobicContact CB-CD2 4.42Å; V309-W512 HydrophobicContact CB-CG 4.39Å; V309-W512 HydrophobicContact CB-CZ2 4.44Å; V309-W512 WeakPolarHBondContact CB-O 3.04Å; V309-W512 HydrophobicContact CG1-CD2 4.48Å; V309-W512 HydrophobicContact CG1-CZ2 3.64Å; V309-W512 PolarHBondContact N-O 2.84Å; V309-W512 PolarHBondContact O-N 2.78Å; V309-W512 VanDerWaalsContact O-O 3.11Å; V309-E514 HydrophobicContact CG2-CB 4.31Å; V309-E514 HydrophobicContact CG2-CG 3.87Å; V309-V549 HydrophobicContact CG1-CG1 3.55Å; V309-A551 HydrophobicContact CG2-CB 4.14Å; V309-L561 HydrophobicContact CG1-CD1 4.32Å; V309-L561 HydrophobicContact CG2-CD1 4.14Å; V309-Y565 HydrophobicContact CG1-CE2 4.27Å
310	L	95.6	Very high	90	Very high	3 Å²	3	41.7 Å²	41.7	2%	0.016	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	120.9	-168.7	-55	172.9	0	0	0	109.8	L308 L312 E511 V549 V550 V552	L308-L310 HydrophobicContact CD1-CD2 4.09Å; L308-L310 HydrophobicContact CD2-CD2 4.05Å; L308-L310 HydrophobicContact CG-CD2 3.76Å; L308-L310 HydrophobicContact CG-CG 4.19Å; L310-L312 HydrophobicContact CB-CD2 3.63Å; L310-L312 HydrophobicContact CB-CG 4.49Å; L310-L312 HydrophobicContact CD1-CD2 4.43Å; L310-E511 HydrophobicContact CD2-CB 4.05Å; L310-E511 HydrophobicContact CD2-CG 3.49Å; L310-E511 VanDerWaalsContact CD2-CG 3.49Å; L310-E511 WeakPolarHBondContact CD2-OE1 3.07Å; L310-V549 CarbonylContact O-C 3.59Å; L310-V549 WeakPolarHBondContact O-CA 3.43Å; L310-V550 PolarHBondContact N-O 2.96Å; L310-V550 PolarHBondContact O-N 3.37Å; L310-V552 HydrophobicContact CD1-CG2 4.14Å
311	S	95.3	Very high	87.7	Confident	8 Å²	8	45.5 Å²	45.5	6%	0.056	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	115.4	164.4	-172.6	0	0	0	0	108.5	H313 D510 Y548	S311-H313 PolarHBondContact O-CE1 2.74Å; S311-H313 PolarHBondContact O-ND1 2.91Å; S311-H313 PolarHBondContact OG-CE1 2.77Å; S311-H313 PolarHBondContact OG-NE2 3.15Å; S311-D510 PolarHBondContact N-O 3.13Å; S311-Y548 WeakPolarHBondContact CA-O 3.25Å
312	L	94.5	Very high	85	Confident	10 Å²	10	48.4 Å²	48.4	5%	0.052	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	129.6	-175.9	-45.5	179.4	0	0	0	110.7	L203 L206 L207 L310 P314 Y548 V550	L203-L312 HydrophobicContact CD1-CB 4.08Å; L203-L312 HydrophobicContact CD1-CD1 3.84Å; L206-L312 HydrophobicContact CB-CB 4.4Å; L206-L312 HydrophobicContact CB-CD2 4.27Å; L206-L312 HydrophobicContact CD1-CB 4.3Å; L207-L312 HydrophobicContact CB-CD1 4.42Å; L207-L312 HydrophobicContact CD1-CD1 4.21Å; L310-L312 HydrophobicContact CB-CD2 3.63Å; L310-L312 HydrophobicContact CB-CG 4.49Å; L310-L312 HydrophobicContact CD1-CD2 4.43Å; L312-P314 WeakPolarHBondContact O-CD 3.49Å; L312-Y548 PolarHBondContact N-O 3.05Å; L312-V550 HydrophobicContact CD1-CB 4.43Å; L312-V550 HydrophobicContact CD1-CG2 3.93Å
313	H	92.2	Very high	82.6	Confident	56 Å²	56	54.6 Å²	54.6	26%	0.259	31%	0.305	S	S	.	.			trans	-117.2	72.2	-177.9	-51.5	81.6	0	0	0	112.2	S311 D510 T543	S311-H313 PolarHBondContact O-CE1 2.74Å; S311-H313 PolarHBondContact O-ND1 2.91Å; S311-H313 PolarHBondContact OG-CE1 2.77Å; S311-H313 PolarHBondContact OG-NE2 3.15Å; H313-D510 VanDerWaalsContact CE1-CG 3.47Å; H313-D510 IonicContact CE1-OD1 3.61Å; H313-D510 PolarHBondContact CE1-OD1 3.22Å; H313-D510 IonicContact CE1-OD2 3.79Å; H313-D510 IonicContact NE2-OD1 2.75Å; H313-T543 WeakPolarHBondContact NE2-CB 3.43Å; H313-T543 PolarHBondContact NE2-O 2.9Å
314	P	93.6	Very high	79.7	Confident	9 Å²	9	53.4 Å²	53.4	6%	0.058	31%	0.311	C	S	.	.	P	Polyproline II helix	trans	-62.1	161	172	28.4	-37.1	0	0	0	112.3	H199 H202 L203 L206 L312 P316 Y548	H199-P314 WeakPolarHBondContact CE1-CG 3.46Å; H202-P314 HydrophobicContact CB-CB 4.28Å; H202-P314 WeakPolarHBondContact ND1-CA 3.24Å; L203-P314 HydrophobicContact CB-CB 3.91Å; L203-P314 HydrophobicContact CB-CG 4.15Å; L203-P314 HydrophobicContact CD1-CG 4.11Å; L206-P314 HydrophobicContact CD1-CB 4.33Å; L312-P314 WeakPolarHBondContact O-CD 3.49Å; P314-P316 WeakPolarHBondContact O-CD 3.41Å; P314-Y548 HydrophobicContact CG-CD2 3.84Å; P314-Y548 HydrophobicContact CG-CE2 3.55Å
315	V	92	Very high	76.9	Confident	73 Å²	73	62.9 Å²	62.9	44%	0.442	35%	0.351	S	S	.	.	P	Polyproline II helix	trans	-61.8	125.9	-177.1	-174.9	0	0	0	0	109.6	H199 H202 F317	H199-V315 WeakPolarHBondContact CB-O 3.3Å; H199-V315 PolarHBondContact ND1-O 3.36Å; H202-V315 HydrophobicContact CB-CG2 4.36Å; H202-V315 WeakPolarHBondContact ND1-CG2 3.42Å; H202-V315 PolarHBondContact ND1-N 2.83Å; V315-F317 PolarHBondContact O-N 2.99Å
316	P	90.4	Very high	73.8	Confident	93 Å²	93	63.6 Å²	63.6	60%	0.604	37%	0.371	S	S	*	.	P	Polyproline II helix	trans	-59.4	120.5	-178.7	-26.3	35.5	0	0	0	112.8	P314 K318	P314-P316 WeakPolarHBondContact O-CD 3.41Å; P316-K318 WeakPolarHBondContact CB-O 3.38Å
317	F	88.7	Confident	70.8	Confident	32 Å²	32	69.2 Å²	69.2	14%	0.14	41%	0.408	C	S	.	.	S	Bend	trans	-81.5	-5.2	172.9	70.4	-90.6	0	0	0	113.2	L195 I196 H199 V315 R576 R577 V578	L195-F317 HydrophobicContact CB-CB 4.05Å; L195-F317 WeakPolarHBondContact O-CB 3.28Å; I196-F317 HydrophobicContact CD1-CD2 4.41Å; I196-F317 HydrophobicContact CG1-CB 4.21Å; I196-F317 HydrophobicContact CG1-CD2 3.59Å; I196-F317 HydrophobicContact CG1-CE2 4.15Å; I196-F317 HydrophobicContact CG1-CG 4.01Å; H199-F317 HydrophobicContact CB-CB 4.03Å; H199-F317 HydrophobicContact CB-CD1 4.05Å; H199-F317 HydrophobicContact CB-CG 4.49Å; H199-F317 AromaticContact CD2-CD1 3.95Å; H199-F317 AromaticContact CE1-CD1 3.76Å; H199-F317 AromaticContact CG-CD1 3.67Å; H199-F317 AromaticContact ND1-CD1 3.59Å; V315-F317 PolarHBondContact O-N 2.99Å; F317-R576 WeakPolarHBondContact CE1-O 3.42Å; F317-R577 WeakPolarHBondContact CZ-O 3.35Å; F317-V578 HydrophobicContact CE1-CG1 4.41Å
318	K	81.8	Confident	67.6	Low	97 Å²	97	80.9 Å²	80.9	42%	0.422	45%	0.451	S	S	.	.	S	Bend	trans	-111.1	137.9	169.9	-63	-169.1	176.1	-177.7	0	108.6	P316 K575	P316-K318 WeakPolarHBondContact CB-O 3.38Å; K318-K575 WeakPolarHBondContact CD-O 3.35Å; K318-K575 VanDerWaalsContact CE-O 3.26Å; K318-K575 WeakPolarHBondContact CE-O 3.08Å; K318-K575 PolarHBondContact NZ-O 2.85Å
319	P	63.4	Low	64.2	Low	117 Å²	117	86.9 Å²	86.9	76%	0.76	49%	0.488	S	S	*	.	P	Polyproline II helix	trans	-61.5	146.5	178.2	27	-34.5	0	0	0	110.5	S321	P319-S321 PolarHBondContact O-N 3.13Å
320	P	54.2	Low	61	Low	120 Å²	120	92.5 Å²	92.5	78%	0.779	53%	0.528	S	S	*	.	P	Polyproline II helix	trans	-63.6	123.5	169.3	28	-32.8	0	0	0	108.6	S322	P320-S322 PolarHBondContact O-N 3.44Å
321	S	48.8	Very low	57.7	Low	101 Å²	101	99.5 Å²	99.5	71%	0.706	57%	0.571	S	S	*	*	P	Polyproline II helix	trans	-56.4	128.7	178.7	56.4	0	0	0	0	110.6	P319 K323	P319-S321 PolarHBondContact O-N 3.13Å; S321-K323 PolarHBondContact O-N 2.95Å
322	S	37.9	Very low	54.3	Low	75 Å²	75	102.7 Å²	102.7	52%	0.524	61%	0.605	S	S	.	*	S	Bend	trans	-69.3	42.2	-171.8	41.5	0	0	0	0	114.9	E137 P320	E137-S322 PolarHBondContact OE2-OG 3.06Å; P320-S322 PolarHBondContact O-N 3.44Å
323	K	42.4	Very low	51	Low	154 Å²	154	106.9 Å²	106.9	67%	0.67	64%	0.641	S	S	*	*			trans	-118.6	35.4	-175.8	-75.4	159.8	-178	156.9	0	112.7	E136 S321	E136-K323 VanDerWaalsContact CD-NZ 3.27Å; E136-K323 IonicContact OE1-NZ 3.67Å; E136-K323 PolarHBondContact OE1-NZ 3.37Å; E136-K323 IonicContact OE2-NZ 3.02Å; E136-K323 PolarHBondContact OE2-NZ 3.32Å; S321-K323 PolarHBondContact O-N 2.95Å
324	S	31.7	Very low	48.3	Very low	103 Å²	103	109.8 Å²	109.8	72%	0.72	67%	0.665	S	S	*	*	S	Bend	trans	-114	120	158.4	56.4	0	0	0	0	109.6	G326	S324-G326 PolarHBondContact O-N 2.99Å; S324-G326 VanDerWaalsContact O-N 3.08Å
325	K	35.3	Very low	44.9	Very low	217 Å²	217	116.7 Å²	116.7	94%	0.943	70%	0.697	S	S	*	*			trans	-64.5	110.6	178	-69.2	-178.2	177.8	-179.3	0	110.1
326	G	27.4	Very low	41.5	Very low	58 Å²	58	123 Å²	123	60%	0.598	71%	0.712	S	S	*	*			trans	-62.3	152.3	172.3	0	0	0	0	0	112	S324	S324-G326 PolarHBondContact O-N 2.99Å; S324-G326 VanDerWaalsContact O-N 3.08Å
327	P	32.4	Very low	38.1	Very low	120 Å²	120	123.8 Å²	123.8	78%	0.779	72%	0.719	S	S	*	*			trans	-58.3	142.8	169.1	-20.2	32.5	0	0	0	110.6	T329	P327-T329 PolarHBondContact O-N 2.84Å
328	R	28.9	Very low	35	Very low	252 Å²	252	130.6 Å²	130.6	95%	0.951	75%	0.751	S	S	*	*			trans	-72.2	90.2	176.1	-77.7	-179.4	166.1	-177.2	-6	110.9
329	T	26	Very low	32.1	Very low	126 Å²	126	131.3 Å²	131.3	77%	0.773	76%	0.764	S	S	*	*			trans	-90.9	100.8	163.2	51.3	0	0	0	0	109.2	P327 T331	P327-T329 PolarHBondContact O-N 2.84Å; T329-T331 PolarHBondContact O-N 3.34Å
330	S	29.6	Very low	30.2	Very low	118 Å²	118	130.5 Å²	130.5	83%	0.825	76%	0.761	S	S	*	*			trans	-71.4	117.7	176.7	50.7	0	0	0	0	111.2
331	T	25.4	Very low	28.9	Very low	151 Å²	151	132.5 Å²	132.5	93%	0.926	76%	0.76	S	S	*	*			trans	-68.9	133.2	172.4	-4.7	0	0	0	0	110.9	T329	T329-T331 PolarHBondContact O-N 3.34Å
332	G	23.6	Very low	27.6	Very low	75 Å²	75	135 Å²	135	77%	0.773	76%	0.761	S	S	*	*			trans	-160.2	127.4	173.1	0	0	0	0	0	110.4
333	A	25	Very low	26.9	Very low	98 Å²	98	137 Å²	137	81%	0.81	78%	0.775	S	S	*	*			trans	-162.5	157.2	-177.1	0	0	0	0	0	110.1
334	P	36.8	Very low	26.1	Very low	117 Å²	117	134.2 Å²	134.2	76%	0.76	77%	0.774	S	S	*	*			cis	-127	-155.9	-24.3	37.5	-20	0	0	0	111.3
335	E	20.9	Very low	25.8	Very low	154 Å²	154	137.9 Å²	137.9	72%	0.72	78%	0.777	S	S	*	*			trans	87.3	122.3	165.7	-66.2	-115	105.7	0	0	120.6
336	R	20.9	Very low	25.2	Very low	204 Å²	204	131.9 Å²	131.9	77%	0.77	76%	0.763	S	S	*	*			trans	59.2	103.4	136.5	-75.5	-179.9	153	177.2	-5	122.6
337	C	19.5	Very low	25.1	Very low	111 Å²	111	136.8 Å²	136.8	75%	0.75	78%	0.775	S	S	*	*				82.1	147.9	111.9	-77.3	0	0	0	0	122.7
338	Q	24.2	Very low	24.6	Very low	174 Å²	174	136.1 Å²	136.1	81%	0.813	77%	0.773	S	S	*	*			trans	81.7	94.1	153.2	-75.1	-175.4	56.2	0	0	121.1
339	T	20.3	Very low	25.2	Very low	113 Å²	113	129.3 Å²	129.3	69%	0.693	76%	0.762	S	S	*	*				73	138.8	118.5	-23.1	0	0	0	0	121.6
340	S	24.1	Very low	25.1	Very low	99 Å²	99	131.2 Å²	131.2	69%	0.692	76%	0.762	S	S	*	*			trans	85.2	132.3	144.7	17.8	0	0	0	0	121.8
341	Q	26.3	Very low	24.8	Very low	162 Å²	162	130.7 Å²	130.7	76%	0.757	75%	0.754	S	S	*	*			trans	74.7	91.9	146.7	-61.5	-161.1	-81.6	0	0	121.3
342	E	22.1	Very low	24.6	Very low	155 Å²	155	132.3 Å²	132.3	72%	0.724	75%	0.748	S	S	*	*				58.8	136.1	104.8	-68.2	179	114.8	0	0	121.7
343	S	23	Very low	24.6	Very low	117 Å²	117	135.1 Å²	135.1	82%	0.818	75%	0.75	S	S	*	*			trans	79.4	145.4	149	84.6	0	0	0	0	118.1
344	S	25.2	Very low	24.9	Very low	95 Å²	95	135.6 Å²	135.6	66%	0.664	75%	0.747	S	S	*	*			cis	-164.1	168	-23.2	55.1	0	0	0	0	112.1
345	K	25.4	Very low	24.7	Very low	179 Å²	179	136.4 Å²	136.4	78%	0.778	75%	0.752	S	S	*	*			trans	62.8	99.9	151.3	-74.1	166.5	-179.6	175.7	0	119.3
346	S	23.1	Very low	24.8	Very low	92 Å²	92	132.3 Å²	132.3	64%	0.643	75%	0.752	S	S	*	*				25.6	127.3	113.3	62.2	0	0	0	0	119.3
347	N	24	Very low	25.2	Very low	160 Å²	160	128.6 Å²	128.6	86%	0.856	75%	0.752	S	S	*	*				-166.9	149.7	102.8	-91.9	-9.1	0	0	0	113.1
348	S	23.1	Very low	25.6	Very low	106 Å²	106	132.2 Å²	132.2	74%	0.741	76%	0.755	S	S	*	*			trans	-112.9	-176.7	161.6	64.4	0	0	0	0	107.4
349	P	41.2	Very low	25.7	Very low	109 Å²	109	135.6 Å²	135.6	71%	0.708	76%	0.76	S	S	*	*			cis	-135.6	-156.4	1.2	33.7	-9.6	0	0	0	113.7
350	E	22.5	Very low	26.9	Very low	166 Å²	166	135.5 Å²	135.5	78%	0.776	76%	0.762	S	S	*	*			trans	115.2	100.1	150.1	-57.7	-131.1	132.6	0	0	120.7
351	T	23.6	Very low	26.9	Very low	107 Å²	107	135.3 Å²	135.3	66%	0.656	77%	0.766	S	S	*	*				13.6	128.7	123.4	16.3	0	0	0	0	121.1
352	K	22.2	Very low	26.9	Very low	185 Å²	185	136.8 Å²	136.8	80%	0.804	77%	0.773	S	S	*	*				159.7	151	97	-105.4	157.6	-175.6	168.2	0	116.1
353	V	23.2	Very low	27.1	Very low	134 Å²	134	133 Å²	133	81%	0.812	78%	0.775	S	S	*	*			trans	75.1	137.7	144.3	168.6	0	0	0	0	120.6
354	S	30.7	Very low	27.2	Very low	108 Å²	108	137 Å²	137	76%	0.755	78%	0.781	S	S	*	*			trans	-104.8	165.4	170	-39.9	0	0	0	0	111.4
355	P	32.5	Very low	27.2	Very low	134 Å²	134	142.3 Å²	142.3	87%	0.87	79%	0.792	S	S	*	*				-140.4	167.5	128.3	37.4	-25.2	0	0	0	114
356	G	23.4	Very low	27.3	Very low	69 Å²	69	140.3 Å²	140.3	71%	0.711	80%	0.795	S	S	*	*			trans	-146.2	170	170.1	0	0	0	0	0	111.8
357	T	29.1	Very low	27.5	Very low	125 Å²	125	146 Å²	146	77%	0.767	81%	0.808	S	S	*	*			trans	-165.6	126	174.2	-91	0	0	0	0	115.1
358	K	28.1	Very low	27.5	Very low	188 Å²	188	141.2 Å²	141.2	82%	0.817	80%	0.796	S	S	*	*			trans	41.9	115.7	146.1	-54	169.1	-163.8	168.2	0	122.9
359	R	26.1	Very low	27.6	Very low	244 Å²	244	141.7 Å²	141.7	92%	0.921	80%	0.8	S	S	*	*				38.3	163.1	107.9	-105	-172.5	175.1	-167.4	-0.2	121.4
360	P	45.8	Very low	26.8	Very low	111 Å²	111	142 Å²	142	72%	0.721	81%	0.805	S	S	*	*			cis	-144.2	-164.9	-1.1	42.5	-21.7	0	0	0	117.4
361	A	24.6	Very low	26.8	Very low	95 Å²	95	138.2 Å²	138.2	79%	0.785	81%	0.81	S	S	*	*			trans	81.9	142.7	158.8	0	0	0	0	0	117.4
362	Q	26.2	Very low	26.9	Very low	194 Å²	194	136.6 Å²	136.6	91%	0.907	81%	0.814	S	S	*	*			cis	-136.2	179.6	-2.8	-69.1	-167.7	94.9	0	0	109.1
363	G	25.2	Very low	27.1	Very low	74 Å²	74	137.2 Å²	137.2	76%	0.763	82%	0.817	S	S	*	*			cis	135.2	107	-8.2	0	0	0	0	0	113.8
364	E	25.7	Very low	27.2	Very low	203 Å²	203	140.3 Å²	140.3	95%	0.949	82%	0.819	S	S	*	*			trans	-136.2	166.2	-173.7	-157.8	170.9	-138.9	0	0	114
365	K	26.6	Very low	26.9	Very low	206 Å²	206	139.4 Å²	139.4	90%	0.896	82%	0.818	S	S	*	*			trans	-125.5	136.1	-164.2	-86.6	-176.5	177.6	174	0	118
366	V	27.4	Very low	26.5	Very low	137 Å²	137	143 Å²	143	83%	0.83	82%	0.82	S	S	*	*			trans	-40.7	139.2	166.7	175.6	0	0	0	0	118.2
367	K	25.7	Very low	26.5	Very low	211 Å²	211	151 Å²	151	92%	0.917	83%	0.829	S	S	*	*			trans	-174.8	149.7	132.4	-102.1	172	-177.8	-177.3	0	109.9
368	G	24.6	Very low	26.2	Very low	59 Å²	59	155.3 Å²	155.3	61%	0.608	84%	0.837	S	S	*	*			cis	160	153.5	-7.8	0	0	0	0	0	112.3
369	S	25.7	Very low	26	Very low	117 Å²	117	155.3 Å²	155.3	82%	0.818	84%	0.837	S	S	*	*			trans	72.7	118.4	-176.9	73.2	0	0	0	0	115.3
370	S	23.8	Very low	25.8	Very low	116 Å²	116	151.7 Å²	151.7	81%	0.811	83%	0.832	S	S	*	*				73.3	117.3	59.3	76.7	0	0	0	0	112.9
371	G	23.5	Very low	24.7	Very low	86 Å²	86	153.3 Å²	153.3	89%	0.887	83%	0.828	S	S	*	*			cis	123	151.5	39.7	0	0	0	0	0	107.4
372	G	25	Very low	24.6	Very low	72 Å²	72	156.9 Å²	156.9	74%	0.742	83%	0.828	S	S	*	*			cis	171.5	-169.3	-2.7	0	0	0	0	0	110.5
373	K	26.1	Very low	24.4	Very low	199 Å²	199	154.8 Å²	154.8	87%	0.865	82%	0.819	S	S	*	*			trans	75.8	125.9	168.1	-62.3	174.1	178.8	168.5	0	120.6
374	K	24.8	Very low	24.3	Very low	199 Å²	199	160.7 Å²	160.7	87%	0.865	83%	0.826	S	S	*	*			trans	70.1	155	144.1	-69.1	180	177.4	-176.2	0	119
375	A	25.3	Very low	24.2	Very low	88 Å²	88	158.7 Å²	158.7	73%	0.727	82%	0.817	S	S	*	*			cis	-174.7	170	-24.8	0	0	0	0	0	111.9
376	K	24.7	Very low	24.2	Very low	210 Å²	210	158 Å²	158	91%	0.913	82%	0.817	S	S	*	*			trans	102.4	125.4	139.9	-153.6	175.5	-174.2	-179.5	0	118.6
377	R	23.5	Very low	24	Very low	238 Å²	238	159.3 Å²	159.3	90%	0.898	81%	0.812	S	S	*	*			trans	-70	152.2	174	-59.8	139.6	67.3	177.4	2.9	112.6
378	K	22.6	Very low	24	Very low	215 Å²	215	154.9 Å²	154.9	94%	0.935	80%	0.804	S	S	*	*				-151.1	172.2	129.9	-133	-173.6	176.8	-168.7	0	111.6
379	K	24.1	Very low	23.9	Very low	188 Å²	188	158.8 Å²	158.8	82%	0.817	82%	0.816	S	S	*	*			trans	-151.9	124.4	-163.1	170.2	-164.9	176	-176.9	0	110.7
380	M	21.1	Very low	23.8	Very low	167 Å²	167	160.8 Å²	160.8	82%	0.823	82%	0.817	S	S	*	*			trans	-153.6	140.8	153.5	-62.7	-169.6	66.6	0	0	105.7
381	K	22.2	Very low	23.9	Very low	146 Å²	146	160.8 Å²	160.8	64%	0.635	82%	0.817	S	S	*	*			cis	92.4	91.1	19.5	-158.8	-89.3	174.7	-163.4	0	114.3	E383	K381-E383 IonicContact NZ-OE1 3.96Å; K381-E383 PolarHBondContact NZ-OE1 3.49Å
382	E	22.5	Very low	23.9	Very low	169 Å²	169	161.5 Å²	161.5	79%	0.79	82%	0.815	S	S	*	*			trans	-174	164.7	162.4	-97	151.1	-148.5	0	0	104.5
383	E	22.8	Very low	23.9	Very low	150 Å²	150	161.5 Å²	161.5	70%	0.701	82%	0.815	S	S	*	*				-164.6	154.9	-53.2	-115.4	159.7	-143.5	0	0	106.2	K381	K381-E383 IonicContact NZ-OE1 3.96Å; K381-E383 PolarHBondContact NZ-OE1 3.49Å
384	E	23.6	Very low	24	Very low	198 Å²	198	160.9 Å²	160.9	93%	0.925	82%	0.815	S	S	*	*			trans	-96.3	136.6	-168.8	-68.2	169.2	122.3	0	0	112.8
385	E	23.8	Very low	24.1	Very low	162 Å²	162	160 Å²	160	76%	0.757	81%	0.806	S	S	*	*			trans	-116.3	121	157.8	-82.9	-157.5	166.2	0	0	109.4	K387	E385-K387 IonicContact OE2-NZ 3.91Å; E385-K387 PolarHBondContact OE2-NZ 3.43Å
386	E	26.1	Very low	24.2	Very low	191 Å²	191	162 Å²	162	89%	0.893	81%	0.811	S	S	*	*			trans	-79.6	140.9	168.2	-62.8	-175.3	130.5	0	0	110.9
387	K	23.7	Very low	24.4	Very low	165 Å²	165	156.7 Å²	156.7	72%	0.717	79%	0.788	S	S	*	*			trans	-135.1	148	166.1	-78.9	-172.6	172.9	111.8	0	110.9	E385	E385-K387 IonicContact OE2-NZ 3.91Å; E385-K387 PolarHBondContact OE2-NZ 3.43Å
388	P	24	Very low	24.5	Very low	117 Å²	117	152.3 Å²	152.3	76%	0.76	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-80	148	-156.8	30.6	-36.8	0	0	0	114
389	V	22.3	Very low	24.9	Very low	142 Å²	142	147.4 Å²	147.4	86%	0.861	78%	0.776	S	S	*	*	P	Polyproline II helix	trans	-74.1	129.5	169	180	0	0	0	0	109.4
390	L	24.5	Very low	25.3	Very low	158 Å²	158	147.2 Å²	147.2	83%	0.827	78%	0.775	S	S	*	*	P	Polyproline II helix	trans	-101.5	148.9	166	-72.4	175.4	0	0	0	110.4
391	S	25.8	Very low	25.9	Very low	116 Å²	116	150.8 Å²	150.8	81%	0.811	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-66.2	132.6	-168.1	52.3	0	0	0	0	114	G393	S391-G393 PolarHBondContact O-N 2.76Å
392	A	23.8	Very low	26.3	Very low	102 Å²	102	155.4 Å²	155.4	84%	0.843	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-64.7	117.6	167.3	0	0	0	0	0	110.6	Q394	A392-Q394 PolarHBondContact O-N 2.68Å
393	G	24.9	Very low	26.7	Very low	72 Å²	72	152.4 Å²	152.4	74%	0.742	79%	0.79	S	S	*	*			trans	-79.5	115.9	177.9	0	0	0	0	0	111.9	S391 R395	S391-G393 PolarHBondContact O-N 2.76Å; G393-R395 PolarHBondContact O-N 2.69Å
394	Q	28.7	Very low	27.2	Very low	185 Å²	185	152.1 Å²	152.1	86%	0.864	80%	0.798	S	S	*	*			trans	-57.9	128.2	177	-68.2	174.5	-46.8	0	0	111.6	A392	A392-Q394 PolarHBondContact O-N 2.68Å
395	R	26.7	Very low	27.3	Very low	181 Å²	181	147.1 Å²	147.1	68%	0.683	79%	0.791	S	S	*	*			trans	-79.5	131.5	170.7	-83.4	178.4	164.2	173.1	-4.1	109.8	G393 K397 E673	G393-R395 PolarHBondContact O-N 2.69Å; R395-K397 PolarHBondContact O-N 3.3Å; R395-K397 VanDerWaalsContact O-N 3.17Å; R395-E673 IonicContact CZ-OE1 2.7Å; R395-E673 IonicContact NE-OE1 3.49Å; R395-E673 IonicContact NH2-OE1 3.51Å; R395-E673 PolarHBondContact NH2-OE1 2.8Å
396	P	27.7	Very low	27.6	Very low	129 Å²	129	144.4 Å²	144.4	84%	0.838	79%	0.789	S	S	*	*			trans	-74.6	106.5	175.7	28.7	-33.1	0	0	0	111.5	N398	P396-N398 PolarHBondContact O-N 2.85Å
397	K	28.3	Very low	27.7	Very low	99 Å²	99	145.1 Å²	145.1	43%	0.43	79%	0.79	S	S	.	*			trans	-57.2	120.6	170.9	-78.7	162.5	165.9	143.6	0	110.9	R395 S399 E581 D585	R395-K397 PolarHBondContact O-N 3.3Å; R395-K397 VanDerWaalsContact O-N 3.17Å; K397-S399 VanDerWaalsContact C-N 3.26Å; K397-S399 PolarHBondContact O-N 3.09Å; K397-E581 WeakPolarHBondContact CE-OE1 3.3Å; K397-E581 WeakPolarHBondContact CE-OE2 3.49Å; K397-E581 IonicContact NZ-OE1 3.57Å; K397-E581 PolarHBondContact NZ-OE1 3.41Å; K397-E581 IonicContact NZ-OE2 3.58Å; K397-D585 IonicContact NZ-OD1 2.68Å; K397-D585 PolarHBondContact NZ-OD1 3.22Å; K397-D585 IonicContact NZ-OD2 3.74Å; K397-D585 PolarHBondContact NZ-OD2 3.37Å
398	N	26	Very low	27.8	Very low	146 Å²	146	142.4 Å²	142.4	78%	0.781	79%	0.787	S	S	*	*			trans	-79.6	69	175.7	-174.1	11.9	0	0	0	111.7	P396 K400	P396-N398 PolarHBondContact O-N 2.85Å; N398-K400 VanDerWaalsContact C-N 3.29Å; N398-K400 PolarHBondContact O-N 2.91Å
399	S	30.6	Very low	27.9	Very low	113 Å²	113	141.8 Å²	141.8	79%	0.79	79%	0.785	S	S	*	*			trans	-79	64.7	-175.6	65	0	0	0	0	113.3	K397	K397-S399 VanDerWaalsContact C-N 3.26Å; K397-S399 PolarHBondContact O-N 3.09Å
400	K	32.8	Very low	28	Very low	183 Å²	183	145 Å²	145	80%	0.796	78%	0.783	S	S	*	*			trans	-109.7	104.5	171.5	-78.9	-178.1	177.7	173.6	0	111.8	N398 R402	N398-K400 VanDerWaalsContact C-N 3.29Å; N398-K400 PolarHBondContact O-N 2.91Å; K400-R402 PolarHBondContact O-N 2.61Å
401	R	32.8	Very low	28.1	Very low	242 Å²	242	145.2 Å²	145.2	91%	0.913	78%	0.778	S	S	*	*			trans	-48.1	137.1	166.3	-81.9	177.8	160.3	-173.5	-6	110.4	S403	R401-S403 VanDerWaalsContact C-N 3.28Å; R401-S403 PolarHBondContact O-N 2.93Å
402	R	31.8	Very low	28.1	Very low	244 Å²	244	148.7 Å²	148.7	92%	0.921	78%	0.781	S	S	*	*			trans	-71.2	76.2	178.1	-162.4	-178.2	-153.8	172.1	9.4	111.5	K400 V404	K400-R402 PolarHBondContact O-N 2.61Å; R402-V404 PolarHBondContact O-N 3.04Å
403	S	31.1	Very low	28.2	Very low	106 Å²	106	151 Å²	151	74%	0.741	77%	0.774	S	S	*	*			trans	-64.4	119.9	173.8	55.6	0	0	0	0	110.3	R401 A405	R401-S403 VanDerWaalsContact C-N 3.28Å; R401-S403 PolarHBondContact O-N 2.93Å; S403-A405 PolarHBondContact O-N 2.89Å; S403-A405 VanDerWaalsContact O-N 3.08Å
404	V	32	Very low	28.3	Very low	144 Å²	144	153.4 Å²	153.4	87%	0.873	78%	0.78	S	S	*	*			trans	-68.2	106.2	179.3	-179.9	0	0	0	0	109.7	R402	R402-V404 PolarHBondContact O-N 3.04Å
405	A	25.8	Very low	28	Very low	92 Å²	92	150.6 Å²	150.6	76%	0.76	77%	0.771	S	S	*	*			trans	-79.1	128.8	171.9	0	0	0	0	0	110.2	S403	S403-A405 PolarHBondContact O-N 2.89Å; S403-A405 VanDerWaalsContact O-N 3.08Å
406	S	29.8	Very low	28	Very low	105 Å²	105	147.1 Å²	147.1	73%	0.734	78%	0.775	S	S	*	*			trans	-71.5	136.6	177.5	46.8	0	0	0	0	111.5	V408	S406-V408 PolarHBondContact O-N 2.69Å
407	K	29.7	Very low	28	Very low	207 Å²	207	148.7 Å²	148.7	90%	0.9	77%	0.771	S	S	*	*			trans	-81.6	80.5	-172.1	-166	170.8	-175.9	174.3	0	111.7	S409	K407-S409 PolarHBondContact O-N 2.68Å
408	V	25.1	Very low	27.9	Very low	107 Å²	107	152.9 Å²	152.9	65%	0.648	79%	0.792	S	S	*	*			trans	-77.6	105.2	172.6	-179.8	0	0	0	0	109.7	S406	S406-V408 PolarHBondContact O-N 2.69Å
409	S	25.8	Very low	28	Very low	105 Å²	105	155 Å²	155	73%	0.734	80%	0.797	S	S	*	*			trans	-89.2	122.3	170.5	52.9	0	0	0	0	110.8	K407	K407-S409 PolarHBondContact O-N 2.68Å
410	Y	24.6	Very low	27.7	Very low	208 Å²	208	158 Å²	158	82%	0.816	80%	0.799	S	S	*	*			trans	-74.2	128	165.2	-63.7	-93	0	0	0	108.7
411	K	27.1	Very low	27.4	Very low	163 Å²	163	157.2 Å²	157.2	71%	0.709	80%	0.797	S	S	*	*			trans	-102.1	112.1	167.8	-163.3	-174.4	-178.4	-162.3	0	106.8	E413	K411-E413 HydrophobicContact CD-CG 3.96Å; K411-E413 WeakPolarHBondContact CD-OE1 3.3Å; K411-E413 WeakPolarHBondContact CE-OE1 3.35Å; K411-E413 HydrophobicContact CG-CG 3.98Å; K411-E413 IonicContact NZ-OE1 2.89Å; K411-E413 PolarHBondContact NZ-OE1 2.9Å
412	E	26.2	Very low	27	Very low	190 Å²	190	154.2 Å²	154.2	89%	0.888	79%	0.794	S	S	*	*			trans	-89.5	122.3	166.6	-65.6	-167.4	140.7	0	0	107.2
413	E	25.1	Very low	26.6	Very low	149 Å²	149	146.2 Å²	146.2	70%	0.696	78%	0.78	S	S	*	*			trans	-112.1	104.4	179.1	-65.6	179.2	139	0	0	106.6	K411	K411-E413 HydrophobicContact CD-CG 3.96Å; K411-E413 WeakPolarHBondContact CD-OE1 3.3Å; K411-E413 WeakPolarHBondContact CE-OE1 3.35Å; K411-E413 HydrophobicContact CG-CG 3.98Å; K411-E413 IonicContact NZ-OE1 2.89Å; K411-E413 PolarHBondContact NZ-OE1 2.9Å
414	S	26	Very low	26.3	Very low	124 Å²	124	146.3 Å²	146.3	87%	0.867	78%	0.78	S	S	*	*			trans	-91.2	104	172.2	-166.3	0	0	0	0	107.5
415	N	24.2	Very low	26	Very low	126 Å²	126	146.8 Å²	146.8	67%	0.674	78%	0.778	S	S	*	*			trans	-79.6	141.7	171.8	-157.5	51.6	0	0	0	109.1	E417	N415-E417 PolarHBondContact ND2-OE1 3.42Å
416	S	26.7	Very low	26.1	Very low	108 Å²	108	146.5 Å²	146.5	76%	0.755	78%	0.776	S	S	*	*			trans	-133	113.3	177	55.7	0	0	0	0	108.8
417	E	26.9	Very low	26.1	Very low	162 Å²	162	148.8 Å²	148.8	76%	0.757	78%	0.775	S	S	*	*			trans	-113.4	111.9	174.3	-78.2	160.9	-165.3	0	0	107.5	N415	N415-E417 PolarHBondContact ND2-OE1 3.42Å
418	E	27	Very low	26.1	Very low	187 Å²	187	147.4 Å²	147.4	87%	0.874	77%	0.772	S	S	*	*			trans	26.9	128.4	149.1	-65.6	163.6	-160.4	0	0	120.9
419	E	26.3	Very low	26	Very low	190 Å²	190	151.7 Å²	151.7	89%	0.888	78%	0.777	S	S	*	*				-158.7	136.6	119.9	-107.3	166.6	-160.1	0	0	110.2
420	E	25.4	Very low	26.1	Very low	177 Å²	177	154.1 Å²	154.1	83%	0.827	78%	0.777	S	S	*	*			trans	6.4	152.6	161.6	-43.5	-173.9	139.1	0	0	121
421	E	26.3	Very low	25.9	Very low	165 Å²	165	151.1 Å²	151.1	77%	0.771	77%	0.77	S	S	*	*			cis	-153.6	166.6	35.5	-80.8	-173.8	140.7	0	0	114.2
422	E	24.2	Very low	25.7	Very low	180 Å²	180	147.8 Å²	147.8	84%	0.841	77%	0.768	S	S	*	*			trans	52.5	146.2	151.4	-71	-157.4	152.8	0	0	122.8
423	A	24.5	Very low	25.6	Very low	75 Å²	75	143.3 Å²	143.3	62%	0.62	76%	0.757	S	S	*	*			cis	-169.6	173.9	-15.2	0	0	0	0	0	112.1
424	S	24.4	Very low	25.6	Very low	108 Å²	108	144 Å²	144	76%	0.755	76%	0.761	S	S	*	*			trans	78.3	123.8	159.4	68.3	0	0	0	0	121.1
425	D	24.1	Very low	25.5	Very low	155 Å²	155	145.7 Å²	145.7	83%	0.829	76%	0.76	S	S	*	*			trans	58	119.3	144.8	-71.9	17.5	0	0	0	120.7
426	A	28.4	Very low	25.5	Very low	85 Å²	85	147 Å²	147	70%	0.702	77%	0.767	S	S	*	*				97.8	144.2	52.7	0	0	0	0	0	110.9
427	E	30.5	Very low	25.2	Very low	154 Å²	154	149.8 Å²	149.8	72%	0.72	77%	0.766	S	S	*	*			cis	-154.4	-170.6	-2.7	-115.1	-79.5	-166.9	0	0	107.6
428	E	28.6	Very low	25.1	Very low	178 Å²	178	149.7 Å²	149.7	83%	0.832	77%	0.765	S	S	*	*			trans	70.3	115.1	174.2	-84.6	-177.7	137.2	0	0	114.3
429	Y	24.3	Very low	24.9	Very low	196 Å²	196	146 Å²	146	77%	0.769	76%	0.756	S	S	*	*			cis	51.7	142.5	36.6	-74.2	-75.7	0	0	0	111.8
430	Q	26.6	Very low	24.8	Very low	157 Å²	157	142.4 Å²	142.4	73%	0.734	75%	0.75	S	S	*	*			cis	-157.1	177.7	16.1	-120	172.2	-79.6	0	0	105.2
431	E	22.1	Very low	24.7	Very low	144 Å²	144	139 Å²	139	67%	0.673	74%	0.742	S	S	*	*			cis	-165.6	164.3	-19.3	-148.4	178.4	167	0	0	107.5
432	S	21.2	Very low	24.7	Very low	94 Å²	94	140 Å²	140	66%	0.657	74%	0.744	S	S	*	*			trans	54.2	175	151.9	73.5	0	0	0	0	118
433	S	25.9	Very low	24.8	Very low	95 Å²	95	143.1 Å²	143.1	66%	0.664	75%	0.748	S	S	*	*			cis	-142.6	149.7	2.3	-2.2	0	0	0	0	113.2
434	E	24.8	Very low	24.8	Very low	165 Å²	165	143.6 Å²	143.6	77%	0.771	75%	0.752	S	S	*	*			trans	-20.4	152.6	136.5	66.5	-149.5	66.9	0	0	116.5
435	D	23	Very low	24.8	Very low	158 Å²	158	149.6 Å²	149.6	85%	0.845	76%	0.758	S	S	*	*			cis	-160.9	-167.3	3	-136.2	-39.5	0	0	0	111.5
436	D	24.7	Very low	24.9	Very low	155 Å²	155	150.8 Å²	150.8	83%	0.829	76%	0.756	S	S	*	*			trans	126.8	164.3	136.7	-133.2	-21.9	0	0	0	117.8
437	F	21.2	Very low	24.8	Very low	165 Å²	165	155 Å²	155	72%	0.724	76%	0.758	S	S	*	*			trans	-123.9	-168.8	-139.2	-167.2	-116.4	0	0	0	115.3	T439	F437-T439 HydrophobicContact CZ-CG2 4.46Å
438	E	24.5	Very low	24.6	Very low	160 Å²	160	153.6 Å²	153.6	75%	0.748	75%	0.753	S	S	*	*			trans	66.3	100.6	175.9	-53.3	-153.5	151.9	0	0	117.4
439	T	22.2	Very low	24.5	Very low	110 Å²	110	155.1 Å²	155.1	68%	0.675	75%	0.751	S	S	*	*				69.3	121	59.4	77.5	0	0	0	0	117.4	F437	F437-T439 HydrophobicContact CZ-CG2 4.46Å
440	C	23.7	Very low	24.5	Very low	114 Å²	114	152.1 Å²	152.1	77%	0.77	75%	0.748	S	S	*	*			trans	-155.1	107.4	145.3	-162.9	0	0	0	0	114.2
441	T	24.7	Very low	24.5	Very low	107 Å²	107	148.6 Å²	148.6	66%	0.656	75%	0.746	S	S	*	*			trans	22.9	148.4	142.6	77.3	0	0	0	0	121.4
442	K	25.7	Very low	24.6	Very low	185 Å²	185	147.7 Å²	147.7	80%	0.804	75%	0.751	S	S	*	*			cis	-158.1	149.7	41.3	-69.1	171	-175.4	158.4	0	114.2
443	R	25	Very low	24.8	Very low	246 Å²	246	148 Å²	148	93%	0.928	75%	0.753	S	S	*	*			trans	12.8	148.1	133.2	-71.1	175.3	174.1	-170	-1.1	119.8
444	A	26.1	Very low	24.7	Very low	85 Å²	85	148.2 Å²	148.2	70%	0.702	76%	0.755	S	S	*	*			cis	-167.3	157.8	4.2	0	0	0	0	0	115.5
445	R	24.7	Very low	24.6	Very low	234 Å²	234	147.4 Å²	147.4	88%	0.883	75%	0.751	S	S	*	*			trans	3.5	149.4	132.9	-59.9	170.9	171.2	168.9	-3.7	116.9
446	K	26.1	Very low	24.7	Very low	180 Å²	180	146.9 Å²	146.9	78%	0.783	74%	0.741	S	S	*	*			cis	-176.9	136.2	48.5	-146.7	179	-178.4	-175.8	0	112.9
447	K	26.4	Very low	24.7	Very low	173 Å²	173	145.7 Å²	145.7	75%	0.752	74%	0.739	S	S	*	*			trans	51.1	159.1	133.2	-71.7	-161.5	171.9	-163.2	0	123.3
448	M	25.2	Very low	24.8	Very low	125 Å²	125	143.8 Å²	143.8	62%	0.616	75%	0.746	S	S	*	*			cis	171.5	179.4	-17.9	-164.5	-177.1	174.2	0	0	109
449	R	27.2	Very low	24.8	Very low	209 Å²	209	146.6 Å²	146.6	79%	0.789	75%	0.75	S	S	*	*			trans	79.5	153.9	149.6	-83.3	167.8	164.9	-157.9	-9.6	118.5
450	N	24.1	Very low	24.9	Very low	133 Å²	133	146.8 Å²	146.8	71%	0.711	75%	0.751	S	S	*	*			cis	-172.3	174.2	-24.1	-123	54.3	0	0	0	109.9
451	A	25.4	Very low	25	Very low	83 Å²	83	151 Å²	151	69%	0.686	76%	0.759	S	S	*	*			trans	70.7	159.7	150.4	0	0	0	0	0	119.1
452	T	24.2	Very low	25	Very low	125 Å²	125	148.6 Å²	148.6	77%	0.767	76%	0.757	S	S	*	*				-172.9	162.1	-51.3	30.2	0	0	0	0	109.6
453	S	25.9	Very low	25	Very low	101 Å²	101	145.9 Å²	145.9	71%	0.706	76%	0.756	S	S	*	*			trans	66.6	120.3	145.1	62.5	0	0	0	0	123.5
454	S	24.1	Very low	25.1	Very low	100 Å²	100	144.2 Å²	144.2	70%	0.699	75%	0.749	S	S	*	*				74.2	113.5	123.7	70.2	0	0	0	0	124.3
455	E	23.4	Very low	25	Very low	147 Å²	147	148.1 Å²	148.1	69%	0.687	75%	0.751	S	S	*	*				70.7	141.5	120.5	-69	-140.8	105.3	0	0	126
456	K	24.6	Very low	24.9	Very low	148 Å²	148	145.5 Å²	145.5	64%	0.643	74%	0.741	S	S	*	*			trans	71.7	95	139.5	-76.9	169.2	179.3	137	0	122.6
457	T	23.6	Very low	24.8	Very low	130 Å²	130	144.6 Å²	144.6	80%	0.798	73%	0.732	S	S	*	*				45.9	109.3	119.9	59.1	0	0	0	0	121.3
458	S	25.1	Very low	24.8	Very low	124 Å²	124	145.5 Å²	145.5	87%	0.867	73%	0.731	S	S	*	*				-177.7	166.5	123.2	52.6	0	0	0	0	109.6
459	R	23.1	Very low	24.7	Very low	220 Å²	220	145.1 Å²	145.1	83%	0.83	74%	0.736	S	S	*	*			cis	178.5	125.1	-43.9	175.6	178.5	174.5	163.9	1	104
460	T	24.2	Very low	24.5	Very low	114 Å²	114	137.9 Å²	137.9	70%	0.699	73%	0.726	S	S	*	*			trans	55.1	114.4	165.7	53.2	0	0	0	0	120.7
461	Q	26.8	Very low	24.6	Very low	201 Å²	201	140.2 Å²	140.2	94%	0.939	73%	0.733	S	S	*	*				159.8	138.9	116.1	-85.3	-176.6	26.1	0	0	108.4
462	G	25.2	Very low	24.5	Very low	58 Å²	58	144.1 Å²	144.1	60%	0.598	73%	0.734	S	S	*	*			cis	162.7	164.3	-7.3	0	0	0	0	0	110.2
463	T	25.5	Very low	24.5	Very low	128 Å²	128	144.1 Å²	144.1	79%	0.785	73%	0.73	S	S	*	*			trans	59	139.7	164.8	54.8	0	0	0	0	118.4
464	R	25.6	Very low	24.5	Very low	210 Å²	210	145 Å²	145	79%	0.792	72%	0.722	S	S	*	*			cis	-164.5	157.1	14.3	-118.2	158	-165.6	-172.9	3.8	109.7
465	K	24.4	Very low	24.4	Very low	168 Å²	168	147.3 Å²	147.3	73%	0.73	73%	0.727	S	S	*	*				25.2	142.7	123.3	-64.3	-176.1	179.4	174.4	0	118
466	R	23.2	Very low	24.4	Very low	179 Å²	179	144.1 Å²	144.1	68%	0.675	73%	0.734	S	S	*	*			cis	-175.3	151.3	15.9	-127.2	178.7	173.3	-175.4	-3.5	114.2
467	R	23.8	Very low	24.3	Very low	160 Å²	160	144.8 Å²	144.8	60%	0.604	74%	0.739	S	S	*	*			trans	45.5	134.7	131.5	-85	-177.6	171.5	-165.9	-3.5	123.5
468	R	25.7	Very low	24.3	Very low	193 Å²	193	148.9 Å²	148.9	73%	0.728	74%	0.74	S	S	*	*				65.9	163.8	129.4	-67.5	-176.7	177.6	-166.9	-6.3	118
469	T	23.6	Very low	24.2	Very low	117 Å²	117	151.9 Å²	151.9	72%	0.718	74%	0.741	S	S	*	*			cis	-149	171.3	2.3	-9.2	0	0	0	0	106.7
470	G	23.5	Very low	24.2	Very low	57 Å²	57	147.8 Å²	147.8	59%	0.588	73%	0.731	S	S	*	*			cis	-166	164	6.6	0	0	0	0	0	108.7
471	E	24.8	Very low	24	Very low	181 Å²	181	148.5 Å²	148.5	85%	0.846	74%	0.739	S	S	*	*				64	105.4	95.3	-71.4	175.4	112.6	0	0	116
472	K	24	Very low	23.9	Very low	165 Å²	165	145.4 Å²	145.4	72%	0.717	72%	0.722	S	S	*	*				-169	157.3	118.7	-112.7	-174.9	164.7	-113	0	114.6	E474	K472-E474 IonicContact NZ-OE1 3.33Å; K472-E474 PolarHBondContact NZ-OE1 3.05Å; K472-E474 IonicContact NZ-OE2 2.68Å; K472-E474 PolarHBondContact NZ-OE2 3.42Å
473	N	23.6	Very low	23.8	Very low	126 Å²	126	151.6 Å²	151.6	67%	0.674	74%	0.736	S	S	*	*			trans	-73.2	-159.7	164.2	-15.7	-61.5	0	0	0	108.1
474	E	26.1	Very low	23.7	Very low	118 Å²	118	153.9 Å²	153.9	55%	0.551	74%	0.737	S	S	*	*			cis	-152.8	145.3	22.8	-72.5	76.5	-109.6	0	0	106.6	K472	K472-E474 IonicContact NZ-OE1 3.33Å; K472-E474 PolarHBondContact NZ-OE1 3.05Å; K472-E474 IonicContact NZ-OE2 2.68Å; K472-E474 PolarHBondContact NZ-OE2 3.42Å
475	D	23.3	Very low	23.6	Very low	150 Å²	150	151.7 Å²	151.7	80%	0.802	74%	0.741	S	S	*	*			cis	-167.6	175.6	-26.3	-75.8	-46.7	0	0	0	108.9
476	G	23.8	Very low	23.6	Very low	80 Å²	80	151.9 Å²	151.9	83%	0.825	75%	0.751	S	S	*	*			trans	-178.4	133.2	176.2	0	0	0	0	0	118.2
477	E	22.7	Very low	23.8	Very low	162 Å²	162	152.6 Å²	152.6	76%	0.757	76%	0.762	S	S	*	*			trans	-148.6	147.5	-156	-123.6	-169.7	156.8	0	0	115.3
478	W	22.3	Very low	23.8	Very low	215 Å²	215	152.9 Å²	152.9	81%	0.814	78%	0.775	S	S	*	*			trans	57.1	154.9	168.5	-51.1	104.6	0	0	0	117.2
479	E	22.7	Very low	23.7	Very low	188 Å²	188	152.7 Å²	152.7	88%	0.879	78%	0.783	S	S	*	*			cis	-137.5	169.9	38.7	-83.5	-173.1	146.6	0	0	116.1
480	E	22.9	Very low	23.6	Very low	134 Å²	134	151 Å²	151	63%	0.626	79%	0.789	S	S	*	*			trans	-109.6	141.6	174.3	179.8	-162	-167.9	0	0	109.8	K482	E480-K482 WeakPolarHBondContact OE1-CE 3.47Å; E480-K482 IonicContact OE1-NZ 2.99Å; E480-K482 PolarHBondContact OE1-NZ 3.17Å; E480-K482 IonicContact OE2-NZ 2.68Å; E480-K482 PolarHBondContact OE2-NZ 2.93Å
481	C	21.5	Very low	23.7	Very low	129 Å²	129	152.8 Å²	152.8	87%	0.872	80%	0.798	S	S	*	*			trans	-133.5	138.3	161.5	-84.8	0	0	0	0	111.2
482	K	23.4	Very low	23.6	Very low	135 Å²	135	150.4 Å²	150.4	59%	0.587	80%	0.796	S	S	*	*			trans	-109	158.7	176.7	-59.1	174.6	177.1	60.6	0	110.1	E480	E480-K482 WeakPolarHBondContact OE1-CE 3.47Å; E480-K482 IonicContact OE1-NZ 2.99Å; E480-K482 PolarHBondContact OE1-NZ 3.17Å; E480-K482 IonicContact OE2-NZ 2.68Å; E480-K482 PolarHBondContact OE2-NZ 2.93Å
483	E	23.7	Very low	23.5	Very low	188 Å²	188	147.6 Å²	147.6	88%	0.879	80%	0.797	S	S	*	*			trans	179.7	97.9	152.7	-101.3	159.6	-147.5	0	0	104
484	E	23.5	Very low	23.6	Very low	176 Å²	176	149.4 Å²	149.4	82%	0.822	81%	0.806	S	S	*	*				77.4	136.3	71.6	-67.4	-168.2	-177	0	0	113.6
485	D	24.1	Very low	23.4	Very low	164 Å²	164	155.1 Å²	155.1	88%	0.877	82%	0.823	S	S	*	*			trans	-88.4	156.2	-171.3	-62.9	-75.4	0	0	0	112.5
486	D	23.2	Very low	23.6	Very low	172 Å²	172	152.4 Å²	152.4	92%	0.92	82%	0.821	S	S	*	*			trans	-145.5	133.6	163.1	-117.7	-28.8	0	0	0	110.2
487	E	27.6	Very low	23.7	Very low	194 Å²	194	158.1 Å²	158.1	91%	0.907	82%	0.823	S	S	*	*			trans	-106.4	136.7	177.5	-65.1	-172	137.1	0	0	111.1
488	D	23.1	Very low	24	Very low	167 Å²	167	162.2 Å²	162.2	89%	0.893	83%	0.832	S	S	*	*			trans	-153	150.1	155.4	-163.1	13	0	0	0	111.9
489	E	25.3	Very low	24.4	Very low	189 Å²	189	163.5 Å²	163.5	88%	0.883	84%	0.836	S	S	*	*			trans	-95.3	136.7	178.9	-76.1	-153.6	152.2	0	0	112.8
490	G	21.7	Very low	24.8	Very low	82 Å²	82	159.8 Å²	159.8	85%	0.845	83%	0.831	S	S	*	*			trans	-158.2	108.5	174.9	0	0	0	0	0	114
491	A	23.8	Very low	25.4	Very low	94 Å²	94	156.8 Å²	156.8	78%	0.777	84%	0.836	S	S	*	*			trans	-86.1	134.6	-177.7	0	0	0	0	0	113.4
492	T	22.7	Very low	26	Very low	131 Å²	131	159.7 Å²	159.7	80%	0.804	84%	0.837	S	S	*	*				155.2	144	117.1	47.7	0	0	0	0	115.6
493	S	22.9	Very low	27	Very low	105 Å²	105	163.1 Å²	163.1	73%	0.734	85%	0.846	S	S	*	*			trans	78.7	113.1	152.2	78.6	0	0	0	0	121.6
494	N	24.5	Very low	28.1	Very low	164 Å²	164	163 Å²	163	88%	0.877	84%	0.843	S	S	*	*			trans	34.8	114.5	137.7	-67.7	-21.2	0	0	0	121.3
495	R	23	Very low	28.8	Very low	239 Å²	239	162.8 Å²	162.8	90%	0.902	85%	0.847	S	S	*	*				144.9	108.5	108.9	-174	175.8	-179.1	-179.1	-0.1	113.8
496	A	27.3	Very low	30.4	Very low	92 Å²	92	157.6 Å²	157.6	76%	0.76	83%	0.833	S	S	*	*			trans	58.9	107.4	151.5	0	0	0	0	0	119.9
497	K	25.9	Very low	32.4	Very low	200 Å²	200	155.6 Å²	155.6	87%	0.87	83%	0.829	S	S	*	*				-144.1	115.6	124.8	-117.9	170.3	-175.9	174.2	0	110.3	R499	K497-R499 PolarHBondContact O-N 3.41Å
498	R	29.2	Very low	34.8	Very low	249 Å²	249	147.5 Å²	147.5	94%	0.94	80%	0.798	S	S	*	*			trans	-67.5	97.8	161.4	-88.1	-179.8	161.3	-179.6	-7.1	106.8	S500	R498-S500 PolarHBondContact O-N 2.9Å; R498-S500 VanDerWaalsContact O-N 3.08Å
499	R	29.6	Very low	37.8	Very low	242 Å²	242	140.1 Å²	140.1	91%	0.913	76%	0.76	S	S	*	*			trans	-67.5	99.8	161.1	-80.2	-178.1	166.6	172.1	-4.3	106.6	K497 G501	K497-R499 PolarHBondContact O-N 3.41Å; R499-G501 PolarHBondContact O-N 2.71Å
500	S	32.7	Very low	41	Very low	109 Å²	109	132.6 Å²	132.6	76%	0.762	73%	0.726	S	S	*	*			trans	-59.6	120.4	161.7	47.3	0	0	0	0	107.1	R498 Q502	R498-S500 PolarHBondContact O-N 2.9Å; R498-S500 VanDerWaalsContact O-N 3.08Å; S500-Q502 PolarHBondContact O-N 3.21Å
501	G	34.3	Very low	44.4	Very low	71 Å²	71	129.6 Å²	129.6	73%	0.732	69%	0.69	S	S	*	*			trans	-54.2	115.9	178.5	0	0	0	0	0	109.8	R499 R503	R499-G501 PolarHBondContact O-N 2.71Å; G501-R503 PolarHBondContact O-N 2.91Å; G501-R503 VanDerWaalsContact O-N 3.14Å
502	Q	33.9	Very low	47.8	Very low	191 Å²	191	125.1 Å²	125.1	89%	0.893	65%	0.653	S	S	*	*			trans	-66.7	110.8	169.7	-173	169.3	-17.2	0	0	105.5	S500 K504	S500-Q502 PolarHBondContact O-N 3.21Å; Q502-K504 PolarHBondContact O-N 2.84Å
503	R	44.8	Very low	51.4	Low	207 Å²	207	119 Å²	119	78%	0.781	62%	0.615	S	S	*	*			trans	-57.2	128.1	-178.8	-70.7	-177.5	173.7	-175.3	-4.3	107.9	G501 D505	G501-R503 PolarHBondContact O-N 2.91Å; G501-R503 VanDerWaalsContact O-N 3.14Å; R503-D505 PolarHBondContact O-N 2.9Å
504	K	46.3	Very low	54.8	Low	186 Å²	186	114 Å²	114	81%	0.809	58%	0.58	S	S	*	*			trans	-67	126.4	165.6	-67.7	-179.5	178.8	177.2	0	106.6	Q502 G506	Q502-K504 PolarHBondContact O-N 2.84Å; K504-G506 PolarHBondContact O-N 2.97Å
505	D	38	Very low	58.2	Low	170 Å²	170	106.2 Å²	106.2	91%	0.909	54%	0.538	S	S	*	.	S	Bend	trans	-75.3	104.7	171.2	-71.1	-51.1	0	0	0	108.6	R503	R503-D505 PolarHBondContact O-N 2.9Å
506	G	57.9	Low	61.6	Low	56 Å²	56	95.9 Å²	95.9	58%	0.577	50%	0.5	S	S	*	.	S	Bend	trans	172	173.4	-176.1	0	0	0	0	0	111.5	K504	K504-G506 PolarHBondContact O-N 2.97Å
507	P	65.4	Low	64.7	Low	129 Å²	129	91.8 Å²	91.8	84%	0.838	47%	0.465	S	S	*	.			trans	-63.9	145.9	169.7	29.3	-34.4	0	0	0	110.5
508	G	78.4	Confident	67.7	Low	25 Å²	25	86.5 Å²	86.5	26%	0.258	45%	0.446	S	S	.	.			trans	-78.7	173.5	-179.8	0	0	0	0	0	114.3	D510 N541 T543	G508-D510 PolarHBondContact O-N 3.07Å; G508-N541 CarbonylContact C-O 3.56Å; G508-N541 WeakPolarHBondContact CA-O 3.25Å; G508-T543 PolarHBondContact N-OG1 3.13Å
509	A	86.7	Confident	70.5	Confident	12 Å²	12	80.6 Å²	80.6	10%	0.099	43%	0.427	C	S	.	.			trans	-76	74.8	168.8	0	0	0	0	0	109.8	N541	A509-N541 HydrophobicContact CB-CB 4.04Å; A509-N541 PolarHBondContact N-O 3.35Å
510	D	91.8	Very high	73.2	Confident	30 Å²	30	71.5 Å²	71.5	16%	0.16	40%	0.401	C	S	.	.			trans	-84.9	-6.4	-169.8	-71.7	-45.4	0	0	0	115	S311 H313 G508 A542 T543	S311-D510 PolarHBondContact N-O 3.13Å; H313-D510 VanDerWaalsContact CE1-CG 3.47Å; H313-D510 IonicContact CE1-OD1 3.61Å; H313-D510 PolarHBondContact CE1-OD1 3.22Å; H313-D510 IonicContact CE1-OD2 3.79Å; H313-D510 IonicContact NE2-OD1 2.75Å; G508-D510 PolarHBondContact O-N 3.07Å; D510-A542 WeakPolarHBondContact OD1-CA 3.42Å; D510-A542 WeakPolarHBondContact OD1-CB 3.3Å; D510-T543 WeakPolarHBondContact OD1-CB 3.28Å; D510-T543 PolarHBondContact OD1-N 3.12Å; D510-T543 PolarHBondContact OD1-OG1 3.47Å; D510-T543 VanDerWaalsContact OD2-CB 3.23Å; D510-T543 WeakPolarHBondContact OD2-CB 3.23Å; D510-T543 PolarHBondContact OD2-OG1 3.41Å
511	E	93.6	Very high	75.9	Confident	20 Å²	20	68.7 Å²	68.7	9%	0.093	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	125.8	176.2	-54.1	-165.2	168.1	0	0	111.2	R213 H288 Q289 T292 H293 V309 L310	R213-E511 IonicContact CZ-OE1 2.88Å; R213-E511 IonicContact NH1-OE1 3.55Å; R213-E511 PolarHBondContact NH1-OE1 2.88Å; R213-E511 IonicContact NH1-OE2 3.97Å; H288-E511 PolarHBondContact CD2-O 3.23Å; H288-E511 PolarHBondContact NE2-O 2.68Å; Q289-E511 HydrophobicContact CG-CG 4.1Å; Q289-E511 WeakPolarHBondContact CG-OE2 3.45Å; T292-E511 HydrophobicContact CG2-CB 4.23Å; T292-E511 PolarHBondContact OG1-O 3.07Å; T292-E511 VanDerWaalsContact OG1-O 3.13Å; H293-E511 IonicContact CD2-OE2 3.44Å; H293-E511 IonicContact NE2-OE2 3.75Å; H293-E511 PolarHBondContact NE2-OE2 3.37Å; V309-E511 WeakPolarHBondContact O-CA 3.45Å; L310-E511 HydrophobicContact CD2-CB 4.05Å; L310-E511 HydrophobicContact CD2-CG 3.49Å; L310-E511 VanDerWaalsContact CD2-CG 3.49Å; L310-E511 WeakPolarHBondContact CD2-OE1 3.07Å
512	W	95.6	Very high	78.6	Confident	0 Å²	0	66.5 Å²	66.5	0%	0	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	178.5	177.1	64	84.7	0	0	0	110.3	V309 C538 A542 V549 Y565	V309-W512 WeakPolarHBondContact CA-O 3.46Å; V309-W512 HydrophobicContact CB-CD2 4.42Å; V309-W512 HydrophobicContact CB-CG 4.39Å; V309-W512 HydrophobicContact CB-CZ2 4.44Å; V309-W512 WeakPolarHBondContact CB-O 3.04Å; V309-W512 HydrophobicContact CG1-CD2 4.48Å; V309-W512 HydrophobicContact CG1-CZ2 3.64Å; V309-W512 PolarHBondContact N-O 2.84Å; V309-W512 PolarHBondContact O-N 2.78Å; V309-W512 VanDerWaalsContact O-O 3.11Å; W512-C538 HydrophobicContact CD2-CB 3.9Å; W512-C538 HydrophobicContact CE3-CB 4.12Å; W512-C538 HydrophobicContact CG-CB 4.24Å; W512-A542 HydrophobicContact CZ3-CB 4.04Å; W512-V549 HydrophobicContact CH2-CG1 3.9Å; W512-V549 HydrophobicContact CH2-CG2 4.49Å; W512-V549 HydrophobicContact CZ2-CG1 3.63Å; W512-Y565 AromaticContact CE2-CD1 3.96Å; W512-Y565 AromaticContact CE2-CE1 3.61Å; W512-Y565 AromaticContact CE2-CZ 3.79Å; W512-Y565 HydrophobicContact CH2-CD1 4.44Å; W512-Y565 AromaticContact CZ2-CD1 3.53Å; W512-Y565 HydrophobicContact CZ2-CD1 3.53Å; W512-Y565 AromaticContact CZ2-CD2 3.97Å; W512-Y565 HydrophobicContact CZ2-CD2 3.97Å; W512-Y565 AromaticContact CZ2-CE1 3.69Å; W512-Y565 HydrophobicContact CZ2-CE1 3.69Å; W512-Y565 HydrophobicContact CZ2-CE2 4.14Å; W512-Y565 AromaticContact CZ2-CG 3.66Å; W512-Y565 HydrophobicContact CZ2-CG 3.66Å; W512-Y565 AromaticContact NE1-CE1 3.25Å; W512-Y565 AromaticContact NE1-CE2 3.72Å; W512-Y565 AromaticContact NE1-CZ 3.05Å; W512-Y565 PolarHBondContact NE1-OH 3.17Å
513	L	96.8	Very high	81.4	Confident	1 Å²	1	58.4 Å²	58.4	1%	0.005	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	157.7	-172.9	-52.8	-175.9	0	0	0	112.9	T292 F295 L296 L299 R307 L308 C525 V526	T292-L513 HydrophobicContact CG2-CD2 3.65Å; T292-L513 HydrophobicContact CG2-CG 4.07Å; F295-L513 HydrophobicContact CD1-CD1 3.89Å; L296-L513 HydrophobicContact CB-CD1 3.84Å; L296-L513 HydrophobicContact CB-CD2 4Å; L296-L513 HydrophobicContact CD1-CD1 4.22Å; L296-L513 HydrophobicContact CD1-CD2 4.09Å; L296-L513 HydrophobicContact CD2-CD2 4.07Å; L296-L513 HydrophobicContact CG-CD2 4.28Å; L299-L513 HydrophobicContact CD1-CD1 3.6Å; R307-L513 WeakPolarHBondContact O-CA 3.15Å; L308-L513 HydrophobicContact CD1-CD2 3.76Å; L513-C525 CarbonylContact O-C 3.56Å; L513-C525 WeakPolarHBondContact O-CA 3.5Å; L513-V526 PolarHBondContact N-O 3.32Å; L513-V526 PolarHBondContact O-N 3.08Å
514	E	95.9	Very high	83.7	Confident	0 Å²	0	48.7 Å²	48.7	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	138.9	159	-73.5	-173.1	170	0	0	110.9	C306 R307 V309 W523 V524 K564 Y565	C306-E514 CarbonylContact C-O 3.56Å; C306-E514 VanDerWaalsContact CA-O 3.32Å; C306-E514 WeakPolarHBondContact CA-O 3.42Å; R307-E514 HydrophobicContact CB-CB 4.25Å; R307-E514 PolarHBondContact N-O 2.92Å; R307-E514 PolarHBondContact O-N 3.47Å; V309-E514 HydrophobicContact CG2-CB 4.31Å; V309-E514 HydrophobicContact CG2-CG 3.87Å; E514-W523 HydrophobicContact CB-CE3 3.85Å; E514-W523 HydrophobicContact CB-CZ3 4.46Å; E514-V524 WeakPolarHBondContact CA-O 3.2Å; E514-K564 VanDerWaalsContact OE1-CD 3.3Å; E514-K564 WeakPolarHBondContact OE1-CD 3.43Å; E514-K564 WeakPolarHBondContact OE1-CE 3.45Å; E514-K564 IonicContact OE1-NZ 3.6Å; E514-K564 PolarHBondContact OE1-NZ 3.45Å; E514-K564 IonicContact OE2-NZ 3.92Å; E514-K564 PolarHBondContact OE2-NZ 2.84Å; E514-Y565 WeakPolarHBondContact CG-OH 3.24Å; E514-Y565 VanDerWaalsContact OE1-CE2 3.29Å; E514-Y565 WeakPolarHBondContact OE1-CE2 3.5Å; E514-Y565 PolarHBondContact OE1-OH 2.98Å
515	V	95.8	Very high	86	Confident	1 Å²	1	40.1 Å²	40.1	1%	0.006	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	129.3	176.6	-173.4	0	0	0	0	109	L247 L299 L304 V524 V526	L247-V515 HydrophobicContact CD1-CB 4.01Å; L247-V515 HydrophobicContact CD1-CG1 4.17Å; L247-V515 HydrophobicContact CD1-CG2 4.31Å; L247-V515 HydrophobicContact CD2-CG1 4.31Å; L299-V515 HydrophobicContact CD1-CG2 3.83Å; L299-V515 HydrophobicContact CD2-CG2 4.3Å; L304-V515 HydrophobicContact CB-CG1 4.28Å; L304-V515 HydrophobicContact CD1-CG1 4.41Å; V515-V524 PolarHBondContact N-O 2.82Å; V515-V524 PolarHBondContact O-N 3.43Å; V515-V526 HydrophobicContact CG2-CG2 4.07Å
516	Y	93.7	Very high	88.7	Confident	23 Å²	23	32.1 Å²	32.1	9%	0.09	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	125.2	171.5	-165.6	-101	0	0	0	109.8	F305 D518 S521 W523 R597	F305-Y516 HydrophobicContact CD1-CG 4.49Å; F305-Y516 PolarHBondContact O-N 2.99Å; Y516-D518 WeakPolarHBondContact CD1-OD1 3.47Å; Y516-D518 WeakPolarHBondContact CE1-OD1 3.28Å; Y516-S521 VanDerWaalsContact CZ-C 3.45Å; Y516-S521 VanDerWaalsContact OH-C 3.23Å; Y516-S521 WeakPolarHBondContact OH-CA 3.13Å; Y516-S521 VanDerWaalsContact OH-CB 3.3Å; Y516-S521 WeakPolarHBondContact OH-CB 3.42Å; Y516-S521 PolarHBondContact OH-O 2.77Å; Y516-W523 AromaticContact CD2-CD1 3.89Å; Y516-W523 AromaticContact CD2-CD2 3.8Å; Y516-W523 HydrophobicContact CD2-CD2 3.8Å; Y516-W523 AromaticContact CD2-CE2 3.65Å; Y516-W523 HydrophobicContact CD2-CE3 4.44Å; Y516-W523 AromaticContact CD2-CG 3.96Å; Y516-W523 HydrophobicContact CD2-CG 3.96Å; Y516-W523 HydrophobicContact CD2-CZ2 4.19Å; Y516-W523 AromaticContact CD2-NE1 3.69Å; Y516-W523 HydrophobicContact CG-CD2 4.45Å; Y516-R597 HydrophobicContact CE1-CG 4.48Å; Y516-R597 HydrophobicContact CE2-CB 4.45Å
517	L	92.6	Very high	90.4	Very high	5 Å²	5	29.5 Å²	29.5	3%	0.026	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	110.4	174.3	-68.1	-178.4	0	0	0	109.4	I242 Q244 L247 K519 S520 S521 S522 V524	I242-L517 HydrophobicContact CG2-CD2 3.93Å; Q244-L517 HydrophobicContact CG-CD1 3.8Å; L247-L517 HydrophobicContact CD1-CD1 4.29Å; L247-L517 HydrophobicContact CD1-CD2 3.87Å; L247-L517 HydrophobicContact CD1-CG 4.29Å; L247-L517 HydrophobicContact CG-CD2 4.33Å; L517-K519 PolarHBondContact O-N 3.16Å; L517-S520 PolarHBondContact O-N 3.38Å; L517-S520 PolarHBondContact O-OG 2.84Å; L517-S521 WeakPolarHBondContact O-CA 3.31Å; L517-S521 PolarHBondContact O-N 3.09Å; L517-S522 PolarHBondContact N-O 3.31Å; L517-S522 PolarHBondContact O-N 3.31Å; L517-V524 HydrophobicContact CD1-CB 4.37Å; L517-V524 HydrophobicContact CD1-CG2 3.65Å; L517-V524 HydrophobicContact CG-CG2 4.17Å
518	D	88.8	Confident	91.6	Very high	90 Å²	90	23.5 Å²	23.5	48%	0.481	13%	0.134	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.8	-36.5	-178.9	-62.9	-47.5	0	0	0	112.5	Y516 S520 S521	Y516-D518 WeakPolarHBondContact CD1-OD1 3.47Å; Y516-D518 WeakPolarHBondContact CE1-OD1 3.28Å; D518-S520 PolarHBondContact O-N 2.71Å; D518-S521 WeakPolarHBondContact O-CA 3.28Å; D518-S521 PolarHBondContact O-N 3.39Å; D518-S521 PolarHBondContact O-OG 3.06Å
519	K	87.5	Confident	92	Very high	124 Å²	124	26.1 Å²	26.1	54%	0.539	14%	0.14	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.8	-35.6	-179.3	-172.7	-173.7	-176	172.9	0	114.5	D243 L517	D243-K519 HydrophobicContact CB-CD 3.69Å; D243-K519 IonicContact OD2-NZ 2.68Å; D243-K519 PolarHBondContact OD2-NZ 2.92Å; L517-K519 PolarHBondContact O-N 3.16Å
520	S	86.7	Confident	92	Very high	52 Å²	52	28.7 Å²	28.7	36%	0.364	15%	0.15	S	C	.	.	T	Hydrogen-bonded Turn	trans	-99.9	-11.6	169.1	55.1	0	0	0	0	112.3	L517 D518 S522 K600	L517-S520 PolarHBondContact O-N 3.38Å; L517-S520 PolarHBondContact O-OG 2.84Å; D518-S520 PolarHBondContact O-N 2.71Å; S520-S522 VanDerWaalsContact C-N 3.28Å; S520-S522 WeakPolarHBondContact CB-OG 3.33Å; S520-S522 PolarHBondContact O-N 3.46Å; S520-S522 PolarHBondContact OG-OG 2.92Å; S520-K600 PolarHBondContact O-NZ 2.97Å
521	S	89.1	Confident	91.9	Very high	50 Å²	50	27.8 Å²	27.8	35%	0.35	15%	0.148	S	C	.	.	T	Hydrogen-bonded Turn	trans	48.2	49.5	-170.4	-23.5	0	0	0	0	111	Y516 L517 D518 K600	Y516-S521 VanDerWaalsContact CZ-C 3.45Å; Y516-S521 VanDerWaalsContact OH-C 3.23Å; Y516-S521 WeakPolarHBondContact OH-CA 3.13Å; Y516-S521 VanDerWaalsContact OH-CB 3.3Å; Y516-S521 WeakPolarHBondContact OH-CB 3.42Å; Y516-S521 PolarHBondContact OH-O 2.77Å; L517-S521 WeakPolarHBondContact O-CA 3.31Å; L517-S521 PolarHBondContact O-N 3.09Å; D518-S521 WeakPolarHBondContact O-CA 3.28Å; D518-S521 PolarHBondContact O-N 3.39Å; D518-S521 PolarHBondContact O-OG 3.06Å; S521-K600 WeakPolarHBondContact O-CD 3.38Å; S521-K600 WeakPolarHBondContact O-CE 3.49Å; S521-K600 PolarHBondContact O-NZ 3.32Å
522	S	90.6	Very high	91.7	Very high	25 Å²	25	28 Å²	28	18%	0.175	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.5	156.8	-174.3	63.1	0	0	0	0	112.3	L517 S520	L517-S522 PolarHBondContact N-O 3.31Å; L517-S522 PolarHBondContact O-N 3.31Å; S520-S522 VanDerWaalsContact C-N 3.28Å; S520-S522 WeakPolarHBondContact CB-OG 3.33Å; S520-S522 PolarHBondContact O-N 3.46Å; S520-S522 PolarHBondContact OG-OG 2.92Å
523	W	93.1	Very high	91.2	Very high	20 Å²	20	33.7 Å²	33.7	8%	0.076	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	121.9	175.8	-71.5	104	0	0	0	111.4	F305 R307 E514 Y516 E601	F305-W523 AromaticContact CD1-CH2 3.36Å; F305-W523 HydrophobicContact CD1-CH2 3.36Å; F305-W523 AromaticContact CD1-CZ2 3.7Å; F305-W523 HydrophobicContact CD1-CZ2 3.7Å; F305-W523 HydrophobicContact CD1-CZ3 4.32Å; F305-W523 AromaticContact CE1-CH2 3.44Å; F305-W523 HydrophobicContact CE1-CH2 3.44Å; F305-W523 VanDerWaalsContact CE1-CH2 3.44Å; F305-W523 AromaticContact CE1-CZ2 3.46Å; F305-W523 HydrophobicContact CE1-CZ2 3.46Å; F305-W523 VanDerWaalsContact CE1-CZ2 3.46Å; F305-W523 HydrophobicContact CG-CH2 4.19Å; F305-W523 HydrophobicContact CZ-CH2 4.3Å; F305-W523 HydrophobicContact CZ-CZ2 4.47Å; F305-W523 WeakPolarHBondContact O-CZ3 3.03Å; R307-W523 HydrophobicContact CB-CZ3 4.28Å; R307-W523 HydrophobicContact CG-CH2 3.73Å; R307-W523 HydrophobicContact CG-CZ2 4.42Å; R307-W523 HydrophobicContact CG-CZ3 3.85Å; R307-W523 VanDerWaalsContact CZ-CE2 3.44Å; R307-W523 VanDerWaalsContact NE-CZ2 3.28Å; R307-W523 VanDerWaalsContact NH1-CE2 3.26Å; R307-W523 VanDerWaalsContact NH1-NE1 3.2Å; E514-W523 HydrophobicContact CB-CE3 3.85Å; E514-W523 HydrophobicContact CB-CZ3 4.46Å; Y516-W523 AromaticContact CD2-CD1 3.89Å; Y516-W523 AromaticContact CD2-CD2 3.8Å; Y516-W523 HydrophobicContact CD2-CD2 3.8Å; Y516-W523 AromaticContact CD2-CE2 3.65Å; Y516-W523 HydrophobicContact CD2-CE3 4.44Å; Y516-W523 AromaticContact CD2-CG 3.96Å; Y516-W523 HydrophobicContact CD2-CG 3.96Å; Y516-W523 HydrophobicContact CD2-CZ2 4.19Å; Y516-W523 AromaticContact CD2-NE1 3.69Å; Y516-W523 HydrophobicContact CG-CD2 4.45Å; W523-E601 VanDerWaalsContact CD1-CD 3.43Å; W523-E601 PolarHBondContact NE1-OE2 3.41Å
524	V	93.7	Very high	90.4	Very high	3 Å²	3	35.1 Å²	35.1	2%	0.018	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	122	176.8	178.5	0	0	0	0	110	Q244 E514 V515 L517 V532 E533	Q244-V524 HydrophobicContact CG-CG2 4.38Å; E514-V524 WeakPolarHBondContact CA-O 3.2Å; V515-V524 PolarHBondContact N-O 2.82Å; V515-V524 PolarHBondContact O-N 3.43Å; L517-V524 HydrophobicContact CD1-CB 4.37Å; L517-V524 HydrophobicContact CD1-CG2 3.65Å; L517-V524 HydrophobicContact CG-CG2 4.17Å; V524-V532 HydrophobicContact CG1-CG1 3.53Å; V524-E533 HydrophobicContact CG1-CB 4.05Å; V524-E533 HydrophobicContact CG1-CG 4.41Å
525	C	94.8	Very high	89.8	Confident	6 Å²	6	37.4 Å²	37.4	4%	0.041	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.8	136.4	173	-176.5	0	0	0	0	110.9	L513 E533 P535 C538 Y565	L513-C525 CarbonylContact O-C 3.56Å; L513-C525 WeakPolarHBondContact O-CA 3.5Å; C525-E533 WeakPolarHBondContact O-CA 3.42Å; C525-E533 PolarHBondContact O-N 2.97Å; C525-P535 HydrophobicContact CB-CB 4Å; C525-P535 HydrophobicContact CB-CG 4.48Å; C525-C538 VanDerWaalsContact SG-SG 3.62Å; C525-Y565 WeakPolarHBondContact CB-OH 3.46Å; C525-Y565 PolarHBondContact SG-OH 3.33Å
526	V	94.8	Very high	89.3	Confident	2 Å²	2	43.4 Å²	43.4	1%	0.012	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	128.3	175.7	-168.8	0	0	0	0	110.4	L247 L251 F295 L513 V515 V532	L247-V526 HydrophobicContact CD1-CG2 4.37Å; L251-V526 HydrophobicContact CD2-CG1 3.81Å; F295-V526 HydrophobicContact CD1-CG1 4.49Å; F295-V526 HydrophobicContact CE1-CG1 3.78Å; L513-V526 PolarHBondContact N-O 3.32Å; L513-V526 PolarHBondContact O-N 3.08Å; V515-V526 HydrophobicContact CG2-CG2 4.07Å; V526-V532 HydrophobicContact CG1-CG2 4Å; V526-V532 HydrophobicContact CG2-CG1 4.4Å; V526-V532 HydrophobicContact CG2-CG2 4.31Å
527	D	93.5	Very high	88.8	Confident	1 Å²	1	45.1 Å²	45.1	1%	0.005	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	126.9	-179.5	179.5	-51.1	0	0	0	109.1	R255 H288 E529 H530 G531 V534 C538	R255-D527 PolarHBondContact NH2-O 3.41Å; H288-D527 IonicContact CE1-OD1 2.7Å; D527-E529 PolarHBondContact O-N 2.75Å; D527-E529 PolarHBondContact OD1-N 3.17Å; D527-H530 HydrophobicContact CB-CB 4.03Å; D527-H530 PolarHBondContact O-N 2.82Å; D527-H530 IonicContact OD1-CE1 3.17Å; D527-H530 IonicContact OD1-CG 3.46Å; D527-H530 PolarHBondContact OD1-N 2.85Å; D527-H530 IonicContact OD1-ND1 3.45Å; D527-H530 PolarHBondContact OD1-ND1 3.13Å; D527-H530 IonicContact OD2-CG 2.69Å; D527-H530 IonicContact OD2-ND1 3.75Å; D527-H530 PolarHBondContact OD2-ND1 3.24Å; D527-G531 PolarHBondContact N-O 3.49Å; D527-G531 PolarHBondContact O-N 3.4Å; D527-V534 HydrophobicContact CB-CG2 3.79Å; D527-C538 PolarHBondContact OD2-SG 2.87Å
528	V	90.9	Very high	88.5	Confident	4 Å²	4	44.9 Å²	44.9	2%	0.024	24%	0.237	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.2	-21.3	-172.3	-68	0	0	0	0	114	F254 R255 M291 T292 F295	F254-V528 HydrophobicContact CE1-CG1 4.46Å; R255-V528 PolarHBondContact NE-O 3.39Å; R255-V528 VanDerWaalsContact NH2-C 3.32Å; R255-V528 PolarHBondContact NH2-O 2.98Å; M291-V528 HydrophobicContact CB-CB 4.26Å; M291-V528 HydrophobicContact CB-CG2 3.77Å; T292-V528 WeakPolarHBondContact OG1-CG2 3.4Å; F295-V528 HydrophobicContact CB-CG1 3.7Å; F295-V528 HydrophobicContact CD1-CG1 4.06Å; F295-V528 HydrophobicContact CG-CG1 4.11Å
529	E	86.5	Confident	88.3	Confident	79 Å²	79	41.3 Å²	41.3	37%	0.369	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	-102	-35.9	174.6	-77.8	176.4	-129.6	0	0	112.8	R255 H288 D527	R255-E529 VanDerWaalsContact CZ-C 3.44Å; R255-E529 PolarHBondContact NH1-O 3.35Å; R255-E529 PolarHBondContact NH2-O 3.18Å; H288-E529 IonicContact CE1-OE1 2.79Å; H288-E529 IonicContact CG-OE1 3.18Å; H288-E529 IonicContact ND1-OE1 3.42Å; H288-E529 PolarHBondContact ND1-OE1 3.31Å; D527-E529 PolarHBondContact O-N 2.75Å; D527-E529 PolarHBondContact OD1-N 3.17Å
530	H	85.3	Confident	88.3	Confident	66 Å²	66	41.4 Å²	41.4	31%	0.306	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	-101.4	-29.8	-166.4	-58.8	90.3	0	0	0	115.1	R255 D527 V534 L537 N541	R255-H530 VanDerWaalsContact NH2-N 3.17Å; D527-H530 HydrophobicContact CB-CB 4.03Å; D527-H530 PolarHBondContact O-N 2.82Å; D527-H530 IonicContact OD1-CE1 3.17Å; D527-H530 IonicContact OD1-CG 3.46Å; D527-H530 PolarHBondContact OD1-N 2.85Å; D527-H530 IonicContact OD1-ND1 3.45Å; D527-H530 PolarHBondContact OD1-ND1 3.13Å; D527-H530 IonicContact OD2-CG 2.69Å; D527-H530 IonicContact OD2-ND1 3.75Å; D527-H530 PolarHBondContact OD2-ND1 3.24Å; H530-V534 HydrophobicContact CB-CG2 4.13Å; H530-L537 HydrophobicContact CB-CD2 3.75Å; H530-L537 HydrophobicContact CB-CG 4.05Å; H530-N541 PolarHBondContact CD2-ND2 3.31Å; H530-N541 PolarHBondContact CE1-ND2 3.03Å; H530-N541 PolarHBondContact ND1-ND2 2.75Å; H530-N541 PolarHBondContact NE2-ND2 2.98Å
531	G	89.5	Confident	88.3	Confident	12 Å²	12	41.3 Å²	41.3	12%	0.124	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	133.4	-160.1	169.2	0	0	0	0	0	115.4	D527 V534	D527-G531 PolarHBondContact N-O 3.49Å; D527-G531 PolarHBondContact O-N 3.4Å; G531-V534 WeakPolarHBondContact O-CG2 3.39Å
532	V	89.9	Confident	88.3	Confident	24 Å²	24	39.2 Å²	39.2	15%	0.145	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	141.9	177.5	179	0	0	0	0	109.5	Q244 L247 L251 V524 V526	Q244-V532 HydrophobicContact CB-CG1 4.48Å; L247-V532 HydrophobicContact CB-CG1 4.31Å; L247-V532 HydrophobicContact CB-CG2 4Å; L251-V532 HydrophobicContact CD2-CG2 3.96Å; V524-V532 HydrophobicContact CG1-CG1 3.53Å; V526-V532 HydrophobicContact CG1-CG2 4Å; V526-V532 HydrophobicContact CG2-CG1 4.4Å; V526-V532 HydrophobicContact CG2-CG2 4.31Å
533	E	84.8	Confident	88.3	Confident	119 Å²	119	40.4 Å²	40.4	56%	0.556	21%	0.209	S	C	*	.	S	Bend	trans	60.4	40.6	-177.2	-149.9	-177.8	-178.6	0	0	115	Q244 V524 C525 P535	Q244-E533 PolarHBondContact NE2-OE2 2.93Å; V524-E533 HydrophobicContact CG1-CB 4.05Å; V524-E533 HydrophobicContact CG1-CG 4.41Å; C525-E533 WeakPolarHBondContact O-CA 3.42Å; C525-E533 PolarHBondContact O-N 2.97Å; E533-P535 VanDerWaalsContact O-CD 3.22Å; E533-P535 WeakPolarHBondContact O-CD 3.38Å
534	V	80.9	Confident	88	Confident	31 Å²	31	42.3 Å²	42.3	19%	0.188	23%	0.23	C	C	.	.			trans	-111.3	39.4	-176.9	-61.3	0	0	0	0	115.9	D527 H530 G531 H536 L537 C538	D527-V534 HydrophobicContact CB-CG2 3.79Å; H530-V534 HydrophobicContact CB-CG2 4.13Å; G531-V534 WeakPolarHBondContact O-CG2 3.39Å; V534-H536 VanDerWaalsContact C-N 3.29Å; V534-H536 PolarHBondContact O-N 2.73Å; V534-H536 VanDerWaalsContact O-N 3.12Å; V534-L537 HydrophobicContact CB-CB 4.11Å; V534-L537 WeakPolarHBondContact O-CB 3.44Å; V534-L537 PolarHBondContact O-N 2.8Å; V534-C538 PolarHBondContact O-N 2.95Å
535	P	83.6	Confident	87.6	Confident	49 Å²	49	45.6 Å²	45.6	32%	0.318	25%	0.251	S	S	.	.	H	α-helix	trans	-61.4	-31.4	-168.3	27.2	-35.8	0	0	0	114.7	C525 E533 L537 S539 Y565	C525-P535 HydrophobicContact CB-CB 4Å; C525-P535 HydrophobicContact CB-CG 4.48Å; E533-P535 VanDerWaalsContact O-CD 3.22Å; E533-P535 WeakPolarHBondContact O-CD 3.38Å; P535-L537 VanDerWaalsContact C-N 3.31Å; P535-L537 PolarHBondContact O-N 2.98Å; P535-S539 PolarHBondContact O-N 3.03Å; P535-Y565 HydrophobicContact CB-CD1 4.09Å; P535-Y565 HydrophobicContact CB-CE1 3.54Å
536	H	84.3	Confident	87.4	Confident	127 Å²	127	45.8 Å²	45.8	59%	0.588	25%	0.251	S	S	*	.	H	α-helix	trans	-64.6	-34.8	173.2	169.9	-88.3	0	0	0	112.3	V534 S539 Q540	V534-H536 VanDerWaalsContact C-N 3.29Å; V534-H536 PolarHBondContact O-N 2.73Å; V534-H536 VanDerWaalsContact O-N 3.12Å; H536-S539 PolarHBondContact O-N 3.11Å; H536-S539 PolarHBondContact O-OG 3.31Å; H536-Q540 PolarHBondContact CE1-NE2 2.7Å; H536-Q540 PolarHBondContact NE2-NE2 3.49Å; H536-Q540 WeakPolarHBondContact O-CG 3.43Å; H536-Q540 PolarHBondContact O-N 2.7Å
537	L	83.8	Confident	87.1	Confident	58 Å²	58	46.3 Å²	46.3	30%	0.304	25%	0.254	S	S	.	.	H	α-helix	trans	-75.7	-39.8	-178.6	-170.1	44.2	0	0	0	111.1	H530 V534 P535 S539 Q540 N541	H530-L537 HydrophobicContact CB-CD2 3.75Å; H530-L537 HydrophobicContact CB-CG 4.05Å; V534-L537 HydrophobicContact CB-CB 4.11Å; V534-L537 WeakPolarHBondContact O-CB 3.44Å; V534-L537 PolarHBondContact O-N 2.8Å; P535-L537 VanDerWaalsContact C-N 3.31Å; P535-L537 PolarHBondContact O-N 2.98Å; L537-S539 VanDerWaalsContact C-N 3.29Å; L537-S539 PolarHBondContact O-N 3.11Å; L537-Q540 PolarHBondContact O-N 2.94Å; L537-N541 WeakPolarHBondContact CD1-ND2 3.39Å; L537-N541 WeakPolarHBondContact O-CB 3.45Å; L537-N541 VanDerWaalsContact O-CG 3.32Å; L537-N541 PolarHBondContact O-N 3.33Å; L537-N541 PolarHBondContact O-ND2 2.86Å
538	C	85.8	Confident	87.1	Confident	0 Å²	0	46.2 Å²	46.2	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-52.9	-48.3	167.7	-53.9	0	0	0	0	110.9	W512 C525 D527 V534 Q540 N541 A542 Y565	W512-C538 HydrophobicContact CD2-CB 3.9Å; W512-C538 HydrophobicContact CE3-CB 4.12Å; W512-C538 HydrophobicContact CG-CB 4.24Å; C525-C538 VanDerWaalsContact SG-SG 3.62Å; D527-C538 PolarHBondContact OD2-SG 2.87Å; V534-C538 PolarHBondContact O-N 2.95Å; C538-Q540 PolarHBondContact O-N 3.14Å; C538-Q540 VanDerWaalsContact O-N 3.12Å; C538-N541 PolarHBondContact O-N 2.79Å; C538-A542 WeakPolarHBondContact O-CB 3.34Å; C538-A542 PolarHBondContact O-N 2.77Å; C538-Y565 HydrophobicContact CB-CE1 4.35Å
539	S	85.5	Confident	87.3	Confident	16 Å²	16	46 Å²	46	11%	0.112	25%	0.253	C	S	.	.	H	α-helix	trans	-65.4	-13.7	177.6	79	0	0	0	0	115.7	P535 H536 L537 Y565	P535-S539 PolarHBondContact O-N 3.03Å; H536-S539 PolarHBondContact O-N 3.11Å; H536-S539 PolarHBondContact O-OG 3.31Å; L537-S539 VanDerWaalsContact C-N 3.29Å; L537-S539 PolarHBondContact O-N 3.11Å; S539-Y565 WeakPolarHBondContact CB-O 3.35Å
540	Q	87.1	Confident	87.8	Confident	125 Å²	125	42.3 Å²	42.3	58%	0.584	24%	0.235	S	C	*	.	H	α-helix	trans	-98.9	-24.2	175.7	-73.7	-169.6	-18.8	0	0	113.5	H536 L537 C538	H536-Q540 PolarHBondContact CE1-NE2 2.7Å; H536-Q540 PolarHBondContact NE2-NE2 3.49Å; H536-Q540 WeakPolarHBondContact O-CG 3.43Å; H536-Q540 PolarHBondContact O-N 2.7Å; L537-Q540 PolarHBondContact O-N 2.94Å; C538-Q540 PolarHBondContact O-N 3.14Å; C538-Q540 VanDerWaalsContact O-N 3.12Å
541	N	87.1	Confident	88.3	Confident	51 Å²	51	39.2 Å²	39.2	27%	0.273	22%	0.221	S	C	.	.	H	α-helix	trans	-97.3	-23.5	-177.7	-66.1	-20.4	0	0	0	113.1	G508 A509 H530 L537 C538	G508-N541 CarbonylContact C-O 3.56Å; G508-N541 WeakPolarHBondContact CA-O 3.25Å; A509-N541 HydrophobicContact CB-CB 4.04Å; A509-N541 PolarHBondContact N-O 3.35Å; H530-N541 PolarHBondContact CD2-ND2 3.31Å; H530-N541 PolarHBondContact CE1-ND2 3.03Å; H530-N541 PolarHBondContact ND1-ND2 2.75Å; H530-N541 PolarHBondContact NE2-ND2 2.98Å; L537-N541 WeakPolarHBondContact CD1-ND2 3.39Å; L537-N541 WeakPolarHBondContact O-CB 3.45Å; L537-N541 VanDerWaalsContact O-CG 3.32Å; L537-N541 PolarHBondContact O-N 3.33Å; L537-N541 PolarHBondContact O-ND2 2.86Å; C538-N541 PolarHBondContact O-N 2.79Å
542	A	89.3	Confident	88.7	Confident	6 Å²	6	38.6 Å²	38.6	5%	0.05	22%	0.215	C	C	.	.	S	Bend	trans	-64.5	153.8	169.6	0	0	0	0	0	112	D510 W512 C538 A544 L546	D510-A542 WeakPolarHBondContact OD1-CA 3.42Å; D510-A542 WeakPolarHBondContact OD1-CB 3.3Å; W512-A542 HydrophobicContact CZ3-CB 4.04Å; C538-A542 WeakPolarHBondContact O-CB 3.34Å; C538-A542 PolarHBondContact O-N 2.77Å; A542-A544 PolarHBondContact O-N 3.26Å; A542-L546 HydrophobicContact CB-CD1 4.15Å
543	T	89.9	Confident	88.8	Confident	49 Å²	49	38 Å²	38	30%	0.301	21%	0.212	S	C	.	.	P	Polyproline II helix	trans	-59.6	120.9	-179.6	-64.4	0	0	0	0	110.2	H313 G508 D510	H313-T543 WeakPolarHBondContact NE2-CB 3.43Å; H313-T543 PolarHBondContact NE2-O 2.9Å; G508-T543 PolarHBondContact N-OG1 3.13Å; D510-T543 WeakPolarHBondContact OD1-CB 3.28Å; D510-T543 PolarHBondContact OD1-N 3.12Å; D510-T543 PolarHBondContact OD1-OG1 3.47Å; D510-T543 VanDerWaalsContact OD2-CB 3.23Å; D510-T543 WeakPolarHBondContact OD2-CB 3.23Å; D510-T543 PolarHBondContact OD2-OG1 3.41Å
544	A	86.1	Confident	89.1	Confident	61 Å²	61	33.8 Å²	33.8	50%	0.504	20%	0.199	S	C	.	.	S	Bend	trans	-87.6	138	-179.5	0	0	0	0	0	111.5	A542	A542-A544 PolarHBondContact O-N 3.26Å
545	P	87.2	Confident	89.6	Confident	71 Å²	71	38.2 Å²	38.2	46%	0.461	22%	0.222	S	C	.	.	S	Bend	cis	-92	137.5	5.5	34.5	-32.8	0	0	0	113.6
546	L	88.8	Confident	90	Very high	10 Å²	10	36.7 Å²	36.7	5%	0.052	22%	0.215	C	C	.	.	P	Polyproline II helix	trans	-58.3	141.1	164.5	-75	70.6	0	0	0	109.6	A542 V549 R576	A542-L546 HydrophobicContact CB-CD1 4.15Å; L546-V549 HydrophobicContact CD2-CG2 4.14Å; L546-R576 PolarHBondContact O-NH2 2.94Å
547	T	89.6	Confident	90.5	Very high	13 Å²	13	34.3 Å²	34.3	8%	0.08	20%	0.203	C	C	.	.			trans	-147.1	-46.8	-178.1	46	0	0	0	0	112.3	R576 R577	T547-R576 HydrophobicContact CG2-CB 3.71Å; T547-R576 VanDerWaalsContact CG2-NE 3.32Å; T547-R577 WeakPolarHBondContact O-CD 3.33Å; T547-R577 PolarHBondContact O-NH1 3.38Å
548	Y	93.7	Very high	91.1	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	125.9	171.5	-52.3	-88.1	0	0	0	108.1	H199 L203 S311 L312 P314 R577 V578 W583	H199-Y548 AromaticContact CE1-CE2 3.94Å; H199-Y548 AromaticContact NE2-CE2 3.46Å; H199-Y548 WeakPolarHBondContact NE2-CE2 3.34Å; H199-Y548 AromaticContact NE2-CZ 3.53Å; H199-Y548 PolarHBondContact NE2-OH 3.48Å; L203-Y548 HydrophobicContact CD1-CD1 4.25Å; L203-Y548 HydrophobicContact CD1-CD2 3.89Å; L203-Y548 HydrophobicContact CD1-CE2 4.27Å; L203-Y548 HydrophobicContact CD1-CG 3.87Å; L203-Y548 HydrophobicContact CD2-CD1 3.94Å; L203-Y548 HydrophobicContact CD2-CD2 4.31Å; L203-Y548 HydrophobicContact CD2-CE1 3.56Å; L203-Y548 HydrophobicContact CD2-CE2 3.96Å; L203-Y548 HydrophobicContact CD2-CG 4.29Å; S311-Y548 WeakPolarHBondContact CA-O 3.25Å; L312-Y548 PolarHBondContact N-O 3.05Å; P314-Y548 HydrophobicContact CG-CD2 3.84Å; P314-Y548 HydrophobicContact CG-CE2 3.55Å; Y548-R577 HydrophobicContact CD1-CG 4.38Å; Y548-R577 HydrophobicContact CE1-CB 4.16Å; Y548-R577 HydrophobicContact CE1-CG 3.84Å; Y548-R577 HydrophobicContact CE2-CG 4.5Å; Y548-R577 WeakPolarHBondContact OH-CA 3.5Å; Y548-V578 HydrophobicContact CE1-CG2 4.3Å; Y548-V578 PolarHBondContact OH-N 2.91Å; Y548-W583 HydrophobicContact CD1-CH2 4.37Å; Y548-W583 HydrophobicContact CD1-CZ2 4.05Å
549	V	95.4	Very high	91.5	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	109.3	173.5	-179.6	0	0	0	0	105.9	V309 L310 W512 L546 L561 G562 Y565	V309-V549 HydrophobicContact CG1-CG1 3.55Å; L310-V549 CarbonylContact O-C 3.59Å; L310-V549 WeakPolarHBondContact O-CA 3.43Å; W512-V549 HydrophobicContact CH2-CG1 3.9Å; W512-V549 HydrophobicContact CH2-CG2 4.49Å; W512-V549 HydrophobicContact CZ2-CG1 3.63Å; L546-V549 HydrophobicContact CD2-CG2 4.14Å; V549-L561 HydrophobicContact CG1-CB 4.3Å; V549-L561 PolarHBondContact O-N 2.83Å; V549-G562 PolarHBondContact O-N 3.46Å; V549-Y565 HydrophobicContact CG1-CD2 3.88Å; V549-Y565 HydrophobicContact CG1-CG 4.21Å
550	V	96.4	Very high	91.9	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	129.9	-171.9	-172.7	0	0	0	0	109.5	L207 L310 L312 L558 W583	L207-V550 HydrophobicContact CD1-CB 4.35Å; L207-V550 HydrophobicContact CD1-CG1 3.89Å; L207-V550 HydrophobicContact CD1-CG2 4.44Å; L310-V550 PolarHBondContact N-O 2.96Å; L310-V550 PolarHBondContact O-N 3.37Å; L312-V550 HydrophobicContact CD1-CB 4.43Å; L312-V550 HydrophobicContact CD1-CG2 3.93Å; V550-L558 HydrophobicContact CG1-CB 4.46Å; V550-L558 HydrophobicContact CG1-CD2 4.02Å; V550-W583 HydrophobicContact CG2-CH2 4.19Å; V550-W583 HydrophobicContact CG2-CZ2 3.81Å
551	A	96.1	Very high	92.1	Very high	1 Å²	1	28.5 Å²	28.5	1%	0.008	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	140.8	168.8	0	0	0	0	0	110.9	R307 L308 V309 L558 K559 L561	R307-A551 HydrophobicContact CB-CB 4.08Å; R307-A551 HydrophobicContact CG-CB 4.14Å; L308-A551 CarbonylContact O-C 3.52Å; L308-A551 WeakPolarHBondContact O-CA 3.3Å; V309-A551 HydrophobicContact CG2-CB 4.14Å; A551-L558 WeakPolarHBondContact O-CA 3.33Å; A551-K559 PolarHBondContact N-O 2.95Å; A551-K559 PolarHBondContact O-N 3.47Å; A551-L561 HydrophobicContact CB-CD1 3.62Å; A551-L561 HydrophobicContact CB-CG 3.95Å
552	V	96.7	Very high	92.3	Very high	0 Å²	0	26 Å²	26	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	125.1	165.5	-157.6	0	0	0	0	107.8	M211 N214 R307 L308 L310 F557 L558	M211-V552 HydrophobicContact CG-CG1 4.39Å; N214-V552 HydrophobicContact CB-CB 3.87Å; N214-V552 HydrophobicContact CB-CG1 3.74Å; N214-V552 HydrophobicContact CB-CG2 4.38Å; N214-V552 VanDerWaalsContact CG-CG1 3.42Å; N214-V552 VanDerWaalsContact ND2-CG1 3.33Å; N214-V552 WeakPolarHBondContact ND2-CG1 3.34Å; N214-V552 PolarHBondContact OD1-O 3.33Å; R307-V552 CarbonylContact C-O 3.06Å; R307-V552 VanDerWaalsContact CA-O 3.22Å; R307-V552 WeakPolarHBondContact CA-O 3.43Å; L308-V552 PolarHBondContact N-O 3.44Å; L308-V552 PolarHBondContact O-N 2.89Å; L310-V552 HydrophobicContact CD1-CG2 4.14Å; V552-F557 WeakPolarHBondContact CA-O 3.44Å; V552-L558 HydrophobicContact CB-CD2 4.18Å; V552-L558 HydrophobicContact CG1-CD2 3.94Å; V552-L558 HydrophobicContact CG2-CD2 3.7Å
553	D	93.9	Very high	92.3	Very high	12 Å²	12	30 Å²	30	6%	0.064	17%	0.174	C	C	.	.			trans	-87.8	179	177.8	71.5	18.7	0	0	0	113.8	N214 F305 R307 D555 G556 F557	N214-D553 PolarHBondContact ND2-O 2.9Å; N214-D553 PolarHBondContact OD1-O 2.98Å; F305-D553 HydrophobicContact CE2-CB 4.46Å; F305-D553 HydrophobicContact CZ-CB 4.41Å; R307-D553 HydrophobicContact CG-CB 3.7Å; D553-D555 PolarHBondContact O-N 3.35Å; D553-D555 PolarHBondContact OD1-N 2.91Å; D553-D555 VanDerWaalsContact OD1-N 3.11Å; D553-G556 PolarHBondContact O-N 2.92Å; D553-G556 VanDerWaalsContact O-N 3.14Å; D553-G556 PolarHBondContact OD1-N 3.01Å; D553-F557 PolarHBondContact N-O 3.3Å; D553-F557 PolarHBondContact OD1-N 3.22Å
554	G	90.4	Very high	92.3	Very high	29 Å²	29	29.9 Å²	29.9	30%	0.299	17%	0.169	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.4	-29.2	-178.4	0	0	0	0	0	114.7	C306	C306-G554 PolarHBondContact O-N 3.17Å
555	D	91	Very high	92.5	Very high	124 Å²	124	27.2 Å²	27.2	66%	0.663	15%	0.146	S	C	*	.	T	Hydrogen-bonded Turn	trans	-85.3	-16.5	178.7	-59.9	-66.4	0	0	0	112	D553 F557	D553-D555 PolarHBondContact O-N 3.35Å; D553-D555 PolarHBondContact OD1-N 2.91Å; D553-D555 VanDerWaalsContact OD1-N 3.11Å; D555-F557 HydrophobicContact CB-CD2 3.83Å; D555-F557 HydrophobicContact CB-CE2 3.75Å
556	G	92.4	Very high	92.6	Very high	17 Å²	17	24 Å²	24	18%	0.175	13%	0.125	C	C	.	.			trans	104.8	8.2	175	0	0	0	0	0	114.5	D553	D553-G556 PolarHBondContact O-N 2.92Å; D553-G556 VanDerWaalsContact O-N 3.14Å; D553-G556 PolarHBondContact OD1-N 3.01Å
557	F	95.1	Very high	92.3	Very high	77 Å²	77	28 Å²	28	34%	0.338	15%	0.152	S	C	.	.			trans	-75.5	148.8	178.6	-59	-66.8	0	0	0	112	V552 D553 D555 F590 G592	V552-F557 WeakPolarHBondContact CA-O 3.44Å; D553-F557 PolarHBondContact N-O 3.3Å; D553-F557 PolarHBondContact OD1-N 3.22Å; D555-F557 HydrophobicContact CB-CD2 3.83Å; D555-F557 HydrophobicContact CB-CE2 3.75Å; F557-F590 CarbonylContact C-O 3.57Å; F557-F590 VanDerWaalsContact CA-O 3.24Å; F557-F590 WeakPolarHBondContact CA-O 3.3Å; F557-G592 VanDerWaalsContact CD1-CA 3.45Å
558	L	95.3	Very high	92.1	Very high	7 Å²	7	29.7 Å²	29.7	4%	0.037	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	144.6	-177.4	-64.7	-179	0	0	0	112.9	L207 M211 V550 A551 V552 L587 F590	L207-L558 HydrophobicContact CD1-CD1 3.87Å; L207-L558 HydrophobicContact CD1-CD2 4.08Å; L207-L558 HydrophobicContact CD2-CD1 3.86Å; L207-L558 HydrophobicContact CG-CD1 4.05Å; M211-L558 HydrophobicContact CE-CD1 4.48Å; M211-L558 HydrophobicContact CG-CD2 4Å; M211-L558 HydrophobicContact SD-CD1 4Å; M211-L558 HydrophobicContact SD-CD2 4.41Å; M211-L558 HydrophobicContact SD-CG 4.46Å; V550-L558 HydrophobicContact CG1-CB 4.46Å; V550-L558 HydrophobicContact CG1-CD2 4.02Å; A551-L558 WeakPolarHBondContact O-CA 3.33Å; V552-L558 HydrophobicContact CB-CD2 4.18Å; V552-L558 HydrophobicContact CG1-CD2 3.94Å; V552-L558 HydrophobicContact CG2-CD2 3.7Å; L558-L587 HydrophobicContact CB-CD2 4.22Å; L558-L587 HydrophobicContact CD1-CD2 3.73Å; L558-F590 HydrophobicContact CB-CB 4.13Å; L558-F590 HydrophobicContact CD1-CB 3.65Å; L558-F590 HydrophobicContact CD1-CD2 3.95Å; L558-F590 HydrophobicContact CD1-CG 3.97Å; L558-F590 HydrophobicContact CG-CB 3.78Å; L558-F590 PolarHBondContact N-O 2.86Å
559	K	93.9	Very high	91.8	Very high	42 Å²	42	31.1 Å²	31.1	18%	0.183	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.1	129.7	170.3	-163	170.5	-170.8	175.4	0	112.2	A551 L561 D598 E601	A551-K559 PolarHBondContact N-O 2.95Å; A551-K559 PolarHBondContact O-N 3.47Å; K559-L561 HydrophobicContact CD-CD2 4.19Å; K559-L561 HydrophobicContact CG-CD2 4.11Å; K559-L561 PolarHBondContact O-N 3.5Å; K559-D598 IonicContact NZ-OD1 2.68Å; K559-D598 PolarHBondContact NZ-OD1 2.68Å; K559-E601 IonicContact NZ-OE2 3.45Å; K559-E601 PolarHBondContact NZ-OE2 3.21Å
560	D	94.2	Very high	91.1	Very high	28 Å²	28	32.2 Å²	32.2	15%	0.15	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	112	173.1	-168.5	-31.8	0	0	0	110.1	G562 R577 W583 L587	D560-G562 WeakPolarHBondContact OD1-CA 3.17Å; D560-G562 PolarHBondContact OD1-N 2.91Å; D560-R577 IonicContact OD1-NH1 2.74Å; D560-R577 IonicContact OD2-CZ 2.7Å; D560-R577 IonicContact OD2-NH1 3.56Å; D560-R577 PolarHBondContact OD2-NH1 3.33Å; D560-R577 IonicContact OD2-NH2 2.66Å; D560-R577 PolarHBondContact OD2-NH2 2.87Å; D560-W583 PolarHBondContact OD2-NE1 3.38Å; D560-L587 HydrophobicContact CB-CD1 4.22Å
561	L	92.5	Very high	90.5	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	19%	0.187	C	C	.	.			trans	-101.4	15.2	177	-58.7	-171.7	0	0	0	112.6	V309 V549 A551 K559 R563 K564 Y565	V309-L561 HydrophobicContact CG1-CD1 4.32Å; V309-L561 HydrophobicContact CG2-CD1 4.14Å; V549-L561 HydrophobicContact CG1-CB 4.3Å; V549-L561 PolarHBondContact O-N 2.83Å; A551-L561 HydrophobicContact CB-CD1 3.62Å; A551-L561 HydrophobicContact CB-CG 3.95Å; K559-L561 HydrophobicContact CD-CD2 4.19Å; K559-L561 HydrophobicContact CG-CD2 4.11Å; K559-L561 PolarHBondContact O-N 3.5Å; L561-R563 PolarHBondContact O-N 3.34Å; L561-K564 HydrophobicContact CB-CB 4.23Å; L561-K564 HydrophobicContact CD1-CD 4.28Å; L561-K564 HydrophobicContact CD2-CD 4.24Å; L561-K564 WeakPolarHBondContact O-CA 3.49Å; L561-K564 VanDerWaalsContact O-CB 3.24Å; L561-K564 WeakPolarHBondContact O-CB 3.38Å; L561-K564 PolarHBondContact O-N 3.33Å; L561-Y565 HydrophobicContact CB-CD2 3.97Å; L561-Y565 HydrophobicContact CB-CE2 4.24Å; L561-Y565 HydrophobicContact CD1-CE2 4.09Å; L561-Y565 PolarHBondContact O-N 3.33Å; L561-Y565 VanDerWaalsContact O-N 3.09Å
562	G	90.9	Very high	89.8	Confident	0 Å²	0	36.6 Å²	36.6	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-52.8	-41.6	173.3	0	0	0	0	0	112	V549 D560 K564 Y565 D566 W569	V549-G562 PolarHBondContact O-N 3.46Å; D560-G562 WeakPolarHBondContact OD1-CA 3.17Å; D560-G562 PolarHBondContact OD1-N 2.91Å; G562-K564 PolarHBondContact O-N 2.99Å; G562-K564 VanDerWaalsContact O-N 3.13Å; G562-Y565 PolarHBondContact O-N 2.83Å; G562-D566 VanDerWaalsContact O-CB 3.23Å; G562-D566 WeakPolarHBondContact O-CB 3.3Å; G562-D566 PolarHBondContact O-N 3.27Å; G562-W569 VanDerWaalsContact C-CE3 3.43Å
563	R	89	Confident	89.1	Confident	90 Å²	90	36.6 Å²	36.6	34%	0.34	20%	0.204	S	C	.	.	H	α-helix	trans	-54.9	-30.2	172.6	-77.2	-172.6	-90	165	-1.7	114.2	L561 W569 E602 M609	L561-R563 PolarHBondContact O-N 3.34Å; R563-W569 HydrophobicContact CG-CD2 3.98Å; R563-W569 VanDerWaalsContact CG-CE2 3.41Å; R563-W569 HydrophobicContact CG-CG 4.29Å; R563-W569 HydrophobicContact CG-CH2 4.46Å; R563-W569 HydrophobicContact CG-CZ2 3.71Å; R563-E602 IonicContact CZ-OE1 3.21Å; R563-E602 IonicContact CZ-OE2 3.82Å; R563-E602 VanDerWaalsContact NH1-CD 3.26Å; R563-E602 IonicContact NH1-OE1 2.62Å; R563-E602 PolarHBondContact NH1-OE1 2.84Å; R563-E602 IonicContact NH1-OE2 2.74Å; R563-E602 PolarHBondContact NH1-OE2 2.78Å; R563-E602 IonicContact NH2-OE1 2.94Å; R563-E602 IonicContact NH2-OE2 2.63Å; R563-E602 PolarHBondContact NH2-OE2 3.38Å; R563-M609 WeakPolarHBondContact O-CE 3.36Å
564	K	89.3	Confident	88.6	Confident	45 Å²	45	40.7 Å²	40.7	20%	0.196	22%	0.218	C	C	.	.	H	α-helix	trans	-86.7	-43.2	-175.6	-164.3	171	-171.3	177	0	112	E514 L561 G562 E601 L605	E514-K564 VanDerWaalsContact OE1-CD 3.3Å; E514-K564 WeakPolarHBondContact OE1-CD 3.43Å; E514-K564 WeakPolarHBondContact OE1-CE 3.45Å; E514-K564 IonicContact OE1-NZ 3.6Å; E514-K564 PolarHBondContact OE1-NZ 3.45Å; E514-K564 IonicContact OE2-NZ 3.92Å; E514-K564 PolarHBondContact OE2-NZ 2.84Å; L561-K564 HydrophobicContact CB-CB 4.23Å; L561-K564 HydrophobicContact CD1-CD 4.28Å; L561-K564 HydrophobicContact CD2-CD 4.24Å; L561-K564 WeakPolarHBondContact O-CA 3.49Å; L561-K564 VanDerWaalsContact O-CB 3.24Å; L561-K564 WeakPolarHBondContact O-CB 3.38Å; L561-K564 PolarHBondContact O-N 3.33Å; G562-K564 PolarHBondContact O-N 2.99Å; G562-K564 VanDerWaalsContact O-N 3.13Å; K564-E601 IonicContact NZ-OE1 2.74Å; K564-E601 PolarHBondContact NZ-OE1 3.5Å; K564-L605 HydrophobicContact CB-CD2 3.64Å; K564-L605 HydrophobicContact CD-CD2 4.06Å; K564-L605 HydrophobicContact CG-CD2 3.67Å
565	Y	90.4	Very high	88.2	Confident	6 Å²	6	42.9 Å²	42.9	2%	0.024	22%	0.22	C	C	.	.	H	α-helix	trans	-105.4	-28.2	-169.6	-74.3	-83.5	0	0	0	115.6	V309 W512 E514 C525 P535 C538 S539 V549 L561 G562 P567	V309-Y565 HydrophobicContact CG1-CE2 4.27Å; W512-Y565 AromaticContact CE2-CD1 3.96Å; W512-Y565 AromaticContact CE2-CE1 3.61Å; W512-Y565 AromaticContact CE2-CZ 3.79Å; W512-Y565 HydrophobicContact CH2-CD1 4.44Å; W512-Y565 AromaticContact CZ2-CD1 3.53Å; W512-Y565 HydrophobicContact CZ2-CD1 3.53Å; W512-Y565 AromaticContact CZ2-CD2 3.97Å; W512-Y565 HydrophobicContact CZ2-CD2 3.97Å; W512-Y565 AromaticContact CZ2-CE1 3.69Å; W512-Y565 HydrophobicContact CZ2-CE1 3.69Å; W512-Y565 HydrophobicContact CZ2-CE2 4.14Å; W512-Y565 AromaticContact CZ2-CG 3.66Å; W512-Y565 HydrophobicContact CZ2-CG 3.66Å; W512-Y565 AromaticContact NE1-CE1 3.25Å; W512-Y565 AromaticContact NE1-CE2 3.72Å; W512-Y565 AromaticContact NE1-CZ 3.05Å; W512-Y565 PolarHBondContact NE1-OH 3.17Å; E514-Y565 WeakPolarHBondContact CG-OH 3.24Å; E514-Y565 VanDerWaalsContact OE1-CE2 3.29Å; E514-Y565 WeakPolarHBondContact OE1-CE2 3.5Å; E514-Y565 PolarHBondContact OE1-OH 2.98Å; C525-Y565 WeakPolarHBondContact CB-OH 3.46Å; C525-Y565 PolarHBondContact SG-OH 3.33Å; P535-Y565 HydrophobicContact CB-CD1 4.09Å; P535-Y565 HydrophobicContact CB-CE1 3.54Å; C538-Y565 HydrophobicContact CB-CE1 4.35Å; S539-Y565 WeakPolarHBondContact CB-O 3.35Å; V549-Y565 HydrophobicContact CG1-CD2 3.88Å; V549-Y565 HydrophobicContact CG1-CG 4.21Å; L561-Y565 HydrophobicContact CB-CD2 3.97Å; L561-Y565 HydrophobicContact CB-CE2 4.24Å; L561-Y565 HydrophobicContact CD1-CE2 4.09Å; L561-Y565 PolarHBondContact O-N 3.33Å; L561-Y565 VanDerWaalsContact O-N 3.09Å; G562-Y565 PolarHBondContact O-N 2.83Å; Y565-P567 VanDerWaalsContact O-CD 3.27Å; Y565-P567 WeakPolarHBondContact O-CD 3.34Å
566	D	88.9	Confident	88.1	Confident	2 Å²	2	40.1 Å²	40.1	1%	0.011	20%	0.2	C	C	.	.			trans	-81.2	114.2	-175.5	175.2	7.9	0	0	0	111.2	G562 T568 W569 S573	G562-D566 VanDerWaalsContact O-CB 3.23Å; G562-D566 WeakPolarHBondContact O-CB 3.3Å; G562-D566 PolarHBondContact O-N 3.27Å; D566-T568 PolarHBondContact O-N 3.35Å; D566-T568 VanDerWaalsContact OD1-CA 3.32Å; D566-T568 WeakPolarHBondContact OD1-CA 3.33Å; D566-T568 PolarHBondContact OD1-N 3.33Å; D566-T568 PolarHBondContact OD1-OG1 2.86Å; D566-W569 HydrophobicContact CB-CB 4.14Å; D566-W569 HydrophobicContact CB-CE3 4.45Å; D566-W569 VanDerWaalsContact CG-N 3.3Å; D566-W569 WeakPolarHBondContact O-CB 3.36Å; D566-W569 PolarHBondContact O-N 3.04Å; D566-W569 PolarHBondContact OD1-N 2.96Å; D566-W569 WeakPolarHBondContact OD2-CA 3.33Å; D566-W569 PolarHBondContact OD2-N 3.21Å; D566-S573 PolarHBondContact OD1-OG 2.87Å; D566-S573 VanDerWaalsContact OD1-OG 3.06Å; D566-S573 WeakPolarHBondContact OD2-CB 3.4Å; D566-S573 PolarHBondContact OD2-OG 2.97Å
567	P	84.2	Confident	88	Confident	95 Å²	95	39.8 Å²	39.8	62%	0.617	19%	0.194	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.5	-22.9	179	29.2	-35.7	0	0	0	112.3	Y565	Y565-P567 VanDerWaalsContact O-CD 3.27Å; Y565-P567 WeakPolarHBondContact O-CD 3.34Å
568	T	85.4	Confident	87.8	Confident	49 Å²	49	36.6 Å²	36.6	30%	0.301	18%	0.18	S	C	.	.	T	Hydrogen-bonded Turn	trans	-103.2	13.1	-178.8	44.8	0	0	0	0	114	D566 M570 T571 A572 S573	D566-T568 PolarHBondContact O-N 3.35Å; D566-T568 VanDerWaalsContact OD1-CA 3.32Å; D566-T568 WeakPolarHBondContact OD1-CA 3.33Å; D566-T568 PolarHBondContact OD1-N 3.33Å; D566-T568 PolarHBondContact OD1-OG1 2.86Å; T568-M570 VanDerWaalsContact C-N 3.29Å; T568-M570 PolarHBondContact O-N 2.84Å; T568-T571 CarbonylContact O-C 3.6Å; T568-T571 PolarHBondContact O-N 3.2Å; T568-T571 PolarHBondContact O-OG1 3.07Å; T568-A572 PolarHBondContact O-N 3.34Å; T568-S573 WeakPolarHBondContact CB-OG 3.4Å; T568-S573 PolarHBondContact O-N 3.36Å; T568-S573 PolarHBondContact O-OG 3.26Å; T568-S573 PolarHBondContact OG1-OG 2.85Å
569	W	85.6	Confident	87.6	Confident	29 Å²	29	40.7 Å²	40.7	11%	0.11	20%	0.202	C	C	.	.	I	π-helix	trans	-49.5	-46.4	-178.3	178.6	-97	0	0	0	113.5	G562 R563 D566 T571 R574	G562-W569 VanDerWaalsContact C-CE3 3.43Å; R563-W569 HydrophobicContact CG-CD2 3.98Å; R563-W569 VanDerWaalsContact CG-CE2 3.41Å; R563-W569 HydrophobicContact CG-CG 4.29Å; R563-W569 HydrophobicContact CG-CH2 4.46Å; R563-W569 HydrophobicContact CG-CZ2 3.71Å; D566-W569 HydrophobicContact CB-CB 4.14Å; D566-W569 HydrophobicContact CB-CE3 4.45Å; D566-W569 VanDerWaalsContact CG-N 3.3Å; D566-W569 WeakPolarHBondContact O-CB 3.36Å; D566-W569 PolarHBondContact O-N 3.04Å; D566-W569 PolarHBondContact OD1-N 2.96Å; D566-W569 WeakPolarHBondContact OD2-CA 3.33Å; D566-W569 PolarHBondContact OD2-N 3.21Å; W569-T571 VanDerWaalsContact C-N 3.26Å; W569-T571 PolarHBondContact O-N 2.93Å; W569-R574 WeakPolarHBondContact O-CG 3.41Å
570	M	82.6	Confident	87.4	Confident	24 Å²	24	40.8 Å²	40.8	12%	0.118	21%	0.205	C	C	.	.	I	π-helix	trans	-81.5	-1.3	-175.4	-55.8	-170	-55	0	0	113.7	T568 M609 K612 H624 P625 L626	T568-M570 VanDerWaalsContact C-N 3.29Å; T568-M570 PolarHBondContact O-N 2.84Å; M570-M609 HydrophobicContact SD-CB 4.39Å; M570-M609 HydrophobicContact SD-SD 4.42Å; M570-K612 HydrophobicContact CE-CB 4.05Å; M570-K612 HydrophobicContact CE-CD 3.78Å; M570-H624 WeakPolarHBondContact CB-NE2 3.49Å; M570-H624 PolarHBondContact O-CD2 3.44Å; M570-P625 HydrophobicContact CB-CG 3.86Å; M570-P625 HydrophobicContact CG-CG 4.01Å; M570-P625 WeakPolarHBondContact O-CD 3.46Å; M570-L626 HydrophobicContact SD-CD1 3.94Å
571	T	82.8	Confident	87.3	Confident	48 Å²	48	43.9 Å²	43.9	29%	0.294	22%	0.218	S	C	.	.	I	π-helix	trans	-132.9	-96.1	-172.9	58.2	0	0	0	0	112	T568 W569 S573 E620	T568-T571 CarbonylContact O-C 3.6Å; T568-T571 PolarHBondContact O-N 3.2Å; T568-T571 PolarHBondContact O-OG1 3.07Å; W569-T571 VanDerWaalsContact C-N 3.26Å; W569-T571 PolarHBondContact O-N 2.93Å; T571-S573 PolarHBondContact O-N 2.83Å; T571-E620 HydrophobicContact CG2-CB 3.89Å; T571-E620 HydrophobicContact CG2-CG 4.1Å
572	A	80.4	Confident	87.5	Confident	44 Å²	44	46.6 Å²	46.6	36%	0.364	23%	0.228	S	C	.	.	I	π-helix	trans	-75.8	-22.1	-167.3	0	0	0	0	0	113.9	T568 R576	T568-A572 PolarHBondContact O-N 3.34Å; A572-R576 VanDerWaalsContact C-NH1 3.27Å; A572-R576 PolarHBondContact O-NH1 2.68Å; A572-R576 VanDerWaalsContact O-NH1 3.08Å
573	S	83.6	Confident	87.6	Confident	0 Å²	0	46.9 Å²	46.9	0%	0	23%	0.23	C	C	.	.	I	π-helix	trans	-77.6	-38.1	-171.7	-57.8	0	0	0	0	114.5	D566 T568 T571 K575 R576 R577	D566-S573 PolarHBondContact OD1-OG 2.87Å; D566-S573 VanDerWaalsContact OD1-OG 3.06Å; D566-S573 WeakPolarHBondContact OD2-CB 3.4Å; D566-S573 PolarHBondContact OD2-OG 2.97Å; T568-S573 WeakPolarHBondContact CB-OG 3.4Å; T568-S573 PolarHBondContact O-N 3.36Å; T568-S573 PolarHBondContact O-OG 3.26Å; T568-S573 PolarHBondContact OG1-OG 2.85Å; T571-S573 PolarHBondContact O-N 2.83Å; S573-K575 PolarHBondContact O-N 2.9Å; S573-R576 WeakPolarHBondContact O-CA 3.35Å; S573-R576 WeakPolarHBondContact O-CB 3.37Å; S573-R576 PolarHBondContact O-N 3.06Å; S573-R576 PolarHBondContact OG-NH2 3.28Å; S573-R577 PolarHBondContact O-N 3.38Å; S573-R577 VanDerWaalsContact O-N 3.14Å
574	R	82.5	Confident	87.9	Confident	98 Å²	98	49 Å²	49	37%	0.37	24%	0.243	S	C	.	.	G	3₁₀ helix	trans	-58.7	-34.3	173.9	-62.4	-173.3	76.3	-165.1	7.1	111.3	W569 R576 R577 D580	W569-R574 WeakPolarHBondContact O-CG 3.41Å; R574-R576 PolarHBondContact O-N 2.82Å; R574-R577 PolarHBondContact O-N 2.9Å; R574-D580 IonicContact CZ-OD2 3.83Å; R574-D580 IonicContact NE-OD2 2.72Å; R574-D580 PolarHBondContact NE-OD2 2.94Å; R574-D580 IonicContact NH2-OD2 3.92Å; R574-D580 PolarHBondContact NH2-OD2 2.9Å
575	K	82.9	Confident	88.1	Confident	75 Å²	75	50.7 Å²	50.7	33%	0.326	26%	0.255	S	S	.	.	G	3₁₀ helix	trans	-65.2	-15.7	172.3	-71.4	-160.5	169.4	-150.5	0	114.7	D133 K318 S573	D133-K575 VanDerWaalsContact CG-NZ 3.28Å; D133-K575 IonicContact OD1-NZ 2.64Å; D133-K575 PolarHBondContact OD1-NZ 2.78Å; D133-K575 IonicContact OD2-NZ 3.57Å; D133-K575 PolarHBondContact OD2-NZ 3.34Å; K318-K575 WeakPolarHBondContact CD-O 3.35Å; K318-K575 VanDerWaalsContact CE-O 3.26Å; K318-K575 WeakPolarHBondContact CE-O 3.08Å; K318-K575 PolarHBondContact NZ-O 2.85Å; S573-K575 PolarHBondContact O-N 2.9Å
576	R	87.6	Confident	88.4	Confident	66 Å²	66	51.5 Å²	51.5	25%	0.249	26%	0.26	C	S	.	.	G	3₁₀ helix	trans	-104.3	-11.4	177.7	-61.1	-170.7	-59.8	-84.5	2.7	113.8	F317 L546 T547 A572 S573 R574	F317-R576 WeakPolarHBondContact CE1-O 3.42Å; L546-R576 PolarHBondContact O-NH2 2.94Å; T547-R576 HydrophobicContact CG2-CB 3.71Å; T547-R576 VanDerWaalsContact CG2-NE 3.32Å; A572-R576 VanDerWaalsContact C-NH1 3.27Å; A572-R576 PolarHBondContact O-NH1 2.68Å; A572-R576 VanDerWaalsContact O-NH1 3.08Å; S573-R576 WeakPolarHBondContact O-CA 3.35Å; S573-R576 WeakPolarHBondContact O-CB 3.37Å; S573-R576 PolarHBondContact O-N 3.06Å; S573-R576 PolarHBondContact OG-NH2 3.28Å; R574-R576 PolarHBondContact O-N 2.82Å
577	R	90.8	Very high	88.6	Confident	11 Å²	11	52 Å²	52	4%	0.042	26%	0.262	C	S	.	.	S	Bend	trans	-85.9	159.3	177.2	-71.6	171	61.9	109.1	-10.7	110.9	F317 T547 Y548 D560 S573 R574 D580 W583	F317-R577 WeakPolarHBondContact CZ-O 3.35Å; T547-R577 WeakPolarHBondContact O-CD 3.33Å; T547-R577 PolarHBondContact O-NH1 3.38Å; Y548-R577 HydrophobicContact CD1-CG 4.38Å; Y548-R577 HydrophobicContact CE1-CB 4.16Å; Y548-R577 HydrophobicContact CE1-CG 3.84Å; Y548-R577 HydrophobicContact CE2-CG 4.5Å; Y548-R577 WeakPolarHBondContact OH-CA 3.5Å; D560-R577 IonicContact OD1-NH1 2.74Å; D560-R577 IonicContact OD2-CZ 2.7Å; D560-R577 IonicContact OD2-NH1 3.56Å; D560-R577 PolarHBondContact OD2-NH1 3.33Å; D560-R577 IonicContact OD2-NH2 2.66Å; D560-R577 PolarHBondContact OD2-NH2 2.87Å; S573-R577 PolarHBondContact O-N 3.38Å; S573-R577 VanDerWaalsContact O-N 3.14Å; R574-R577 PolarHBondContact O-N 2.9Å; R577-D580 IonicContact NE-OD1 2.66Å; R577-W583 VanDerWaalsContact NH2-NE1 3.19Å
578	V	91.9	Very high	89.1	Confident	9 Å²	9	53.9 Å²	53.9	6%	0.055	26%	0.263	C	S	.	.	P	Polyproline II helix	trans	-64.3	171.8	164.4	-66.4	0	0	0	0	110.8	H199 K200 F317 Y548 D580 W582 W583	H199-V578 VanDerWaalsContact CD2-CG1 3.41Å; H199-V578 WeakPolarHBondContact CD2-CG1 3.49Å; K200-V578 HydrophobicContact CG-CG1 3.89Å; F317-V578 HydrophobicContact CE1-CG1 4.41Å; Y548-V578 HydrophobicContact CE1-CG2 4.3Å; Y548-V578 PolarHBondContact OH-N 2.91Å; V578-D580 PolarHBondContact O-N 3.2Å; V578-W582 HydrophobicContact CB-CE3 4.31Å; V578-W582 HydrophobicContact CG2-CE3 3.62Å; V578-W582 HydrophobicContact CG2-CZ3 3.86Å; V578-W583 HydrophobicContact CG2-CB 4.33Å
579	D	90.1	Very high	89.6	Confident	94 Å²	94	56 Å²	56	50%	0.503	28%	0.278	S	S	.	.	P	Polyproline II helix	trans	-47.3	129.6	167.5	173.2	61.2	0	0	0	112.2	E581 W582 W583	D579-E581 WeakPolarHBondContact OD2-CB 3.34Å; D579-E581 PolarHBondContact OD2-N 3.44Å; D579-W582 HydrophobicContact CB-CB 4.35Å; D579-W582 PolarHBondContact OD2-N 2.87Å; D579-W583 PolarHBondContact O-N 3.35Å
580	D	90.4	Very high	90	Very high	43 Å²	43	58.7 Å²	58.7	23%	0.23	29%	0.291	C	S	.	.	H	α-helix	trans	-69	-33.6	-175.5	-73.8	-39.8	0	0	0	110.9	R574 R577 V578 W583 E584	R574-D580 IonicContact CZ-OD2 3.83Å; R574-D580 IonicContact NE-OD2 2.72Å; R574-D580 PolarHBondContact NE-OD2 2.94Å; R574-D580 IonicContact NH2-OD2 3.92Å; R574-D580 PolarHBondContact NH2-OD2 2.9Å; R577-D580 IonicContact NE-OD1 2.66Å; V578-D580 PolarHBondContact O-N 3.2Å; D580-W583 PolarHBondContact O-N 3.49Å; D580-W583 VanDerWaalsContact O-N 3.17Å; D580-E584 WeakPolarHBondContact O-CG 3.41Å; D580-E584 PolarHBondContact O-N 3.05Å
581	E	92.6	Very high	90.4	Very high	94 Å²	94	63.2 Å²	63.2	44%	0.439	31%	0.313	S	S	.	.	H	α-helix	trans	-65	-44	178.2	-159.6	-165.4	-175	0	0	111.3	K397 D579 W583 E584 D585	K397-E581 WeakPolarHBondContact CE-OE1 3.3Å; K397-E581 WeakPolarHBondContact CE-OE2 3.49Å; K397-E581 IonicContact NZ-OE1 3.57Å; K397-E581 PolarHBondContact NZ-OE1 3.41Å; K397-E581 IonicContact NZ-OE2 3.58Å; D579-E581 WeakPolarHBondContact OD2-CB 3.34Å; D579-E581 PolarHBondContact OD2-N 3.44Å; E581-W583 VanDerWaalsContact C-N 3.28Å; E581-W583 PolarHBondContact O-N 3.05Å; E581-E584 PolarHBondContact O-N 3.13Å; E581-D585 WeakPolarHBondContact O-CB 3.37Å; E581-D585 PolarHBondContact O-N 2.92Å
582	W	95	Very high	90.7	Very high	56 Å²	56	62.5 Å²	62.5	21%	0.212	32%	0.315	C	S	.	.	H	α-helix	trans	-63.3	-32.5	173	179.7	82.8	0	0	0	113	K200 L203 L204 V578 D579 T586	K200-W582 HydrophobicContact CB-CH2 3.7Å; K200-W582 HydrophobicContact CB-CZ2 3.8Å; K200-W582 HydrophobicContact CB-CZ3 4.35Å; K200-W582 HydrophobicContact CD-CD2 3.89Å; K200-W582 HydrophobicContact CD-CE3 4.25Å; K200-W582 HydrophobicContact CD-CG 4.47Å; K200-W582 HydrophobicContact CD-CH2 4.16Å; K200-W582 HydrophobicContact CD-CZ2 3.78Å; K200-W582 HydrophobicContact CD-CZ3 4.37Å; K200-W582 HydrophobicContact CG-CD2 4.26Å; K200-W582 HydrophobicContact CG-CE3 4.13Å; K200-W582 HydrophobicContact CG-CH2 3.66Å; K200-W582 HydrophobicContact CG-CZ2 3.79Å; K200-W582 HydrophobicContact CG-CZ3 3.84Å; K200-W582 VanDerWaalsContact NZ-CD1 3.34Å; K200-W582 VanDerWaalsContact NZ-CG 3.27Å; L203-W582 HydrophobicContact CD2-CZ3 4.41Å; L204-W582 HydrophobicContact CD1-CH2 4.43Å; L204-W582 HydrophobicContact CD1-CZ2 4.24Å; L204-W582 HydrophobicContact CD2-CH2 4.43Å; L204-W582 HydrophobicContact CG-CH2 4.22Å; V578-W582 HydrophobicContact CB-CE3 4.31Å; V578-W582 HydrophobicContact CG2-CE3 3.62Å; V578-W582 HydrophobicContact CG2-CZ3 3.86Å; D579-W582 HydrophobicContact CB-CB 4.35Å; D579-W582 PolarHBondContact OD2-N 2.87Å; W582-T586 HydrophobicContact CH2-CG2 4.39Å; W582-T586 VanDerWaalsContact O-CB 3.28Å; W582-T586 WeakPolarHBondContact O-CB 3.46Å; W582-T586 PolarHBondContact O-N 2.78Å; W582-T586 VanDerWaalsContact O-N 3.12Å; W582-T586 PolarHBondContact O-OG1 3.31Å
583	W	94.7	Very high	91	Very high	7 Å²	7	64.4 Å²	64.4	3%	0.027	32%	0.324	C	S	.	.	H	α-helix	trans	-74.9	-39.5	179.1	-177.2	-115.6	0	0	0	112.1	L203 L207 Y548 V550 D560 R577 V578 D579 D580 E581 T586 L587	L203-W583 HydrophobicContact CD1-CH2 4.15Å; L203-W583 HydrophobicContact CD1-CZ3 4.27Å; L203-W583 HydrophobicContact CD2-CE3 3.86Å; L203-W583 HydrophobicContact CD2-CH2 4.08Å; L203-W583 HydrophobicContact CD2-CZ3 3.47Å; L203-W583 VanDerWaalsContact CD2-CZ3 3.47Å; L203-W583 HydrophobicContact CG-CH2 4.14Å; L203-W583 HydrophobicContact CG-CZ3 3.74Å; L207-W583 HydrophobicContact CD2-CH2 4.41Å; Y548-W583 HydrophobicContact CD1-CH2 4.37Å; Y548-W583 HydrophobicContact CD1-CZ2 4.05Å; V550-W583 HydrophobicContact CG2-CH2 4.19Å; V550-W583 HydrophobicContact CG2-CZ2 3.81Å; D560-W583 PolarHBondContact OD2-NE1 3.38Å; R577-W583 VanDerWaalsContact NH2-NE1 3.19Å; V578-W583 HydrophobicContact CG2-CB 4.33Å; D579-W583 PolarHBondContact O-N 3.35Å; D580-W583 PolarHBondContact O-N 3.49Å; D580-W583 VanDerWaalsContact O-N 3.17Å; E581-W583 VanDerWaalsContact C-N 3.28Å; E581-W583 PolarHBondContact O-N 3.05Å; W583-T586 HydrophobicContact CE3-CG2 4.36Å; W583-T586 HydrophobicContact CZ3-CG2 4.36Å; W583-T586 WeakPolarHBondContact O-CB 3.32Å; W583-T586 PolarHBondContact O-N 2.97Å; W583-L587 HydrophobicContact CD2-CD1 4.35Å; W583-L587 HydrophobicContact CD2-CG 4.37Å; W583-L587 HydrophobicContact CH2-CD2 4.17Å; W583-L587 HydrophobicContact CZ2-CD1 3.9Å; W583-L587 HydrophobicContact CZ2-CD2 4.12Å; W583-L587 HydrophobicContact CZ2-CG 4.21Å; W583-L587 PolarHBondContact O-N 3.19Å
584	E	93.4	Very high	91	Very high	134 Å²	134	71.2 Å²	71.2	63%	0.626	36%	0.355	S	S	*	.	H	α-helix	trans	-64.5	-48.4	173	-70.7	175.8	178.7	0	0	111	D580 E581 T586 L587 E588	D580-E584 WeakPolarHBondContact O-CG 3.41Å; D580-E584 PolarHBondContact O-N 3.05Å; E581-E584 PolarHBondContact O-N 3.13Å; E584-T586 PolarHBondContact O-N 2.62Å; E584-T586 VanDerWaalsContact O-N 3.13Å; E584-L587 PolarHBondContact O-N 3.2Å; E584-L587 VanDerWaalsContact O-N 3.13Å; E584-E588 PolarHBondContact O-N 3.18Å
585	D	95.4	Very high	91.2	Very high	81 Å²	81	69.1 Å²	69.1	43%	0.433	35%	0.351	S	S	.	.	H	α-helix	trans	-51.4	-34.7	170.3	-80.1	9.3	0	0	0	112.4	K397 E581	K397-D585 IonicContact NZ-OD1 2.68Å; K397-D585 PolarHBondContact NZ-OD1 3.22Å; K397-D585 IonicContact NZ-OD2 3.74Å; K397-D585 PolarHBondContact NZ-OD2 3.37Å; E581-D585 WeakPolarHBondContact O-CB 3.37Å; E581-D585 PolarHBondContact O-N 2.92Å
586	T	95.4	Very high	91.5	Very high	22 Å²	22	71.8 Å²	71.8	14%	0.135	37%	0.365	C	S	.	.	H	α-helix	trans	-79.4	-31.6	-176.7	-66.7	0	0	0	0	112.7	L204 W582 W583 E584	L204-T586 HydrophobicContact CD2-CG2 3.58Å; W582-T586 HydrophobicContact CH2-CG2 4.39Å; W582-T586 VanDerWaalsContact O-CB 3.28Å; W582-T586 WeakPolarHBondContact O-CB 3.46Å; W582-T586 PolarHBondContact O-N 2.78Å; W582-T586 VanDerWaalsContact O-N 3.12Å; W582-T586 PolarHBondContact O-OG1 3.31Å; W583-T586 HydrophobicContact CE3-CG2 4.36Å; W583-T586 HydrophobicContact CZ3-CG2 4.36Å; W583-T586 WeakPolarHBondContact O-CB 3.32Å; W583-T586 PolarHBondContact O-N 2.97Å; E584-T586 PolarHBondContact O-N 2.62Å; E584-T586 VanDerWaalsContact O-N 3.13Å
587	L	94.4	Very high	91.6	Very high	12 Å²	12	72.6 Å²	72.6	6%	0.063	37%	0.368	C	S	.	.	H	α-helix	trans	-88.6	-28.9	179.5	-67.7	-176.9	0	0	0	113.1	L207 L558 D560 W583 E584 P589 F590 M591	L207-L587 HydrophobicContact CD2-CD2 4.09Å; L558-L587 HydrophobicContact CB-CD2 4.22Å; L558-L587 HydrophobicContact CD1-CD2 3.73Å; D560-L587 HydrophobicContact CB-CD1 4.22Å; W583-L587 HydrophobicContact CD2-CD1 4.35Å; W583-L587 HydrophobicContact CD2-CG 4.37Å; W583-L587 HydrophobicContact CH2-CD2 4.17Å; W583-L587 HydrophobicContact CZ2-CD1 3.9Å; W583-L587 HydrophobicContact CZ2-CD2 4.12Å; W583-L587 HydrophobicContact CZ2-CG 4.21Å; W583-L587 PolarHBondContact O-N 3.19Å; E584-L587 PolarHBondContact O-N 3.2Å; E584-L587 VanDerWaalsContact O-N 3.13Å; L587-P589 VanDerWaalsContact C-N 3.34Å; L587-P589 VanDerWaalsContact O-N 3.14Å; L587-F590 CarbonylContact O-C 3.54Å; L587-F590 WeakPolarHBondContact O-CA 3.43Å; L587-F590 PolarHBondContact O-N 3.16Å; L587-M591 PolarHBondContact O-N 2.92Å
588	E	94.4	Very high	91.5	Very high	136 Å²	136	73.5 Å²	73.5	64%	0.636	37%	0.374	S	S	*	.	G	3₁₀ helix	trans	-43	-47.3	-177.9	-178.1	-172.4	-129.1	0	0	114.2	E584 F590 M591	E584-E588 PolarHBondContact O-N 3.18Å; E588-F590 PolarHBondContact O-N 3.19Å; E588-M591 PolarHBondContact O-N 2.95Å
589	P	94.3	Very high	91.4	Very high	94 Å²	94	75.6 Å²	75.6	61%	0.61	38%	0.382	S	S	*	.	G	3₁₀ helix	trans	-66.3	-10.3	-177.9	-20.5	34.5	0	0	0	115	L587	L587-P589 VanDerWaalsContact C-N 3.34Å; L587-P589 VanDerWaalsContact O-N 3.14Å
590	F	94.1	Very high	91.5	Very high	85 Å²	85	75.2 Å²	75.2	37%	0.373	38%	0.376	S	S	.	.	G	3₁₀ helix	trans	-122.9	4.4	-175.9	-51.4	-69.8	0	0	0	112.7	M211 F557 L558 L587 E588	M211-F590 HydrophobicContact CE-CD1 3.52Å; M211-F590 HydrophobicContact CE-CE1 3.82Å; M211-F590 HydrophobicContact CE-CG 4.05Å; M211-F590 HydrophobicContact SD-CD1 4.47Å; F557-F590 CarbonylContact C-O 3.57Å; F557-F590 VanDerWaalsContact CA-O 3.24Å; F557-F590 WeakPolarHBondContact CA-O 3.3Å; L558-F590 HydrophobicContact CB-CB 4.13Å; L558-F590 HydrophobicContact CD1-CB 3.65Å; L558-F590 HydrophobicContact CD1-CD2 3.95Å; L558-F590 HydrophobicContact CD1-CG 3.97Å; L558-F590 HydrophobicContact CG-CB 3.78Å; L558-F590 PolarHBondContact N-O 2.86Å; L587-F590 CarbonylContact O-C 3.54Å; L587-F590 WeakPolarHBondContact O-CA 3.43Å; L587-F590 PolarHBondContact O-N 3.16Å; E588-F590 PolarHBondContact O-N 3.19Å
591	M	92.4	Very high	91.5	Very high	119 Å²	119	73.6 Å²	73.6	59%	0.586	37%	0.367	S	S	*	.	P	Polyproline II helix	trans	-72.9	140.9	175.7	-73.8	-179.7	63.8	0	0	111	L587 E588	L587-M591 PolarHBondContact O-N 2.92Å; E588-M591 PolarHBondContact O-N 2.95Å
592	G	87.6	Confident	91.5	Very high	32 Å²	32	71.3 Å²	71.3	33%	0.33	36%	0.357	S	S	.	.	P	Polyproline II helix	trans	-71.9	165.8	173.4	0	0	0	0	0	112.7	F557	F557-G592 VanDerWaalsContact CD1-CA 3.45Å
593	P	86.8	Confident	91.3	Very high	85 Å²	85	75 Å²	75	55%	0.552	37%	0.374	S	S	*	.	P	Polyproline II helix	trans	-59.9	147.1	170.5	28.1	-35	0	0	0	111	D595	P593-D595 VanDerWaalsContact C-N 3.27Å; P593-D595 PolarHBondContact O-N 2.79Å
594	E	84.7	Confident	91	Very high	142 Å²	142	77.6 Å²	77.6	66%	0.664	39%	0.387	S	S	*	.			trans	-76.6	76	-177.5	-159.8	-154.3	177.4	0	0	112.4	K599	E594-K599 HydrophobicContact CG-CG 4.08Å; E594-K599 WeakPolarHBondContact O-CE 3.41Å; E594-K599 PolarHBondContact O-NZ 2.72Å; E594-K599 WeakPolarHBondContact OE1-CE 3.32Å; E594-K599 VanDerWaalsContact OE1-CG 3.29Å; E594-K599 WeakPolarHBondContact OE1-CG 3.43Å; E594-K599 WeakPolarHBondContact OE2-CE 3.25Å
595	D	87.4	Confident	90.8	Very high	54 Å²	54	71.5 Å²	71.5	29%	0.289	36%	0.358	S	S	.	.			trans	-66.3	156	176.1	-93.3	7.4	0	0	0	112.9	P593 R597 D598 K599	P593-D595 VanDerWaalsContact C-N 3.27Å; P593-D595 PolarHBondContact O-N 2.79Å; D595-R597 HydrophobicContact CB-CB 4.17Å; D595-R597 PolarHBondContact O-N 3.09Å; D595-R597 VanDerWaalsContact O-N 3.13Å; D595-R597 IonicContact OD2-CZ 2.88Å; D595-R597 IonicContact OD2-NE 2.61Å; D595-R597 PolarHBondContact OD2-NE 3.4Å; D595-R597 IonicContact OD2-NH2 2.68Å; D595-R597 PolarHBondContact OD2-NH2 2.94Å; D595-D598 PolarHBondContact O-N 2.68Å; D595-K599 PolarHBondContact O-N 3Å
596	E	88.6	Confident	90.5	Very high	132 Å²	132	72.3 Å²	72.3	62%	0.617	36%	0.359	S	S	*	.	H	α-helix	trans	-57.5	-25.4	167.7	-63.8	-53.2	122	0	0	112.7	K599 K600	E596-K599 WeakPolarHBondContact OE1-CD 3.3Å; E596-K599 IonicContact OE1-NZ 3.96Å; E596-K599 PolarHBondContact OE1-NZ 3.13Å; E596-K600 VanDerWaalsContact O-CB 3.3Å; E596-K600 WeakPolarHBondContact O-CB 3.36Å; E596-K600 PolarHBondContact O-N 2.86Å
597	R	88.3	Confident	90.3	Very high	82 Å²	82	74.1 Å²	74.1	31%	0.309	37%	0.373	S	S	.	.	H	α-helix	trans	-62.6	-47.6	172.8	-61.6	-176.5	-73.4	170.7	2.7	111.2	Y516 D595 K600 E601	Y516-R597 HydrophobicContact CE1-CG 4.48Å; Y516-R597 HydrophobicContact CE2-CB 4.45Å; D595-R597 HydrophobicContact CB-CB 4.17Å; D595-R597 PolarHBondContact O-N 3.09Å; D595-R597 VanDerWaalsContact O-N 3.13Å; D595-R597 IonicContact OD2-CZ 2.88Å; D595-R597 IonicContact OD2-NE 2.61Å; D595-R597 PolarHBondContact OD2-NE 3.4Å; D595-R597 IonicContact OD2-NH2 2.68Å; D595-R597 PolarHBondContact OD2-NH2 2.94Å; R597-K600 PolarHBondContact O-N 3.25Å; R597-E601 PolarHBondContact O-N 2.92Å
598	D	89	Confident	89.9	Confident	31 Å²	31	78.6 Å²	78.6	17%	0.166	39%	0.392	C	S	.	.	H	α-helix	trans	-77.8	-33.3	-178.2	-69.9	-80.3	0	0	0	112.3	R307 K559 D595 K600 E601 E602	R307-D598 IonicContact CZ-OD1 3Å; R307-D598 IonicContact NH2-OD1 2.81Å; R307-D598 PolarHBondContact NH2-OD1 2.99Å; K559-D598 IonicContact NZ-OD1 2.68Å; K559-D598 PolarHBondContact NZ-OD1 2.68Å; D595-D598 PolarHBondContact O-N 2.68Å; D598-K600 VanDerWaalsContact C-N 3.35Å; D598-E601 PolarHBondContact O-N 3.34Å; D598-E602 WeakPolarHBondContact O-CB 3.45Å; D598-E602 PolarHBondContact O-N 3.42Å
599	K	90.7	Very high	89.4	Confident	52 Å²	52	73 Å²	73	23%	0.226	37%	0.366	C	S	.	.	H	α-helix	trans	-61.8	-40.2	168.1	-67.7	169.7	-161.1	158.3	0	112.3	E594 D595 E596 K603	E594-K599 HydrophobicContact CG-CG 4.08Å; E594-K599 WeakPolarHBondContact O-CE 3.41Å; E594-K599 PolarHBondContact O-NZ 2.72Å; E594-K599 WeakPolarHBondContact OE1-CE 3.32Å; E594-K599 VanDerWaalsContact OE1-CG 3.29Å; E594-K599 WeakPolarHBondContact OE1-CG 3.43Å; E594-K599 WeakPolarHBondContact OE2-CE 3.25Å; D595-K599 PolarHBondContact O-N 3Å; E596-K599 WeakPolarHBondContact OE1-CD 3.3Å; E596-K599 IonicContact OE1-NZ 3.96Å; E596-K599 PolarHBondContact OE1-NZ 3.13Å; K599-K603 WeakPolarHBondContact O-CB 3.41Å; K599-K603 WeakPolarHBondContact O-CD 3.37Å; K599-K603 VanDerWaalsContact O-CG 3.24Å; K599-K603 WeakPolarHBondContact O-CG 3.5Å; K599-K603 PolarHBondContact O-N 2.81Å
600	K	91.3	Very high	89	Confident	86 Å²	86	74 Å²	74	37%	0.374	37%	0.365	S	S	.	.	H	α-helix	trans	-67	-44.6	174.7	-172.8	-175.1	172.7	-166	0	111	S520 S521 E596 R597 D598 K603 E604	S520-K600 PolarHBondContact O-NZ 2.97Å; S521-K600 WeakPolarHBondContact O-CD 3.38Å; S521-K600 WeakPolarHBondContact O-CE 3.49Å; S521-K600 PolarHBondContact O-NZ 3.32Å; E596-K600 VanDerWaalsContact O-CB 3.3Å; E596-K600 WeakPolarHBondContact O-CB 3.36Å; E596-K600 PolarHBondContact O-N 2.86Å; R597-K600 PolarHBondContact O-N 3.25Å; D598-K600 VanDerWaalsContact C-N 3.35Å; K600-K603 PolarHBondContact O-N 3.06Å; K600-E604 WeakPolarHBondContact O-CB 3.36Å; K600-E604 PolarHBondContact O-N 3.21Å
601	E	91.4	Very high	88.7	Confident	9 Å²	9	76.5 Å²	76.5	4%	0.042	38%	0.383	C	S	.	.	H	α-helix	trans	-61	-45.7	176	177.7	168.6	-137.9	0	0	112	R307 W523 K559 K564 R597 D598 K603 E604 L605	R307-E601 IonicContact CZ-OE2 3.43Å; R307-E601 IonicContact NH1-OE1 2.87Å; R307-E601 IonicContact NH1-OE2 2.73Å; R307-E601 PolarHBondContact NH1-OE2 3.48Å; R307-E601 IonicContact NH2-OE2 3.26Å; W523-E601 VanDerWaalsContact CD1-CD 3.43Å; W523-E601 PolarHBondContact NE1-OE2 3.41Å; K559-E601 IonicContact NZ-OE2 3.45Å; K559-E601 PolarHBondContact NZ-OE2 3.21Å; K564-E601 IonicContact NZ-OE1 2.74Å; K564-E601 PolarHBondContact NZ-OE1 3.5Å; R597-E601 PolarHBondContact O-N 2.92Å; D598-E601 PolarHBondContact O-N 3.34Å; E601-K603 PolarHBondContact O-N 2.78Å; E601-E604 WeakPolarHBondContact O-CB 3.33Å; E601-E604 PolarHBondContact O-N 2.85Å; E601-E604 VanDerWaalsContact O-N 3.16Å; E601-L605 HydrophobicContact CG-CD1 3.95Å; E601-L605 HydrophobicContact CG-CG 4.24Å; E601-L605 WeakPolarHBondContact O-CB 3.36Å; E601-L605 VanDerWaalsContact O-CG 3.3Å; E601-L605 WeakPolarHBondContact O-CG 3.46Å; E601-L605 PolarHBondContact O-N 3.1Å
602	E	91.3	Very high	88.3	Confident	47 Å²	47	73.8 Å²	73.8	22%	0.22	37%	0.368	C	S	.	.	H	α-helix	trans	-61.8	-45.1	178.2	178.8	58.7	-157.3	0	0	111.4	R563 D598 E604 L605 Q606	R563-E602 IonicContact CZ-OE1 3.21Å; R563-E602 IonicContact CZ-OE2 3.82Å; R563-E602 VanDerWaalsContact NH1-CD 3.26Å; R563-E602 IonicContact NH1-OE1 2.62Å; R563-E602 PolarHBondContact NH1-OE1 2.84Å; R563-E602 IonicContact NH1-OE2 2.74Å; R563-E602 PolarHBondContact NH1-OE2 2.78Å; R563-E602 IonicContact NH2-OE1 2.94Å; R563-E602 IonicContact NH2-OE2 2.63Å; R563-E602 PolarHBondContact NH2-OE2 3.38Å; D598-E602 WeakPolarHBondContact O-CB 3.45Å; D598-E602 PolarHBondContact O-N 3.42Å; E602-E604 VanDerWaalsContact C-N 3.3Å; E602-E604 PolarHBondContact O-N 2.79Å; E602-L605 PolarHBondContact O-N 3.31Å; E602-Q606 WeakPolarHBondContact O-CB 3.44Å; E602-Q606 VanDerWaalsContact O-CG 3.28Å; E602-Q606 WeakPolarHBondContact O-CG 3.38Å; E602-Q606 PolarHBondContact O-N 3.14Å; E602-Q606 WeakPolarHBondContact OE1-CG 3.21Å; E602-Q606 PolarHBondContact OE1-NE2 2.93Å
603	K	91.1	Very high	88.3	Confident	133 Å²	133	77.9 Å²	77.9	58%	0.578	39%	0.389	S	S	*	.	H	α-helix	trans	-60	-38.1	173	-73.4	169.9	-177.3	177.5	0	112.4	K599 K600 E601 S607	K599-K603 WeakPolarHBondContact O-CB 3.41Å; K599-K603 WeakPolarHBondContact O-CD 3.37Å; K599-K603 VanDerWaalsContact O-CG 3.24Å; K599-K603 WeakPolarHBondContact O-CG 3.5Å; K599-K603 PolarHBondContact O-N 2.81Å; K600-K603 PolarHBondContact O-N 3.06Å; E601-K603 PolarHBondContact O-N 2.78Å; K603-S607 VanDerWaalsContact O-CB 3.25Å; K603-S607 WeakPolarHBondContact O-CB 3.03Å; K603-S607 PolarHBondContact O-N 2.88Å; K603-S607 PolarHBondContact O-OG 2.95Å
604	E	90.1	Very high	88.3	Confident	62 Å²	62	76.7 Å²	76.7	29%	0.29	38%	0.376	S	S	.	.	H	α-helix	trans	-68.4	-42.1	176.2	-164.4	-168.8	125.7	0	0	111.8	K600 E601 E602 S607 K608	K600-E604 WeakPolarHBondContact O-CB 3.36Å; K600-E604 PolarHBondContact O-N 3.21Å; E601-E604 WeakPolarHBondContact O-CB 3.33Å; E601-E604 PolarHBondContact O-N 2.85Å; E601-E604 VanDerWaalsContact O-N 3.16Å; E602-E604 VanDerWaalsContact C-N 3.3Å; E602-E604 PolarHBondContact O-N 2.79Å; E604-S607 PolarHBondContact O-N 2.84Å; E604-K608 HydrophobicContact CG-CD 4.32Å; E604-K608 WeakPolarHBondContact O-CB 3.38Å; E604-K608 VanDerWaalsContact O-CG 3.3Å; E604-K608 WeakPolarHBondContact O-CG 3.24Å; E604-K608 PolarHBondContact O-N 3.24Å; E604-K608 WeakPolarHBondContact OE1-CE 3.45Å; E604-K608 IonicContact OE1-NZ 3.71Å; E604-K608 PolarHBondContact OE1-NZ 3.33Å
605	L	88.9	Confident	88.4	Confident	6 Å²	6	70.6 Å²	70.6	3%	0.031	35%	0.349	C	S	.	.	H	α-helix	trans	-65.9	-46.3	176.5	-70.4	175.1	0	0	0	111.7	K564 E601 E602 K608 M609	K564-L605 HydrophobicContact CB-CD2 3.64Å; K564-L605 HydrophobicContact CD-CD2 4.06Å; K564-L605 HydrophobicContact CG-CD2 3.67Å; E601-L605 HydrophobicContact CG-CD1 3.95Å; E601-L605 HydrophobicContact CG-CG 4.24Å; E601-L605 WeakPolarHBondContact O-CB 3.36Å; E601-L605 VanDerWaalsContact O-CG 3.3Å; E601-L605 WeakPolarHBondContact O-CG 3.46Å; E601-L605 PolarHBondContact O-N 3.1Å; E602-L605 PolarHBondContact O-N 3.31Å; L605-K608 CarbonylContact O-C 3.54Å; L605-K608 PolarHBondContact O-N 2.84Å; L605-M609 WeakPolarHBondContact O-CG 3.48Å; L605-M609 PolarHBondContact O-N 3.31Å
606	Q	88.6	Confident	88.4	Confident	97 Å²	97	73.6 Å²	73.6	45%	0.453	37%	0.369	S	S	.	.	H	α-helix	trans	-58.3	-47.8	173.7	-71.3	175.9	7	0	0	111	E602 K608 M609 L610	E602-Q606 WeakPolarHBondContact O-CB 3.44Å; E602-Q606 VanDerWaalsContact O-CG 3.28Å; E602-Q606 WeakPolarHBondContact O-CG 3.38Å; E602-Q606 PolarHBondContact O-N 3.14Å; E602-Q606 WeakPolarHBondContact OE1-CG 3.21Å; E602-Q606 PolarHBondContact OE1-NE2 2.93Å; Q606-K608 VanDerWaalsContact C-N 3.32Å; Q606-K608 PolarHBondContact O-N 2.83Å; Q606-M609 PolarHBondContact O-N 3.28Å; Q606-M609 VanDerWaalsContact O-N 3.09Å; Q606-L610 WeakPolarHBondContact O-CG 2.98Å; Q606-L610 PolarHBondContact O-N 3.3Å
607	S	90.3	Very high	88.5	Confident	60 Å²	60	68.9 Å²	68.9	42%	0.42	35%	0.351	S	S	.	.	H	α-helix	trans	-58.7	-42.5	174.9	-61.3	0	0	0	0	111.8	K603 E604 M609 N611	K603-S607 VanDerWaalsContact O-CB 3.25Å; K603-S607 WeakPolarHBondContact O-CB 3.03Å; K603-S607 PolarHBondContact O-N 2.88Å; K603-S607 PolarHBondContact O-OG 2.95Å; E604-S607 PolarHBondContact O-N 2.84Å; S607-M609 VanDerWaalsContact C-N 3.34Å; S607-M609 PolarHBondContact O-N 3.39Å; S607-N611 WeakPolarHBondContact O-CB 3.3Å; S607-N611 PolarHBondContact O-N 2.83Å; S607-N611 PolarHBondContact O-ND2 2.9Å
608	K	86.3	Confident	88.6	Confident	107 Å²	107	66.2 Å²	66.2	47%	0.465	34%	0.343	S	S	.	.	H	α-helix	trans	-65.5	-33.2	175.4	-79.4	170.9	170	174.6	0	112.6	E604 L605 Q606 K612	E604-K608 HydrophobicContact CG-CD 4.32Å; E604-K608 WeakPolarHBondContact O-CB 3.38Å; E604-K608 VanDerWaalsContact O-CG 3.3Å; E604-K608 WeakPolarHBondContact O-CG 3.24Å; E604-K608 PolarHBondContact O-N 3.24Å; E604-K608 WeakPolarHBondContact OE1-CE 3.45Å; E604-K608 IonicContact OE1-NZ 3.71Å; E604-K608 PolarHBondContact OE1-NZ 3.33Å; L605-K608 CarbonylContact O-C 3.54Å; L605-K608 PolarHBondContact O-N 2.84Å; Q606-K608 VanDerWaalsContact C-N 3.32Å; Q606-K608 PolarHBondContact O-N 2.83Å; K608-K612 PolarHBondContact O-N 2.77Å
609	M	85	Confident	88.6	Confident	19 Å²	19	68.2 Å²	68.2	9%	0.094	36%	0.364	C	S	.	.	H	α-helix	trans	-73.1	-44.8	175.4	-65.9	-45.4	104.3	0	0	112	R563 M570 L605 Q606 S607 N611 K612	R563-M609 WeakPolarHBondContact O-CE 3.36Å; M570-M609 HydrophobicContact SD-CB 4.39Å; M570-M609 HydrophobicContact SD-SD 4.42Å; L605-M609 WeakPolarHBondContact O-CG 3.48Å; L605-M609 PolarHBondContact O-N 3.31Å; Q606-M609 PolarHBondContact O-N 3.28Å; Q606-M609 VanDerWaalsContact O-N 3.09Å; S607-M609 VanDerWaalsContact C-N 3.34Å; S607-M609 PolarHBondContact O-N 3.39Å; M609-N611 PolarHBondContact O-N 2.86Å; M609-K612 HydrophobicContact CE-CD 4.46Å; M609-K612 WeakPolarHBondContact O-CB 3.17Å; M609-K612 PolarHBondContact O-N 2.91Å; M609-K612 HydrophobicContact SD-CD 3.91Å; M609-K612 PolarHBondContact SD-NZ 2.75Å
610	L	85.6	Confident	88.4	Confident	113 Å²	113	69.2 Å²	69.2	59%	0.592	37%	0.369	S	S	*	.	H	α-helix	trans	-62.8	-31.5	177.5	-69.3	169	0	0	0	112.5	Q606 L626	Q606-L610 WeakPolarHBondContact O-CG 2.98Å; Q606-L610 PolarHBondContact O-N 3.3Å; L610-L626 HydrophobicContact CD2-CD1 4.37Å
611	N	86.8	Confident	88.3	Confident	138 Å²	138	65.4 Å²	65.4	74%	0.738	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.7	-2.3	174.7	-75	-68.4	0	0	0	114.4	S607 M609	S607-N611 WeakPolarHBondContact O-CB 3.3Å; S607-N611 PolarHBondContact O-N 2.83Å; S607-N611 PolarHBondContact O-ND2 2.9Å; M609-N611 PolarHBondContact O-N 2.86Å
612	K	84.9	Confident	88.1	Confident	63 Å²	63	68.3 Å²	68.3	27%	0.274	37%	0.365	S	S	.	.	S	Bend	trans	-69.2	138.4	170.7	-77	175.4	179	177	0	109.1	M570 K608 M609	M570-K612 HydrophobicContact CE-CB 4.05Å; M570-K612 HydrophobicContact CE-CD 3.78Å; K608-K612 PolarHBondContact O-N 2.77Å; M609-K612 HydrophobicContact CE-CD 4.46Å; M609-K612 WeakPolarHBondContact O-CB 3.17Å; M609-K612 PolarHBondContact O-N 2.91Å; M609-K612 HydrophobicContact SD-CD 3.91Å; M609-K612 PolarHBondContact SD-NZ 2.75Å
613	P	86.6	Confident	87.8	Confident	118 Å²	118	70.9 Å²	70.9	77%	0.766	38%	0.38	S	S	*	.	P	Polyproline II helix	trans	-62	147.2	177.7	27.5	-35.2	0	0	0	111
614	M	86.6	Confident	87.7	Confident	60 Å²	60	64.7 Å²	64.7	30%	0.296	35%	0.353	S	S	.	.	P	Polyproline II helix	trans	-57.3	143.3	176.5	-76.3	178.9	174.1	0	0	111.9	Y627 L647	M614-Y627 HydrophobicContact CE-CD1 4.46Å; M614-Y627 HydrophobicContact CE-CE1 3.85Å; M614-Y627 HydrophobicContact CG-CD2 4.48Å; M614-Y627 HydrophobicContact CG-CE2 3.87Å; M614-L647 HydrophobicContact CE-CB 3.58Å
615	P	87.9	Confident	87.6	Confident	14 Å²	14	63.6 Å²	63.6	9%	0.091	35%	0.352	C	S	.	.	P	Polyproline II helix	trans	-56.4	143.8	177.4	-21.6	29.6	0	0	0	113.2	E620 Y621	P615-E620 HydrophobicContact CB-CB 3.59Å; P615-E620 HydrophobicContact CB-CG 4.49Å; P615-E620 VanDerWaalsContact CB-OE2 3.31Å; P615-E620 WeakPolarHBondContact CB-OE2 3.29Å; P615-E620 HydrophobicContact CG-CB 4.37Å; P615-Y621 HydrophobicContact CB-CD2 4.15Å; P615-Y621 HydrophobicContact CB-CE2 3.64Å; P615-Y621 HydrophobicContact CG-CE1 4.26Å; P615-Y621 HydrophobicContact CG-CE2 4.23Å; P615-Y621 VanDerWaalsContact O-CE2 3.24Å; P615-Y621 WeakPolarHBondContact O-CE2 3.47Å; P615-Y621 PolarHBondContact O-OH 2.98Å
616	T	87.8	Confident	87.6	Confident	116 Å²	116	65.4 Å²	65.4	71%	0.712	36%	0.361	S	S	*	.	S	Bend	trans	-104	-17	-174.3	66.4	0	0	0	0	113.3	E620 R651	T616-E620 PolarHBondContact N-OE2 3.07Å; T616-R651 PolarHBondContact O-NE 2.73Å
617	S	89.9	Confident	87.8	Confident	34 Å²	34	62 Å²	62	24%	0.238	34%	0.344	C	S	.	.	S	Bend	trans	-94.4	138.8	168	-165.2	0	0	0	0	110.5	A619 E620 Y621	S617-A619 VanDerWaalsContact C-N 3.25Å; S617-A619 PolarHBondContact O-N 2.63Å; S617-E620 VanDerWaalsContact CB-CD 3.41Å; S617-E620 WeakPolarHBondContact CB-OE1 3.24Å; S617-E620 PolarHBondContact N-OE2 3.48Å; S617-E620 WeakPolarHBondContact O-CB 3.42Å; S617-E620 PolarHBondContact O-N 2.74Å; S617-Y621 WeakPolarHBondContact O-CD2 3.41Å
618	I	90.4	Very high	88	Confident	26 Å²	26	59.3 Å²	59.3	13%	0.133	33%	0.326	C	S	.	.	G	3₁₀ helix	trans	-60.2	-39.9	173.9	-68.6	176.4	0	0	0	110.2	E620 Y621 L629 H632 R651	I618-E620 PolarHBondContact O-N 3.25Å; I618-E620 VanDerWaalsContact O-N 3.16Å; I618-Y621 WeakPolarHBondContact O-CB 3.23Å; I618-Y621 PolarHBondContact O-N 2.88Å; I618-L629 HydrophobicContact CG2-CD1 3.91Å; I618-H632 PolarHBondContact O-CE1 3.43Å; I618-H632 VanDerWaalsContact O-CE1 3.31Å; I618-R651 HydrophobicContact CD1-CB 4.29Å; I618-R651 HydrophobicContact CD1-CG 4.43Å; I618-R651 HydrophobicContact CG1-CG 4.43Å
619	A	88.5	Confident	88.4	Confident	73 Å²	73	54.2 Å²	54.2	60%	0.603	30%	0.304	S	S	*	.	G	3₁₀ helix	trans	-61	-26.7	-178.5	0	0	0	0	0	113.8	S617 Y621 K622	S617-A619 VanDerWaalsContact C-N 3.25Å; S617-A619 PolarHBondContact O-N 2.63Å; A619-Y621 PolarHBondContact O-N 3.44Å; A619-K622 PolarHBondContact O-N 2.82Å
620	E	86.8	Confident	88.7	Confident	72 Å²	72	60.4 Å²	60.4	34%	0.336	33%	0.33	S	S	.	.	G	3₁₀ helix	trans	-68.9	-14.6	176	-70.9	152.4	-149.2	0	0	112.7	T571 P615 T616 S617 I618	T571-E620 HydrophobicContact CG2-CB 3.89Å; T571-E620 HydrophobicContact CG2-CG 4.1Å; P615-E620 HydrophobicContact CB-CB 3.59Å; P615-E620 HydrophobicContact CB-CG 4.49Å; P615-E620 VanDerWaalsContact CB-OE2 3.31Å; P615-E620 WeakPolarHBondContact CB-OE2 3.29Å; P615-E620 HydrophobicContact CG-CB 4.37Å; T616-E620 PolarHBondContact N-OE2 3.07Å; S617-E620 VanDerWaalsContact CB-CD 3.41Å; S617-E620 WeakPolarHBondContact CB-OE1 3.24Å; S617-E620 PolarHBondContact N-OE2 3.48Å; S617-E620 WeakPolarHBondContact O-CB 3.42Å; S617-E620 PolarHBondContact O-N 2.74Å; I618-E620 PolarHBondContact O-N 3.25Å; I618-E620 VanDerWaalsContact O-N 3.16Å
621	Y	89.2	Confident	89	Confident	6 Å²	6	61.6 Å²	61.6	2%	0.024	33%	0.326	C	S	.	.	G	3₁₀ helix	trans	-89.8	-2.2	173.3	-64.1	-95.7	0	0	0	114	P615 S617 I618 A619 N623 Y627 L629 H632 C650 V655	P615-Y621 HydrophobicContact CB-CD2 4.15Å; P615-Y621 HydrophobicContact CB-CE2 3.64Å; P615-Y621 HydrophobicContact CG-CE1 4.26Å; P615-Y621 HydrophobicContact CG-CE2 4.23Å; P615-Y621 VanDerWaalsContact O-CE2 3.24Å; P615-Y621 WeakPolarHBondContact O-CE2 3.47Å; P615-Y621 PolarHBondContact O-OH 2.98Å; S617-Y621 WeakPolarHBondContact O-CD2 3.41Å; I618-Y621 WeakPolarHBondContact O-CB 3.23Å; I618-Y621 PolarHBondContact O-N 2.88Å; A619-Y621 PolarHBondContact O-N 3.44Å; Y621-N623 PolarHBondContact O-N 3.32Å; Y621-Y627 HydrophobicContact CE1-CD2 4.3Å; Y621-Y627 HydrophobicContact CE1-CG 4.3Å; Y621-L629 HydrophobicContact CD1-CD1 4.46Å; Y621-L629 HydrophobicContact CD1-CG 4.11Å; Y621-L629 HydrophobicContact CD2-CD1 3.84Å; Y621-L629 HydrophobicContact CD2-CG 4.35Å; Y621-L629 HydrophobicContact CG-CD1 3.78Å; Y621-L629 HydrophobicContact CG-CG 3.89Å; Y621-H632 PolarHBondContact O-ND1 3.44Å; Y621-C650 HydrophobicContact CE2-CB 3.85Å; Y621-C650 VanDerWaalsContact CE2-SG 3.59Å; Y621-V655 HydrophobicContact CD1-CG1 4.44Å; Y621-V655 HydrophobicContact CE1-CG1 3.75Å; Y621-V655 HydrophobicContact CE1-CG2 3.86Å
622	K	87.9	Confident	89.3	Confident	70 Å²	70	57.3 Å²	57.3	30%	0.304	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.6	107.7	170.9	-170.9	-179.1	-178.4	-173.2	0	107.7	E132 D133 A619	E132-K622 PolarHBondContact O-NZ 3.05Å; D133-K622 IonicContact OD1-NZ 2.69Å; D133-K622 PolarHBondContact OD1-NZ 2.85Å; A619-K622 PolarHBondContact O-N 2.82Å
623	N	83.9	Confident	89.7	Confident	102 Å²	102	55.9 Å²	55.9	55%	0.545	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	65.9	30.1	-178.8	-51.4	-0.6	0	0	0	115	Y621	Y621-N623 PolarHBondContact O-N 3.32Å
624	H	88.7	Confident	90	Very high	3 Å²	3	55 Å²	55	1%	0.014	29%	0.285	C	S	.	.			trans	-68.2	136.5	173.9	-172	-88.3	0	0	0	111.1	M570 L626 Y627	M570-H624 WeakPolarHBondContact CB-NE2 3.49Å; M570-H624 PolarHBondContact O-CD2 3.44Å; H624-L626 PolarHBondContact ND1-N 3.13Å; H624-L626 PolarHBondContact O-N 3.04Å; H624-Y627 AromaticContact CE1-CD2 3.24Å; H624-Y627 WeakPolarHBondContact CE1-CD2 3.38Å; H624-Y627 AromaticContact CE1-CE2 3.81Å; H624-Y627 AromaticContact ND1-CD2 3.48Å; H624-Y627 WeakPolarHBondContact ND1-CD2 3.33Å; H624-Y627 AromaticContact ND1-CG 3.83Å; H624-Y627 PolarHBondContact ND1-N 3.33Å
625	P	88.3	Confident	90.3	Very high	39 Å²	39	55.1 Å²	55.1	25%	0.253	28%	0.284	S	S	.	.	S	Bend	trans	-66	-36.6	-172	23.8	-33.4	0	0	0	114.2	M570 R658	M570-P625 HydrophobicContact CB-CG 3.86Å; M570-P625 HydrophobicContact CG-CG 4.01Å; M570-P625 WeakPolarHBondContact O-CD 3.46Å; P625-R658 WeakPolarHBondContact O-CB 3.34Å
626	L	90.1	Very high	90.6	Very high	44 Å²	44	58.7 Å²	58.7	23%	0.23	30%	0.296	C	S	.	.	S	Bend	trans	-100.5	-15.8	-173.6	-58.7	176.1	0	0	0	114.5	M570 L610 H624 S657 R658	M570-L626 HydrophobicContact SD-CD1 3.94Å; L610-L626 HydrophobicContact CD2-CD1 4.37Å; H624-L626 PolarHBondContact ND1-N 3.13Å; H624-L626 PolarHBondContact O-N 3.04Å; L626-S657 PolarHBondContact O-OG 3.22Å; L626-R658 PolarHBondContact O-N 2.91Å
627	Y	92	Very high	91	Very high	25 Å²	25	53.9 Å²	53.9	10%	0.098	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	141	-164.4	-59.7	-47.6	0	0	0	111.9	M614 Y621 H624 L647 V655 Y656	M614-Y627 HydrophobicContact CE-CD1 4.46Å; M614-Y627 HydrophobicContact CE-CE1 3.85Å; M614-Y627 HydrophobicContact CG-CD2 4.48Å; M614-Y627 HydrophobicContact CG-CE2 3.87Å; Y621-Y627 HydrophobicContact CE1-CD2 4.3Å; Y621-Y627 HydrophobicContact CE1-CG 4.3Å; H624-Y627 AromaticContact CE1-CD2 3.24Å; H624-Y627 WeakPolarHBondContact CE1-CD2 3.38Å; H624-Y627 AromaticContact CE1-CE2 3.81Å; H624-Y627 AromaticContact ND1-CD2 3.48Å; H624-Y627 WeakPolarHBondContact ND1-CD2 3.33Å; H624-Y627 AromaticContact ND1-CG 3.83Å; H624-Y627 PolarHBondContact ND1-N 3.33Å; Y627-L647 HydrophobicContact CD1-CD1 4.05Å; Y627-L647 HydrophobicContact CE1-CD1 3.96Å; Y627-V655 HydrophobicContact CD1-CG1 4.09Å; Y627-V655 HydrophobicContact CG-CG1 4.1Å; Y627-Y656 WeakPolarHBondContact CA-O 3.41Å
628	A	94.1	Very high	91.2	Very high	4 Å²	4	52.8 Å²	52.8	3%	0.033	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	142.8	176.6	0	0	0	0	0	111.9	Y656 V661	A628-Y656 PolarHBondContact N-O 2.92Å; A628-Y656 PolarHBondContact O-N 2.99Å; A628-V661 HydrophobicContact CB-CG2 3.49Å; A628-V661 VanDerWaalsContact CB-CG2 3.49Å
629	L	94.4	Very high	91.4	Very high	0 Å²	0	52.6 Å²	52.6	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	140.6	165.9	-70.4	176.2	0	0	0	109	I618 Y621 R631 H632 C650 E653 V655	I618-L629 HydrophobicContact CG2-CD1 3.91Å; Y621-L629 HydrophobicContact CD1-CD1 4.46Å; Y621-L629 HydrophobicContact CD1-CG 4.11Å; Y621-L629 HydrophobicContact CD2-CD1 3.84Å; Y621-L629 HydrophobicContact CD2-CG 4.35Å; Y621-L629 HydrophobicContact CG-CD1 3.78Å; Y621-L629 HydrophobicContact CG-CG 3.89Å; L629-R631 HydrophobicContact CB-CG 3.85Å; L629-R631 HydrophobicContact CD1-CG 4.43Å; L629-R631 PolarHBondContact O-N 3.3Å; L629-R631 VanDerWaalsContact O-N 3.08Å; L629-H632 PolarHBondContact O-N 2.87Å; L629-C650 HydrophobicContact CD2-CB 4.48Å; L629-E653 HydrophobicContact CD2-CB 4.1Å; L629-V655 HydrophobicContact CD2-CG2 3.8Å
630	K	92.5	Very high	91.6	Very high	149 Å²	149	52.8 Å²	52.8	65%	0.648	24%	0.244	S	C	*	.	G	3₁₀ helix	trans	-56.8	-29.4	-178.1	-171	174.7	178.7	178.1	0	113.2	H632 L633	K630-H632 VanDerWaalsContact C-N 3.3Å; K630-H632 PolarHBondContact O-N 3.22Å; K630-L633 HydrophobicContact CB-CD1 4.44Å; K630-L633 HydrophobicContact CG-CD1 4.02Å; K630-L633 WeakPolarHBondContact O-CG 3.31Å
631	R	92.4	Very high	92	Very high	137 Å²	137	52 Å²	52	52%	0.517	25%	0.245	S	C	.	.	G	3₁₀ helix	trans	-68.9	-16	176.3	62	157.2	68.5	-151.8	-2.3	115.7	L629 E653	L629-R631 HydrophobicContact CB-CG 3.85Å; L629-R631 HydrophobicContact CD1-CG 4.43Å; L629-R631 PolarHBondContact O-N 3.3Å; L629-R631 VanDerWaalsContact O-N 3.08Å; R631-E653 WeakPolarHBondContact CD-OE2 3.44Å; R631-E653 WeakPolarHBondContact CG-OE2 3.49Å; R631-E653 IonicContact CZ-OE1 2.66Å; R631-E653 IonicContact CZ-OE2 3.75Å; R631-E653 IonicContact NE-OE1 3.01Å; R631-E653 PolarHBondContact NE-OE1 3.27Å; R631-E653 IonicContact NE-OE2 3.89Å; R631-E653 PolarHBondContact NE-OE2 3.45Å; R631-E653 IonicContact NH2-OE1 2.65Å; R631-E653 PolarHBondContact NH2-OE1 3.26Å; R631-E653 IonicContact NH2-OE2 3.93Å
632	H	92.8	Very high	91.9	Very high	49 Å²	49	56.5 Å²	56.5	23%	0.227	28%	0.275	C	S	.	.	G	3₁₀ helix	trans	-109	6.8	-178.8	-56.7	151.1	0	0	0	112.7	I618 Y621 L629 K630 L634	I618-H632 PolarHBondContact O-CE1 3.43Å; I618-H632 VanDerWaalsContact O-CE1 3.31Å; Y621-H632 PolarHBondContact O-ND1 3.44Å; L629-H632 PolarHBondContact O-N 2.87Å; K630-H632 VanDerWaalsContact C-N 3.3Å; K630-H632 PolarHBondContact O-N 3.22Å; H632-L634 PolarHBondContact O-N 2.9Å
633	L	92.8	Very high	92	Very high	33 Å²	33	59 Å²	59	17%	0.173	30%	0.297	C	S	.	.			trans	-71.6	122.3	174.4	-58.6	175.3	0	0	0	108.8	K630 E637 L639 V661	K630-L633 HydrophobicContact CB-CD1 4.44Å; K630-L633 HydrophobicContact CG-CD1 4.02Å; K630-L633 WeakPolarHBondContact O-CG 3.31Å; L633-E637 HydrophobicContact CB-CB 4.27Å; L633-L639 HydrophobicContact CD1-CD1 3.96Å; L633-L639 HydrophobicContact CD1-CG 3.9Å; L633-L639 HydrophobicContact CD2-CG 4.46Å; L633-V661 HydrophobicContact CD2-CB 4.26Å; L633-V661 HydrophobicContact CD2-CG1 3.61Å; L633-V661 HydrophobicContact CD2-CG2 3.56Å
634	L	93.4	Very high	92.3	Very high	98 Å²	98	54.8 Å²	54.8	51%	0.513	28%	0.276	S	S	.	.			trans	-62.8	165.8	179.4	-59.5	176.6	0	0	0	112	H632 Y636 E637 K685	H632-L634 PolarHBondContact O-N 2.9Å; L634-Y636 PolarHBondContact O-N 3.35Å; L634-Y636 VanDerWaalsContact O-N 3.09Å; L634-E637 HydrophobicContact CB-CB 4.38Å; L634-E637 HydrophobicContact CB-CG 4.05Å; L634-E637 PolarHBondContact N-OE2 3.46Å; L634-E637 PolarHBondContact O-N 3.35Å; L634-K685 PolarHBondContact O-NZ 3.25Å; L634-K685 VanDerWaalsContact O-NZ 3.15Å
635	K	92.5	Very high	92.5	Very high	64 Å²	64	58 Å²	58	28%	0.278	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	-47.6	-41.6	176.6	-176.4	179.9	178.9	-173.2	0	112.7	K685 V687 K688 F690	K635-K685 WeakPolarHBondContact O-CE 3.43Å; K635-K685 PolarHBondContact O-NZ 2.84Å; K635-V687 HydrophobicContact CG-CB 4.28Å; K635-V687 HydrophobicContact CG-CG1 4.15Å; K635-K688 VanDerWaalsContact CE-O 3.32Å; K635-K688 WeakPolarHBondContact CE-O 3.34Å; K635-K688 PolarHBondContact NZ-O 2.77Å; K635-F690 HydrophobicContact CD-CE2 4.31Å
636	Y	94.7	Very high	92.8	Very high	88 Å²	88	59 Å²	59	35%	0.345	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.2	10.9	179.7	-52.7	-71.6	0	0	0	114.3	L634 T663 L664 V687 L709 L711	L634-Y636 PolarHBondContact O-N 3.35Å; L634-Y636 VanDerWaalsContact O-N 3.09Å; Y636-T663 CarbonylContact O-C 3.49Å; Y636-L664 PolarHBondContact O-N 2.97Å; Y636-V687 HydrophobicContact CE1-CG2 4.02Å; Y636-L709 HydrophobicContact CE1-CD2 4.3Å; Y636-L711 HydrophobicContact CD1-CD1 3.67Å; Y636-L711 HydrophobicContact CD1-CD2 3.9Å; Y636-L711 HydrophobicContact CD1-CG 4.45Å; Y636-L711 HydrophobicContact CE1-CD1 4.35Å; Y636-L711 HydrophobicContact CE1-CD2 4.21Å
637	E	94.9	Very high	92.8	Very high	15 Å²	15	61 Å²	61	7%	0.07	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	153.6	172.5	-71.9	-177.1	173.7	0	0	112.1	L633 L634 R658 V661 H662 K685	L633-E637 HydrophobicContact CB-CB 4.27Å; L634-E637 HydrophobicContact CB-CB 4.38Å; L634-E637 HydrophobicContact CB-CG 4.05Å; L634-E637 PolarHBondContact N-OE2 3.46Å; L634-E637 PolarHBondContact O-N 3.35Å; E637-R658 IonicContact OE1-CZ 3.31Å; E637-R658 IonicContact OE1-NH1 2.62Å; E637-R658 PolarHBondContact OE1-NH1 3.21Å; E637-R658 IonicContact OE1-NH2 3.04Å; E637-R658 PolarHBondContact OE1-NH2 3.48Å; E637-R658 IonicContact OE2-CZ 2.74Å; E637-R658 IonicContact OE2-NH1 3.08Å; E637-R658 PolarHBondContact OE2-NH1 3.03Å; E637-R658 IonicContact OE2-NH2 2.68Å; E637-V661 HydrophobicContact CB-CG1 3.9Å; E637-V661 HydrophobicContact CG-CG1 4.05Å; E637-V661 WeakPolarHBondContact OE2-CG1 3.46Å; E637-H662 WeakPolarHBondContact CA-O 3.32Å; E637-K685 PolarHBondContact O-NZ 3.45Å
638	A	94.8	Very high	92.8	Very high	12 Å²	12	60.7 Å²	60.7	10%	0.099	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.1	163	162.8	0	0	0	0	0	112	V661 H662 L664 Y684	A638-V661 WeakPolarHBondContact O-CA 3.29Å; A638-H662 PolarHBondContact N-O 3.07Å; A638-H662 PolarHBondContact O-N 2.7Å; A638-L664 HydrophobicContact CB-CD1 3.76Å; A638-L664 HydrophobicContact CB-CD2 4.37Å; A638-L664 HydrophobicContact CB-CG 4.21Å; A638-Y684 HydrophobicContact CB-CD1 3.95Å; A638-Y684 HydrophobicContact CB-CE1 3.69Å
639	L	95.1	Very high	92.8	Very high	21 Å²	21	68.3 Å²	68.3	11%	0.11	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	132.1	170.3	-74.1	159	0	0	0	110.1	L633 Y656 C660 V661 Y684	L633-L639 HydrophobicContact CD1-CD1 3.96Å; L633-L639 HydrophobicContact CD1-CG 3.9Å; L633-L639 HydrophobicContact CD2-CG 4.46Å; L639-Y656 HydrophobicContact CD1-CD1 4.21Å; L639-Y656 HydrophobicContact CD1-CD2 3.51Å; L639-Y656 HydrophobicContact CD1-CE1 4.33Å; L639-Y656 HydrophobicContact CD1-CE2 3.66Å; L639-Y656 HydrophobicContact CD1-CG 3.81Å; L639-Y656 HydrophobicContact CD2-CD1 4.42Å; L639-Y656 HydrophobicContact CD2-CD2 4.27Å; L639-Y656 HydrophobicContact CD2-CG 3.88Å; L639-C660 CarbonylContact C-O 3.57Å; L639-C660 VanDerWaalsContact CA-O 3.25Å; L639-C660 WeakPolarHBondContact CA-O 3.32Å; L639-C660 HydrophobicContact CD2-CB 4.05Å; L639-V661 HydrophobicContact CD2-CG2 3.69Å; L639-V661 HydrophobicContact CG-CG2 4.41Å; L639-Y684 WeakPolarHBondContact O-CE1 3.41Å; L639-Y684 PolarHBondContact O-OH 3.39Å
640	Y	93.4	Very high	92.6	Very high	78 Å²	78	68.6 Å²	68.6	31%	0.306	35%	0.353	S	S	.	.	S	Bend	trans	-138.2	140.9	170.4	179.9	-93.9	0	0	0	110.1	C660 Y684 W715	Y640-C660 PolarHBondContact N-O 3.12Å; Y640-C660 WeakPolarHBondContact O-CA 3.44Å; Y640-C660 WeakPolarHBondContact O-CB 3.41Å; Y640-C660 VanDerWaalsContact O-O 3.13Å; Y640-Y684 HydrophobicContact CD2-CE2 4.13Å; Y640-W715 AromaticContact CD1-CD2 3.78Å; Y640-W715 HydrophobicContact CD1-CD2 3.78Å; Y640-W715 AromaticContact CD1-CE3 3.62Å; Y640-W715 HydrophobicContact CD1-CE3 3.62Å; Y640-W715 HydrophobicContact CD1-CG 4.34Å; Y640-W715 HydrophobicContact CD1-CH2 4.37Å; Y640-W715 AromaticContact CD1-CZ3 3.94Å; Y640-W715 HydrophobicContact CD1-CZ3 3.94Å; Y640-W715 AromaticContact CD2-CD2 3.64Å; Y640-W715 HydrophobicContact CD2-CD2 3.64Å; Y640-W715 AromaticContact CD2-CE2 3.23Å; Y640-W715 HydrophobicContact CD2-CE3 4.13Å; Y640-W715 HydrophobicContact CD2-CG 4.19Å; Y640-W715 AromaticContact CD2-CH2 3.92Å; Y640-W715 HydrophobicContact CD2-CH2 3.92Å; Y640-W715 AromaticContact CD2-CZ2 3.39Å; Y640-W715 HydrophobicContact CD2-CZ2 3.39Å; Y640-W715 HydrophobicContact CD2-CZ3 4.26Å; Y640-W715 AromaticContact CD2-NE1 3.55Å; Y640-W715 HydrophobicContact CE1-CB 4.12Å; Y640-W715 AromaticContact CE1-CD2 3.8Å; Y640-W715 HydrophobicContact CE1-CD2 3.8Å; Y640-W715 AromaticContact CE1-CE3 3.98Å; Y640-W715 HydrophobicContact CE1-CE3 3.98Å; Y640-W715 AromaticContact CE1-CG 3.85Å; Y640-W715 HydrophobicContact CE1-CG 3.85Å; Y640-W715 AromaticContact CE2-CD1 3.46Å; Y640-W715 VanDerWaalsContact CE2-CD1 3.46Å; Y640-W715 AromaticContact CE2-CD2 3.66Å; Y640-W715 HydrophobicContact CE2-CD2 3.66Å; Y640-W715 AromaticContact CE2-CE2 3.46Å; Y640-W715 VanDerWaalsContact CE2-CE2 3.46Å; Y640-W715 HydrophobicContact CE2-CE3 4.46Å; Y640-W715 AromaticContact CE2-CG 3.68Å; Y640-W715 HydrophobicContact CE2-CG 3.68Å; Y640-W715 HydrophobicContact CE2-CZ2 4.11Å; Y640-W715 AromaticContact CE2-NE1 3.3Å; Y640-W715 VanDerWaalsContact CE2-NE1 3.3Å; Y640-W715 AromaticContact CG-CD2 3.7Å; Y640-W715 HydrophobicContact CG-CD2 3.7Å; Y640-W715 AromaticContact CG-CE2 3.66Å; Y640-W715 AromaticContact CG-CE3 3.7Å; Y640-W715 HydrophobicContact CG-CE3 3.7Å; Y640-W715 HydrophobicContact CG-CG 4.49Å; Y640-W715 AromaticContact CG-CH2 3.64Å; Y640-W715 HydrophobicContact CG-CH2 3.64Å; Y640-W715 AromaticContact CG-CZ2 3.64Å; Y640-W715 HydrophobicContact CG-CZ2 3.64Å; Y640-W715 AromaticContact CG-CZ3 3.67Å; Y640-W715 HydrophobicContact CG-CZ3 3.67Å; Y640-W715 AromaticContact CZ-CD1 3.64Å; Y640-W715 AromaticContact CZ-CD2 3.73Å; Y640-W715 AromaticContact CZ-CG 3.49Å; Y640-W715 VanDerWaalsContact CZ-CG 3.49Å; Y640-W715 AromaticContact CZ-NE1 3.96Å
641	P	93.1	Very high	92.5	Very high	54 Å²	54	70.3 Å²	70.3	35%	0.351	36%	0.356	S	S	.	.	S	Bend	cis	-62.1	160.3	-9	29	-36.2	0	0	0	112.2	T643 A644	P641-T643 PolarHBondContact O-N 3.41Å; P641-A644 WeakPolarHBondContact O-CB 3.22Å; P641-A644 PolarHBondContact O-N 2.93Å
642	P	87.9	Confident	92.3	Very high	102 Å²	102	66.8 Å²	66.8	66%	0.662	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.1	-25	174.9	-21.3	28.1	0	0	0	113.4	A644 Y684	P642-A644 VanDerWaalsContact C-N 3.34Å; P642-Y684 WeakPolarHBondContact CD-OH 3.41Å; P642-Y684 HydrophobicContact CG-CE2 4.05Å; P642-Y684 WeakPolarHBondContact CG-OH 3.33Å
643	T	89.5	Confident	92.4	Very high	123 Å²	123	66.9 Å²	66.9	76%	0.755	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.7	22.7	178.4	59.6	0	0	0	0	113.2	P641 A645	P641-T643 PolarHBondContact O-N 3.41Å; T643-A645 PolarHBondContact O-N 2.94Å
644	A	91.1	Very high	92.4	Very high	13 Å²	13	67 Å²	67	11%	0.107	37%	0.366	C	S	.	.			trans	-53.2	134.6	178.8	0	0	0	0	0	111.5	P641 P642 V646 Y656 C660	P641-A644 WeakPolarHBondContact O-CB 3.22Å; P641-A644 PolarHBondContact O-N 2.93Å; P642-A644 VanDerWaalsContact C-N 3.34Å; A644-V646 PolarHBondContact O-N 3.43Å; A644-Y656 HydrophobicContact CB-CD1 3.96Å; A644-Y656 HydrophobicContact CB-CE1 4.49Å; A644-C660 HydrophobicContact CB-CB 4.06Å
645	A	92.2	Very high	92.5	Very high	71 Å²	71	62.4 Å²	62.4	59%	0.587	34%	0.341	S	S	*	.			trans	-66.5	131.7	-175.5	0	0	0	0	0	111.4	T643 L647	T643-A645 PolarHBondContact O-N 2.94Å; A645-L647 PolarHBondContact O-N 3.4Å
646	V	94.6	Very high	92.6	Very high	59 Å²	59	61.1 Å²	61.1	36%	0.358	34%	0.335	S	S	.	.			trans	-76.3	111.9	172.4	-179.4	0	0	0	0	108.2	A644 G648 Y649 P654 V655 Y656	A644-V646 PolarHBondContact O-N 3.43Å; V646-G648 WeakPolarHBondContact CG1-O 3.4Å; V646-Y649 HydrophobicContact CG1-CD2 4.36Å; V646-Y649 HydrophobicContact CG1-CE1 4.29Å; V646-Y649 HydrophobicContact CG1-CE2 3.89Å; V646-P654 HydrophobicContact CB-CB 4.29Å; V646-P654 HydrophobicContact CG1-CB 3.54Å; V646-P654 HydrophobicContact CG2-CB 3.72Å; V646-V655 CarbonylContact C-O 3.57Å; V646-V655 WeakPolarHBondContact CA-O 3.35Å; V646-Y656 HydrophobicContact CG2-CE1 3.85Å
647	L	91.3	Very high	92.6	Very high	87 Å²	87	57.8 Å²	57.8	46%	0.455	33%	0.325	S	S	.	.			trans	-76.6	-26.5	-178.1	-57.3	-178.8	0	0	0	112.3	M614 Y627 A645 V655	M614-L647 HydrophobicContact CE-CB 3.58Å; Y627-L647 HydrophobicContact CD1-CD1 4.05Å; Y627-L647 HydrophobicContact CE1-CD1 3.96Å; A645-L647 PolarHBondContact O-N 3.4Å; L647-V655 PolarHBondContact N-O 3.34Å
648	G	92.1	Very high	92.5	Very high	17 Å²	17	60.5 Å²	60.5	18%	0.175	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-178.5	-174.4	-178.1	0	0	0	0	0	112	V646 V655	V646-G648 WeakPolarHBondContact CG1-O 3.4Å; G648-V655 PolarHBondContact O-N 2.89Å
649	Y	93	Very high	92.4	Very high	165 Å²	165	65.8 Å²	65.8	65%	0.647	36%	0.361	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-129.8	125.7	178.6	-70	-92.3	0	0	0	111.9	V646 E653 P654	V646-Y649 HydrophobicContact CG1-CD2 4.36Å; V646-Y649 HydrophobicContact CG1-CE1 4.29Å; V646-Y649 HydrophobicContact CG1-CE2 3.89Å; Y649-E653 CarbonylContact C-O 3.51Å; Y649-E653 WeakPolarHBondContact CA-O 3.26Å; Y649-P654 HydrophobicContact CD1-CB 4.37Å; Y649-P654 HydrophobicContact CE1-CB 4.01Å
650	C	91.6	Very high	92.4	Very high	5 Å²	5	66.2 Å²	66.2	3%	0.034	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	112.3	171.3	-168.7	0	0	0	0	109.5	Y621 L629 G652 E653 V655	Y621-C650 HydrophobicContact CE2-CB 3.85Å; Y621-C650 VanDerWaalsContact CE2-SG 3.59Å; L629-C650 HydrophobicContact CD2-CB 4.48Å; C650-G652 PolarHBondContact O-N 3.08Å; C650-E653 PolarHBondContact N-O 3.31Å; C650-E653 PolarHBondContact O-N 3.33Å; C650-V655 HydrophobicContact CB-CG2 4.06Å
651	R	89.3	Confident	92.4	Very high	185 Å²	185	63.4 Å²	63.4	70%	0.698	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.1	30.1	-179.8	-51.6	-172.8	-173.1	-174.8	-1.1	114.7	T616 I618	T616-R651 PolarHBondContact O-NE 2.73Å; I618-R651 HydrophobicContact CD1-CB 4.29Å; I618-R651 HydrophobicContact CD1-CG 4.43Å; I618-R651 HydrophobicContact CG1-CG 4.43Å
652	G	89.3	Confident	92.5	Very high	63 Å²	63	63.7 Å²	63.7	65%	0.649	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	99.6	-12.9	-178.5	0	0	0	0	0	115	C650	C650-G652 PolarHBondContact O-N 3.08Å
653	E	93.2	Very high	92.9	Very high	52 Å²	52	62.3 Å²	62.3	24%	0.243	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	138.8	175.5	-68.1	-164.4	172.3	0	0	112.7	L629 R631 Y649 C650	L629-E653 HydrophobicContact CD2-CB 4.1Å; R631-E653 WeakPolarHBondContact CD-OE2 3.44Å; R631-E653 WeakPolarHBondContact CG-OE2 3.49Å; R631-E653 IonicContact CZ-OE1 2.66Å; R631-E653 IonicContact CZ-OE2 3.75Å; R631-E653 IonicContact NE-OE1 3.01Å; R631-E653 PolarHBondContact NE-OE1 3.27Å; R631-E653 IonicContact NE-OE2 3.89Å; R631-E653 PolarHBondContact NE-OE2 3.45Å; R631-E653 IonicContact NH2-OE1 2.65Å; R631-E653 PolarHBondContact NH2-OE1 3.26Å; R631-E653 IonicContact NH2-OE2 3.93Å; Y649-E653 CarbonylContact C-O 3.51Å; Y649-E653 WeakPolarHBondContact CA-O 3.26Å; C650-E653 PolarHBondContact N-O 3.31Å; C650-E653 PolarHBondContact O-N 3.33Å
654	P	94.1	Very high	93.2	Very high	36 Å²	36	56.4 Å²	56.4	23%	0.234	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.1	130	175.5	28	-33.6	0	0	0	111.7	V646 Y649 Y656	V646-P654 HydrophobicContact CB-CB 4.29Å; V646-P654 HydrophobicContact CG1-CB 3.54Å; V646-P654 HydrophobicContact CG2-CB 3.72Å; Y649-P654 HydrophobicContact CD1-CB 4.37Å; Y649-P654 HydrophobicContact CE1-CB 4.01Å; P654-Y656 HydrophobicContact CB-CE2 3.92Å; P654-Y656 HydrophobicContact CG-CE2 3.84Å; P654-Y656 WeakPolarHBondContact CG-OH 3.46Å; P654-Y656 WeakPolarHBondContact O-CE2 3.05Å
655	V	95.1	Very high	93.4	Very high	0 Å²	0	58 Å²	58	0%	0	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	130.7	171.7	-179.1	0	0	0	0	109	Y621 Y627 L629 V646 L647 G648 C650	Y621-V655 HydrophobicContact CD1-CG1 4.44Å; Y621-V655 HydrophobicContact CE1-CG1 3.75Å; Y621-V655 HydrophobicContact CE1-CG2 3.86Å; Y627-V655 HydrophobicContact CD1-CG1 4.09Å; Y627-V655 HydrophobicContact CG-CG1 4.1Å; L629-V655 HydrophobicContact CD2-CG2 3.8Å; V646-V655 CarbonylContact C-O 3.57Å; V646-V655 WeakPolarHBondContact CA-O 3.35Å; L647-V655 PolarHBondContact N-O 3.34Å; G648-V655 PolarHBondContact O-N 2.89Å; C650-V655 HydrophobicContact CB-CG2 4.06Å
656	Y	94.9	Very high	93.5	Very high	37 Å²	37	55.4 Å²	55.4	15%	0.145	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	164.1	175.3	-55.4	-90	0	0	0	109.9	Y627 A628 L639 A644 V646 P654	Y627-Y656 WeakPolarHBondContact CA-O 3.41Å; A628-Y656 PolarHBondContact N-O 2.92Å; A628-Y656 PolarHBondContact O-N 2.99Å; L639-Y656 HydrophobicContact CD1-CD1 4.21Å; L639-Y656 HydrophobicContact CD1-CD2 3.51Å; L639-Y656 HydrophobicContact CD1-CE1 4.33Å; L639-Y656 HydrophobicContact CD1-CE2 3.66Å; L639-Y656 HydrophobicContact CD1-CG 3.81Å; L639-Y656 HydrophobicContact CD2-CD1 4.42Å; L639-Y656 HydrophobicContact CD2-CD2 4.27Å; L639-Y656 HydrophobicContact CD2-CG 3.88Å; A644-Y656 HydrophobicContact CB-CD1 3.96Å; A644-Y656 HydrophobicContact CB-CE1 4.49Å; V646-Y656 HydrophobicContact CG2-CE1 3.85Å; P654-Y656 HydrophobicContact CB-CE2 3.92Å; P654-Y656 HydrophobicContact CG-CE2 3.84Å; P654-Y656 WeakPolarHBondContact CG-OH 3.46Å; P654-Y656 WeakPolarHBondContact O-CE2 3.05Å
657	S	94.3	Very high	93.5	Very high	19 Å²	19	57.6 Å²	57.6	13%	0.133	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.5	146.3	165.5	-165.5	0	0	0	0	110	L626 D659 C660	L626-S657 PolarHBondContact O-OG 3.22Å; S657-D659 PolarHBondContact O-N 3.33Å; S657-D659 PolarHBondContact OG-N 2.94Å; S657-D659 PolarHBondContact OG-OD2 2.97Å; S657-C660 PolarHBondContact O-N 2.99Å
658	R	92.8	Very high	93.4	Very high	72 Å²	72	60 Å²	60	27%	0.272	30%	0.3	S	S	.	.	G	3₁₀ helix	trans	-67.7	-25.1	169.6	-175.9	61.5	-178.2	171.2	5.6	111.5	P625 L626 E637 C660 V661	P625-R658 WeakPolarHBondContact O-CB 3.34Å; L626-R658 PolarHBondContact O-N 2.91Å; E637-R658 IonicContact OE1-CZ 3.31Å; E637-R658 IonicContact OE1-NH1 2.62Å; E637-R658 PolarHBondContact OE1-NH1 3.21Å; E637-R658 IonicContact OE1-NH2 3.04Å; E637-R658 PolarHBondContact OE1-NH2 3.48Å; E637-R658 IonicContact OE2-CZ 2.74Å; E637-R658 IonicContact OE2-NH1 3.08Å; E637-R658 PolarHBondContact OE2-NH1 3.03Å; E637-R658 IonicContact OE2-NH2 2.68Å; R658-C660 PolarHBondContact O-N 3.49Å; R658-V661 WeakPolarHBondContact O-CB 3.35Å; R658-V661 PolarHBondContact O-N 2.92Å
659	D	93.1	Very high	93.5	Very high	122 Å²	122	61.4 Å²	61.4	65%	0.652	31%	0.305	S	S	*	.	G	3₁₀ helix	trans	-60.9	-26.9	174.9	-38.6	-48.9	0	0	0	112.7	S657 V661	S657-D659 PolarHBondContact O-N 3.33Å; S657-D659 PolarHBondContact OG-N 2.94Å; S657-D659 PolarHBondContact OG-OD2 2.97Å; D659-V661 VanDerWaalsContact C-N 3.25Å; D659-V661 PolarHBondContact O-N 2.99Å
660	C	94.1	Very high	93.6	Very high	30 Å²	30	54 Å²	54	20%	0.203	28%	0.276	C	S	.	.	G	3₁₀ helix	trans	-81.3	-1.4	175.4	-57.2	0	0	0	0	112.8	L639 Y640 A644 S657 R658	L639-C660 CarbonylContact C-O 3.57Å; L639-C660 VanDerWaalsContact CA-O 3.25Å; L639-C660 WeakPolarHBondContact CA-O 3.32Å; L639-C660 HydrophobicContact CD2-CB 4.05Å; Y640-C660 PolarHBondContact N-O 3.12Å; Y640-C660 WeakPolarHBondContact O-CA 3.44Å; Y640-C660 WeakPolarHBondContact O-CB 3.41Å; Y640-C660 VanDerWaalsContact O-O 3.13Å; A644-C660 HydrophobicContact CB-CB 4.06Å; S657-C660 PolarHBondContact O-N 2.99Å; R658-C660 PolarHBondContact O-N 3.49Å
661	V	94.6	Very high	93.7	Very high	19 Å²	19	55.8 Å²	55.8	12%	0.115	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	117.5	176.6	-175.6	0	0	0	0	109.7	A628 L633 E637 A638 L639 R658 D659	A628-V661 HydrophobicContact CB-CG2 3.49Å; A628-V661 VanDerWaalsContact CB-CG2 3.49Å; L633-V661 HydrophobicContact CD2-CB 4.26Å; L633-V661 HydrophobicContact CD2-CG1 3.61Å; L633-V661 HydrophobicContact CD2-CG2 3.56Å; E637-V661 HydrophobicContact CB-CG1 3.9Å; E637-V661 HydrophobicContact CG-CG1 4.05Å; E637-V661 WeakPolarHBondContact OE2-CG1 3.46Å; A638-V661 WeakPolarHBondContact O-CA 3.29Å; L639-V661 HydrophobicContact CD2-CG2 3.69Å; L639-V661 HydrophobicContact CG-CG2 4.41Å; R658-V661 WeakPolarHBondContact O-CB 3.35Å; R658-V661 PolarHBondContact O-N 2.92Å; D659-V661 VanDerWaalsContact C-N 3.25Å; D659-V661 PolarHBondContact O-N 2.99Å
662	H	95.1	Very high	93.9	Very high	60 Å²	60	51 Å²	51	28%	0.278	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	142.7	178	-62.6	-98.9	0	0	0	110.9	E637 A638 W715	E637-H662 WeakPolarHBondContact CA-O 3.32Å; A638-H662 PolarHBondContact N-O 3.07Å; A638-H662 PolarHBondContact O-N 2.7Å; H662-W715 HydrophobicContact CB-CH2 4.09Å; H662-W715 HydrophobicContact CB-CZ3 3.6Å; H662-W715 AromaticContact CD2-CZ3 3.98Å; H662-W715 AromaticContact CG-CZ3 3.66Å
663	T	95.6	Very high	94.1	Very high	73 Å²	73	50.1 Å²	50.1	45%	0.448	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	137.4	166.9	-44.5	0	0	0	0	109.4	Y636 H665	Y636-T663 CarbonylContact O-C 3.49Å; T663-H665 WeakPolarHBondContact CG2-CE1 3.44Å
664	L	96	Very high	94.1	Very high	0 Å²	0	48 Å²	48	0%	0	24%	0.239	C	C	.	.			trans	-109	142.7	176.3	-47.8	178.6	0	0	0	109.5	Y636 A638 Y684 K685 L711 F712 W715	Y636-L664 PolarHBondContact O-N 2.97Å; A638-L664 HydrophobicContact CB-CD1 3.76Å; A638-L664 HydrophobicContact CB-CD2 4.37Å; A638-L664 HydrophobicContact CB-CG 4.21Å; L664-Y684 HydrophobicContact CD1-CD1 4.05Å; L664-Y684 HydrophobicContact CD2-CD1 4.04Å; L664-K685 HydrophobicContact CD1-CB 3.46Å; L664-K685 VanDerWaalsContact CD1-CB 3.46Å; L664-K685 HydrophobicContact CD1-CD 3.83Å; L664-K685 HydrophobicContact CD1-CG 4.31Å; L664-L711 HydrophobicContact CB-CB 3.72Å; L664-L711 HydrophobicContact CB-CD1 4.29Å; L664-L711 HydrophobicContact CD1-CB 4.17Å; L664-L711 HydrophobicContact CD1-CD1 4.5Å; L664-F712 WeakPolarHBondContact CA-O 3.39Å; L664-W715 HydrophobicContact CD2-CH2 3.67Å; L664-W715 HydrophobicContact CD2-CZ2 4.17Å
665	H	95.6	Very high	94.2	Very high	47 Å²	47	48.5 Å²	48.5	22%	0.218	24%	0.237	C	C	.	.	B	Isolated β-bridge	trans	-129.9	154	-179.2	-67.2	-29.7	0	0	0	111.3	T663 T669 W670 F712	T663-H665 WeakPolarHBondContact CG2-CE1 3.44Å; H665-T669 HydrophobicContact CB-CG2 3.81Å; H665-W670 HydrophobicContact CB-CD2 3.97Å; H665-W670 HydrophobicContact CB-CG 4.01Å; H665-W670 HydrophobicContact CB-CZ2 4.25Å; H665-W670 PolarHBondContact O-NE1 2.72Å; H665-F712 PolarHBondContact N-O 3.37Å; H665-F712 PolarHBondContact O-N 2.84Å
666	S	94.8	Very high	94.2	Very high	15 Å²	15	50.7 Å²	50.7	11%	0.105	25%	0.25	C	C	.	.			trans	-70	163.4	170.4	65.5	0	0	0	0	110.5	E668 T669 W670	S666-E668 PolarHBondContact O-N 3.46Å; S666-T669 PolarHBondContact O-N 2.97Å; S666-T669 PolarHBondContact OG-N 2.82Å; S666-T669 PolarHBondContact OG-OG1 3.43Å; S666-W670 PolarHBondContact O-N 2.86Å
667	R	93.3	Very high	94.3	Very high	106 Å²	106	49.1 Å²	49.1	40%	0.4	24%	0.244	S	C	.	.	H	α-helix	trans	-52.8	-39.4	174.9	-79.3	-179.4	176.1	-93.1	-5.9	112.4	L671 V677 R678 F712	R667-L671 PolarHBondContact O-N 2.88Å; R667-L671 VanDerWaalsContact O-N 3.09Å; R667-V677 HydrophobicContact CG-CB 3.95Å; R667-V677 HydrophobicContact CG-CG2 3.75Å; R667-V677 PolarHBondContact NH1-O 2.96Å; R667-V677 VanDerWaalsContact NH2-CG1 3.29Å; R667-R678 PolarHBondContact NH2-O 3.38Å; R667-F712 HydrophobicContact CG-CD2 4.19Å; R667-F712 HydrophobicContact CG-CE2 3.84Å
668	E	90.5	Very high	94.3	Very high	138 Å²	138	52.6 Å²	52.6	65%	0.645	25%	0.254	S	S	*	.	H	α-helix	trans	-67.1	-37.3	177.3	-63.3	176.5	-172.1	0	0	113.4	S666 K672	S666-E668 PolarHBondContact O-N 3.46Å; E668-K672 PolarHBondContact O-N 2.87Å
669	T	93.3	Very high	94.3	Very high	46 Å²	46	57.2 Å²	57.2	28%	0.282	28%	0.284	S	S	.	.	H	α-helix	trans	-78.4	-36	179.4	-65.7	0	0	0	0	111.5	H665 S666 L671 K672 E673	H665-T669 HydrophobicContact CB-CG2 3.81Å; S666-T669 PolarHBondContact O-N 2.97Å; S666-T669 PolarHBondContact OG-N 2.82Å; S666-T669 PolarHBondContact OG-OG1 3.43Å; T669-L671 VanDerWaalsContact C-N 3.29Å; T669-L671 PolarHBondContact O-N 2.73Å; T669-K672 WeakPolarHBondContact O-CB 3.38Å; T669-K672 PolarHBondContact O-N 2.74Å; T669-E673 PolarHBondContact O-N 2.7Å
670	W	95.7	Very high	94.2	Very high	9 Å²	9	55.3 Å²	55.3	3%	0.034	29%	0.293	C	S	.	.	H	α-helix	trans	-60.6	-37.8	168.9	-79.8	124.3	0	0	0	112.3	H665 S666 K672 E673 A674 R675 V677 F712 E714 T717	H665-W670 HydrophobicContact CB-CD2 3.97Å; H665-W670 HydrophobicContact CB-CG 4.01Å; H665-W670 HydrophobicContact CB-CZ2 4.25Å; H665-W670 PolarHBondContact O-NE1 2.72Å; S666-W670 PolarHBondContact O-N 2.86Å; W670-K672 VanDerWaalsContact C-N 3.28Å; W670-K672 PolarHBondContact O-N 2.8Å; W670-E673 HydrophobicContact CE3-CB 4.42Å; W670-E673 CarbonylContact O-C 3.51Å; W670-E673 WeakPolarHBondContact O-CA 3.27Å; W670-E673 WeakPolarHBondContact O-CB 3.48Å; W670-E673 PolarHBondContact O-N 2.66Å; W670-A674 PolarHBondContact O-N 2.86Å; W670-R675 CarbonylContact C-O 3.59Å; W670-R675 HydrophobicContact CB-CB 4.47Å; W670-R675 HydrophobicContact CE3-CB 4.18Å; W670-R675 PolarHBondContact O-N 3.05Å; W670-R675 VanDerWaalsContact O-O 3.05Å; W670-V677 HydrophobicContact CG-CG2 4.43Å; W670-F712 PolarHBondContact NE1-O 3.49Å; W670-E714 HydrophobicContact CH2-CB 3.75Å; W670-E714 HydrophobicContact CH2-CG 4.09Å; W670-E714 HydrophobicContact CZ2-CB 4.13Å; W670-E714 HydrophobicContact CZ3-CG 4.41Å; W670-T717 HydrophobicContact CB-CG2 4.46Å; W670-T717 HydrophobicContact CD2-CG2 3.82Å; W670-T717 HydrophobicContact CE3-CG2 4.45Å; W670-T717 HydrophobicContact CG-CG2 3.81Å
671	L	93.3	Very high	94.2	Very high	42 Å²	42	56.8 Å²	56.8	22%	0.22	30%	0.297	C	S	.	.	H	α-helix	trans	-62.3	-34.2	175.8	-175.4	63.6	0	0	0	112.4	R667 T669 E673 A674 R675 Y720 Y739 F741 M745	R667-L671 PolarHBondContact O-N 2.88Å; R667-L671 VanDerWaalsContact O-N 3.09Å; T669-L671 VanDerWaalsContact C-N 3.29Å; T669-L671 PolarHBondContact O-N 2.73Å; L671-E673 PolarHBondContact O-N 3.49Å; L671-A674 PolarHBondContact O-N 2.93Å; L671-R675 WeakPolarHBondContact CA-O 3.34Å; L671-R675 PolarHBondContact N-O 2.71Å; L671-Y720 HydrophobicContact CD1-CD2 3.83Å; L671-Y720 HydrophobicContact CD1-CE2 3.94Å; L671-Y720 HydrophobicContact CD1-CG 4.43Å; L671-Y739 HydrophobicContact CD2-CD2 4.26Å; L671-F741 HydrophobicContact CG-CE2 4.5Å; L671-M745 HydrophobicContact CD1-CE 3.74Å; L671-M745 HydrophobicContact CG-CE 4.16Å; L671-M745 WeakPolarHBondContact O-CE 3.4Å
672	K	93.2	Very high	94.2	Very high	86 Å²	86	63.6 Å²	63.6	37%	0.374	33%	0.327	S	S	.	.	H	α-helix	trans	-64.9	-25.2	172	-64.2	168.2	-169.8	169.7	0	112.7	E668 T669 W670 A674 F741	E668-K672 PolarHBondContact O-N 2.87Å; T669-K672 WeakPolarHBondContact O-CB 3.38Å; T669-K672 PolarHBondContact O-N 2.74Å; W670-K672 VanDerWaalsContact C-N 3.28Å; W670-K672 PolarHBondContact O-N 2.8Å; K672-A674 VanDerWaalsContact C-N 3.3Å; K672-F741 HydrophobicContact CB-CD2 4.26Å; K672-F741 HydrophobicContact CB-CG 4.23Å; K672-F741 HydrophobicContact CG-CD1 4.26Å; K672-F741 HydrophobicContact CG-CD2 4.05Å; K672-F741 HydrophobicContact CG-CE1 4.24Å; K672-F741 HydrophobicContact CG-CE2 3.99Å; K672-F741 HydrophobicContact CG-CG 4.17Å; K672-F741 HydrophobicContact CG-CZ 4.1Å; K672-F741 VanDerWaalsContact O-CB 3.3Å; K672-F741 WeakPolarHBondContact O-CB 3.43Å
673	E	93.4	Very high	94.1	Very high	43 Å²	43	63.4 Å²	63.4	20%	0.201	33%	0.331	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.5	7.9	172.3	-59.9	-132.3	107.7	0	0	113.4	R395 T669 W670 L671 R675 K742	R395-E673 IonicContact CZ-OE1 2.7Å; R395-E673 IonicContact NE-OE1 3.49Å; R395-E673 IonicContact NH2-OE1 3.51Å; R395-E673 PolarHBondContact NH2-OE1 2.8Å; T669-E673 PolarHBondContact O-N 2.7Å; W670-E673 HydrophobicContact CE3-CB 4.42Å; W670-E673 CarbonylContact O-C 3.51Å; W670-E673 WeakPolarHBondContact O-CA 3.27Å; W670-E673 WeakPolarHBondContact O-CB 3.48Å; W670-E673 PolarHBondContact O-N 2.66Å; L671-E673 PolarHBondContact O-N 3.49Å; E673-R675 VanDerWaalsContact C-N 3.33Å; E673-K742 WeakPolarHBondContact O-CE 3.46Å; E673-K742 PolarHBondContact O-NZ 3.47Å
674	A	94.3	Very high	94.1	Very high	8 Å²	8	63.2 Å²	63.2	7%	0.066	32%	0.323	C	S	.	.	T	Hydrogen-bonded Turn	trans	55.8	43.5	-171.5	0	0	0	0	0	113.1	W670 L671 K672 Y720 K742 C744 M745	W670-A674 PolarHBondContact O-N 2.86Å; L671-A674 PolarHBondContact O-N 2.93Å; K672-A674 VanDerWaalsContact C-N 3.3Å; A674-Y720 VanDerWaalsContact C-CB 3.43Å; A674-Y720 VanDerWaalsContact O-CB 3.22Å; A674-Y720 WeakPolarHBondContact O-CB 3.48Å; A674-Y720 PolarHBondContact O-N 2.95Å; A674-K742 HydrophobicContact CB-CB 4.17Å; A674-K742 HydrophobicContact CB-CD 3.9Å; A674-K742 HydrophobicContact CB-CG 4.38Å; A674-C744 VanDerWaalsContact CB-SG 3.59Å; A674-M745 HydrophobicContact CB-CG 3.6Å; A674-M745 HydrophobicContact CB-SD 3.86Å
675	R	95.6	Very high	94	Very high	47 Å²	47	66 Å²	66	18%	0.177	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	145.2	172.7	-59.2	-174.3	68.7	88.9	0.9	110.4	W670 L671 E673 E714 T717 E718	W670-R675 CarbonylContact C-O 3.59Å; W670-R675 HydrophobicContact CB-CB 4.47Å; W670-R675 HydrophobicContact CE3-CB 4.18Å; W670-R675 PolarHBondContact O-N 3.05Å; W670-R675 VanDerWaalsContact O-O 3.05Å; L671-R675 WeakPolarHBondContact CA-O 3.34Å; L671-R675 PolarHBondContact N-O 2.71Å; E673-R675 VanDerWaalsContact C-N 3.33Å; R675-E714 IonicContact CZ-OE1 3.67Å; R675-E714 IonicContact NH1-OE1 2.7Å; R675-T717 PolarHBondContact NE-OG1 2.66Å; R675-T717 PolarHBondContact NH2-O 3.37Å; R675-T717 PolarHBondContact NH2-OG1 3.49Å; R675-E718 CarbonylContact C-O 3.51Å; R675-E718 VanDerWaalsContact CA-O 3.32Å; R675-E718 WeakPolarHBondContact CA-O 3.16Å
676	T	94.7	Very high	93.9	Very high	45 Å²	45	67.8 Å²	67.8	28%	0.276	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	132.7	175.8	29.8	0	0	0	0	110	R678 T717 E718 Y720	T676-R678 PolarHBondContact O-N 3.16Å; T676-T717 CarbonylContact O-C 3.56Å; T676-T717 WeakPolarHBondContact O-CA 3.35Å; T676-T717 WeakPolarHBondContact O-CB 3.27Å; T676-E718 PolarHBondContact N-O 2.9Å; T676-E718 PolarHBondContact O-N 3.29Å; T676-Y720 HydrophobicContact CG2-CD2 3.88Å
677	V	96.1	Very high	93.8	Very high	5 Å²	5	67.4 Å²	67.4	3%	0.03	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.5	130.4	169.9	-179.4	0	0	0	0	107.9	R667 W670 E681 F712 Q716 T717	R667-V677 HydrophobicContact CG-CB 3.95Å; R667-V677 HydrophobicContact CG-CG2 3.75Å; R667-V677 PolarHBondContact NH1-O 2.96Å; R667-V677 VanDerWaalsContact NH2-CG1 3.29Å; W670-V677 HydrophobicContact CG-CG2 4.43Å; V677-E681 HydrophobicContact CG1-CB 3.94Å; V677-E681 HydrophobicContact CG1-CG 4.48Å; V677-F712 HydrophobicContact CB-CD1 4.48Å; V677-F712 HydrophobicContact CB-CG 4.31Å; V677-F712 HydrophobicContact CG1-CB 4.14Å; V677-F712 HydrophobicContact CG1-CD1 3.41Å; V677-F712 VanDerWaalsContact CG1-CD1 3.41Å; V677-F712 HydrophobicContact CG1-CD2 4.25Å; V677-F712 HydrophobicContact CG1-CE1 3.76Å; V677-F712 HydrophobicContact CG1-CG 3.67Å; V677-F712 HydrophobicContact CG1-CZ 4.32Å; V677-F712 HydrophobicContact CG2-CB 3.7Å; V677-F712 HydrophobicContact CG2-CD1 4.31Å; V677-F712 HydrophobicContact CG2-CD2 3.79Å; V677-F712 HydrophobicContact CG2-CG 3.67Å; V677-Q716 WeakPolarHBondContact CA-O 3.32Å; V677-Q716 HydrophobicContact CG1-CB 4.44Å; V677-T717 HydrophobicContact CB-CG2 4.47Å; V677-T717 HydrophobicContact CG2-CG2 3.86Å
678	R	95.5	Very high	93.6	Very high	92 Å²	92	65.1 Å²	65.1	35%	0.347	34%	0.335	S	S	.	.	P	Polyproline II helix	trans	-60.3	162	-173	-52.5	-177.4	-170.4	108.2	10.3	112.4	R667 T676 G680 E681 W715 Q716 T717 E718	R667-R678 PolarHBondContact NH2-O 3.38Å; T676-R678 PolarHBondContact O-N 3.16Å; R678-G680 PolarHBondContact O-N 3.22Å; R678-E681 HydrophobicContact CB-CG 3.75Å; R678-E681 HydrophobicContact CG-CG 4.47Å; R678-E681 IonicContact NH1-OE1 3.86Å; R678-E681 PolarHBondContact NH1-OE1 3.45Å; R678-W715 VanDerWaalsContact CZ-O 3.3Å; R678-W715 PolarHBondContact NH1-O 3.19Å; R678-W715 PolarHBondContact NH2-O 2.8Å; R678-Q716 PolarHBondContact N-O 3.27Å; R678-T717 PolarHBondContact NH2-O 3.1Å; R678-E718 HydrophobicContact CG-CB 4.37Å; R678-E718 HydrophobicContact CG-CG 4.35Å
679	L	91.6	Very high	93.3	Very high	169 Å²	169	58.6 Å²	58.6	89%	0.885	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.4	127.4	175.1	-61.6	174.5	0	0	0	110
680	G	91.8	Very high	92.7	Very high	82 Å²	82	61.1 Å²	61.1	85%	0.845	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	86.3	-2.7	179.5	0	0	0	0	0	116.5	R678	R678-G680 PolarHBondContact O-N 3.22Å
681	E	93.4	Very high	91.8	Very high	60 Å²	60	63.6 Å²	63.6	28%	0.28	33%	0.33	S	S	.	.	P	Polyproline II helix	trans	-68.7	129.1	173.5	-71.5	-86.2	-179.9	0	0	111.7	V677 R678 Q716	V677-E681 HydrophobicContact CG1-CB 3.94Å; V677-E681 HydrophobicContact CG1-CG 4.48Å; R678-E681 HydrophobicContact CB-CG 3.75Å; R678-E681 HydrophobicContact CG-CG 4.47Å; R678-E681 IonicContact NH1-OE1 3.86Å; R678-E681 PolarHBondContact NH1-OE1 3.45Å; E681-Q716 HydrophobicContact CB-CB 4.42Å; E681-Q716 HydrophobicContact CG-CB 4.13Å; E681-Q716 WeakPolarHBondContact OE2-CG 3.37Å; E681-Q716 PolarHBondContact OE2-NE2 3.14Å
682	E	94.4	Very high	91.1	Very high	162 Å²	162	66.9 Å²	66.9	76%	0.757	35%	0.348	S	S	*	.	P	Polyproline II helix	trans	-79.7	148.7	173.3	-64.2	-174	161.5	0	0	111.5	Y684 Q716	E682-Y684 PolarHBondContact O-N 2.95Å; E682-Q716 PolarHBondContact O-NE2 3.02Å
683	P	94.9	Very high	90.2	Very high	56 Å²	56	73 Å²	73	36%	0.364	37%	0.369	S	S	.	.	P	Polyproline II helix	trans	-64.6	127.7	178.4	-19.2	31.9	0	0	0	112.5	K685 M686 P710 F712	P683-K685 VanDerWaalsContact C-N 3.28Å; P683-K685 PolarHBondContact O-N 2.72Å; P683-M686 HydrophobicContact CB-SD 3.66Å; P683-M686 HydrophobicContact CG-SD 3.78Å; P683-P710 HydrophobicContact CB-CB 3.67Å; P683-P710 HydrophobicContact CG-CB 3.51Å; P683-F712 HydrophobicContact CB-CE1 4.11Å; P683-F712 HydrophobicContact CB-CZ 4.12Å; P683-F712 HydrophobicContact CG-CE1 4.03Å; P683-F712 HydrophobicContact CG-CZ 3.83Å
684	Y	94.7	Very high	89.4	Confident	70 Å²	70	71.7 Å²	71.7	28%	0.275	37%	0.365	S	S	.	.	S	Bend	trans	-69.2	-26.3	177.5	-163.6	-109.4	0	0	0	113.1	A638 L639 Y640 P642 L664 E682 L711 W715	A638-Y684 HydrophobicContact CB-CD1 3.95Å; A638-Y684 HydrophobicContact CB-CE1 3.69Å; L639-Y684 WeakPolarHBondContact O-CE1 3.41Å; L639-Y684 PolarHBondContact O-OH 3.39Å; Y640-Y684 HydrophobicContact CD2-CE2 4.13Å; P642-Y684 WeakPolarHBondContact CD-OH 3.41Å; P642-Y684 HydrophobicContact CG-CE2 4.05Å; P642-Y684 WeakPolarHBondContact CG-OH 3.33Å; L664-Y684 HydrophobicContact CD1-CD1 4.05Å; L664-Y684 HydrophobicContact CD2-CD1 4.04Å; E682-Y684 PolarHBondContact O-N 2.95Å; Y684-L711 PolarHBondContact N-O 2.79Å; Y684-W715 HydrophobicContact CD1-CH2 4.31Å; Y684-W715 AromaticContact CD1-CZ2 3.75Å; Y684-W715 HydrophobicContact CD1-CZ2 3.75Å; Y684-W715 AromaticContact CD2-CZ2 4Å; Y684-W715 HydrophobicContact CD2-CZ2 4Å; Y684-W715 HydrophobicContact CE1-CH2 4.24Å; Y684-W715 AromaticContact CE1-CZ2 3.8Å; Y684-W715 HydrophobicContact CE1-CZ2 3.8Å; Y684-W715 HydrophobicContact CE2-CZ2 4.06Å; Y684-W715 AromaticContact CG-CZ2 3.83Å; Y684-W715 HydrophobicContact CG-CZ2 3.83Å; Y684-W715 AromaticContact CZ-CZ2 3.96Å
685	K	94.2	Very high	88.5	Confident	59 Å²	59	74.3 Å²	74.3	26%	0.257	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.3	127.7	177.2	-164.7	-178.7	-171	-176.4	0	109.7	L634 K635 E637 L664 P683 V687 L711	L634-K685 PolarHBondContact O-NZ 3.25Å; L634-K685 VanDerWaalsContact O-NZ 3.15Å; K635-K685 WeakPolarHBondContact O-CE 3.43Å; K635-K685 PolarHBondContact O-NZ 2.84Å; E637-K685 PolarHBondContact O-NZ 3.45Å; L664-K685 HydrophobicContact CD1-CB 3.46Å; L664-K685 VanDerWaalsContact CD1-CB 3.46Å; L664-K685 HydrophobicContact CD1-CD 3.83Å; L664-K685 HydrophobicContact CD1-CG 4.31Å; P683-K685 VanDerWaalsContact C-N 3.28Å; P683-K685 PolarHBondContact O-N 2.72Å; K685-V687 HydrophobicContact CD-CG1 4.19Å; K685-V687 HydrophobicContact CG-CG1 4.11Å; K685-L711 HydrophobicContact CB-CB 4.4Å; K685-L711 HydrophobicContact CB-CD1 4.44Å; K685-L711 HydrophobicContact CD-CD1 4.38Å; K685-L711 PolarHBondContact N-O 3Å; K685-L711 WeakPolarHBondContact O-CA 3.38Å; K685-L711 VanDerWaalsContact O-CB 3.31Å; K685-L711 WeakPolarHBondContact O-CB 3.44Å; K685-L711 PolarHBondContact O-N 3.28Å
686	M	93.9	Very high	87.7	Confident	83 Å²	83	78.8 Å²	78.8	41%	0.409	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	138.6	166.4	-61.6	-60.1	-62.9	0	0	109.1	P683 N707 P710	P683-M686 HydrophobicContact CB-SD 3.66Å; P683-M686 HydrophobicContact CG-SD 3.78Å; M686-N707 HydrophobicContact CB-CB 3.8Å; M686-N707 WeakPolarHBondContact CE-O 3.37Å; M686-P710 HydrophobicContact CE-CB 4.12Å; M686-P710 VanDerWaalsContact SD-CA 3.59Å; M686-P710 HydrophobicContact SD-CB 3.71Å
687	V	91.7	Very high	86.7	Confident	8 Å²	8	79.3 Å²	79.3	5%	0.048	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	155	174.1	-57.3	0	0	0	0	111.9	K635 Y636 K685 G689 N707 D708 L709 L711	K635-V687 HydrophobicContact CG-CB 4.28Å; K635-V687 HydrophobicContact CG-CG1 4.15Å; Y636-V687 HydrophobicContact CE1-CG2 4.02Å; K685-V687 HydrophobicContact CD-CG1 4.19Å; K685-V687 HydrophobicContact CG-CG1 4.11Å; V687-G689 PolarHBondContact O-N 2.81Å; V687-N707 VanDerWaalsContact CA-OD1 3.28Å; V687-N707 WeakPolarHBondContact CA-OD1 3.49Å; V687-D708 PolarHBondContact O-N 3.38Å; V687-L709 HydrophobicContact CG2-CB 4.05Å; V687-L709 HydrophobicContact CG2-CD2 4.08Å; V687-L709 HydrophobicContact CG2-CG 4.35Å; V687-L709 PolarHBondContact N-O 3.06Å; V687-L709 WeakPolarHBondContact O-CA 3.32Å; V687-L709 VanDerWaalsContact O-CB 3.27Å; V687-L709 WeakPolarHBondContact O-CB 3.49Å; V687-L709 PolarHBondContact O-N 3.24Å; V687-L711 HydrophobicContact CB-CD1 4.41Å; V687-L711 HydrophobicContact CG1-CD1 3.7Å; V687-L711 HydrophobicContact CG2-CD1 3.77Å; V687-L711 HydrophobicContact CG2-CD2 4.33Å; V687-L711 HydrophobicContact CG2-CG 4.04Å
688	K	88.9	Confident	85.9	Confident	58 Å²	58	80.3 Å²	80.3	25%	0.252	41%	0.405	S	S	.	.			trans	-64.2	118.2	174.1	-161.2	169.3	-168.6	178.8	0	110.5	K635 R698 K704 D705 N707	K635-K688 VanDerWaalsContact CE-O 3.32Å; K635-K688 WeakPolarHBondContact CE-O 3.34Å; K635-K688 PolarHBondContact NZ-O 2.77Å; K688-R698 VanDerWaalsContact CE-NE 3.31Å; K688-K704 VanDerWaalsContact CE-O 3.23Å; K688-K704 WeakPolarHBondContact CE-O 3.2Å; K688-K704 PolarHBondContact NZ-O 3.15Å; K688-D705 IonicContact NZ-OD1 2.79Å; K688-D705 PolarHBondContact NZ-OD1 3.37Å; K688-N707 PolarHBondContact N-OD1 3.09Å
689	G	84.4	Confident	84.8	Confident	1 Å²	1	80.1 Å²	80.1	1%	0.01	41%	0.41	C	S	.	.			trans	-75.4	136.4	-177.2	0	0	0	0	0	112.9	V687 S694 R698 D708	V687-G689 PolarHBondContact O-N 2.81Å; G689-S694 VanDerWaalsContact O-CB 3.28Å; G689-S694 WeakPolarHBondContact O-CB 3.33Å; G689-R698 VanDerWaalsContact O-CZ 3.29Å; G689-R698 PolarHBondContact O-NH1 3.06Å; G689-R698 PolarHBondContact O-NH2 2.98Å; G689-D708 WeakPolarHBondContact CA-OD2 3.24Å; G689-D708 PolarHBondContact N-OD1 3.45Å; G689-D708 PolarHBondContact N-OD2 3.14Å
690	F	81.3	Confident	83.9	Confident	98 Å²	98	79.5 Å²	79.5	43%	0.43	40%	0.404	S	S	.	.			trans	-96.1	-0.8	179.2	-72.4	-49.2	0	0	0	114.8	S129 K635	S129-F690 WeakPolarHBondContact OG-CE2 3.48Å; S129-F690 WeakPolarHBondContact OG-CZ 3.48Å; K635-F690 HydrophobicContact CD-CE2 4.31Å
691	S	77.3	Confident	82.7	Confident	62 Å²	62	78.4 Å²	78.4	43%	0.434	38%	0.383	S	S	.	.	S	Bend	trans	-65.4	148.5	177.5	76	0	0	0	0	111.5	R693 S694 R695	S691-R693 PolarHBondContact O-N 3.25Å; S691-R693 VanDerWaalsContact O-N 3.08Å; S691-S694 WeakPolarHBondContact O-CA 3.35Å; S691-S694 VanDerWaalsContact O-CB 3.28Å; S691-S694 WeakPolarHBondContact O-CB 3.31Å; S691-S694 PolarHBondContact O-N 3.27Å; S691-S694 PolarHBondContact OG-N 2.77Å; S691-S694 PolarHBondContact OG-OG 3.24Å; S691-R695 PolarHBondContact O-N 3.25Å
692	N	77.2	Confident	81.6	Confident	111 Å²	111	85.2 Å²	85.2	59%	0.594	42%	0.415	S	S	*	.	H	α-helix	trans	-56.2	-30.1	177.9	-61.4	9.3	0	0	0	112.3	K696	N692-K696 WeakPolarHBondContact O-CB 3.41Å; N692-K696 PolarHBondContact O-N 3.3Å
693	R	75.4	Confident	79.9	Confident	214 Å²	214	82.5 Å²	82.5	81%	0.808	40%	0.404	S	S	*	.	H	α-helix	trans	-65	-46	171.6	-173.2	-178.9	-177.9	-173.1	2	112	S691 A697	S691-R693 PolarHBondContact O-N 3.25Å; S691-R693 VanDerWaalsContact O-N 3.08Å; R693-A697 VanDerWaalsContact O-CB 3.27Å; R693-A697 WeakPolarHBondContact O-CB 3.33Å; R693-A697 PolarHBondContact O-N 3.28Å
694	S	75.2	Confident	78.4	Confident	16 Å²	16	85.5 Å²	85.5	11%	0.112	41%	0.411	C	S	.	.	H	α-helix	trans	-62.4	-43.6	175.5	-49.4	0	0	0	0	111.4	G689 S691 A697 R698 D708	G689-S694 VanDerWaalsContact O-CB 3.28Å; G689-S694 WeakPolarHBondContact O-CB 3.33Å; S691-S694 WeakPolarHBondContact O-CA 3.35Å; S691-S694 VanDerWaalsContact O-CB 3.28Å; S691-S694 WeakPolarHBondContact O-CB 3.31Å; S691-S694 PolarHBondContact O-N 3.27Å; S691-S694 PolarHBondContact OG-N 2.77Å; S691-S694 PolarHBondContact OG-OG 3.24Å; S694-A697 PolarHBondContact O-N 3.14Å; S694-R698 PolarHBondContact O-N 2.89Å; S694-R698 VanDerWaalsContact O-N 3.07Å; S694-D708 WeakPolarHBondContact CB-OD2 3.31Å; S694-D708 PolarHBondContact OG-OD2 3.46Å
695	R	77.2	Confident	77.1	Confident	63 Å²	63	88.1 Å²	88.1	24%	0.238	43%	0.43	C	S	.	.	H	α-helix	trans	-63.5	-51.7	179.4	-151.8	-167.1	-61.6	174.2	-3.8	111.2	E124 E126 S691 A697 R698 M699	E124-R695 WeakPolarHBondContact OE1-CD 3.4Å; E124-R695 WeakPolarHBondContact OE1-CG 3.31Å; E124-R695 WeakPolarHBondContact OE2-CD 3.31Å; E124-R695 IonicContact OE2-CZ 3.18Å; E124-R695 IonicContact OE2-NE 2.62Å; E124-R695 IonicContact OE2-NH1 3.54Å; E124-R695 PolarHBondContact OE2-NH1 3Å; E126-R695 IonicContact OE1-CZ 3.88Å; E126-R695 IonicContact OE1-NH1 2.74Å; E126-R695 PolarHBondContact OE1-NH1 3.28Å; E126-R695 IonicContact OE1-NH2 3.85Å; E126-R695 PolarHBondContact OE1-NH2 2.78Å; S691-R695 PolarHBondContact O-N 3.25Å; R695-A697 VanDerWaalsContact C-N 3.32Å; R695-A697 PolarHBondContact O-N 3.2Å; R695-R698 PolarHBondContact O-N 3.04Å; R695-M699 PolarHBondContact O-N 3.38Å; R695-M699 VanDerWaalsContact O-N 3.08Å
696	K	76.9	Confident	76.3	Confident	141 Å²	141	90.7 Å²	90.7	61%	0.613	44%	0.443	S	S	*	.	H	α-helix	trans	-61.8	-36.3	176.1	-172.9	165.9	-176	168.7	0	112.7	N692 M699 M700	N692-K696 WeakPolarHBondContact O-CB 3.41Å; N692-K696 PolarHBondContact O-N 3.3Å; K696-M699 PolarHBondContact O-N 2.54Å; K696-M700 PolarHBondContact O-N 3.06Å; K696-M700 VanDerWaalsContact O-N 3.08Å
697	A	75.5	Confident	75.7	Confident	55 Å²	55	90.9 Å²	90.9	46%	0.455	45%	0.446	S	S	.	.	H	α-helix	trans	-63.6	-40.1	175.4	0	0	0	0	0	112.6	R693 S694 R695 M699 M700 S701	R693-A697 VanDerWaalsContact O-CB 3.27Å; R693-A697 WeakPolarHBondContact O-CB 3.33Å; R693-A697 PolarHBondContact O-N 3.28Å; S694-A697 PolarHBondContact O-N 3.14Å; R695-A697 VanDerWaalsContact C-N 3.32Å; R695-A697 PolarHBondContact O-N 3.2Å; A697-M699 VanDerWaalsContact C-N 3.35Å; A697-M700 PolarHBondContact O-N 3.2Å; A697-S701 PolarHBondContact O-N 2.96Å
698	R	77.6	Confident	75.5	Confident	26 Å²	26	93.3 Å²	93.3	10%	0.098	46%	0.458	C	S	.	.	H	α-helix	trans	-76	-15.2	175.1	-69.3	-171.5	-53.2	-96.2	-6.7	114.7	K688 G689 S694 R695 S701 D708	K688-R698 VanDerWaalsContact CE-NE 3.31Å; G689-R698 VanDerWaalsContact O-CZ 3.29Å; G689-R698 PolarHBondContact O-NH1 3.06Å; G689-R698 PolarHBondContact O-NH2 2.98Å; S694-R698 PolarHBondContact O-N 2.89Å; S694-R698 VanDerWaalsContact O-N 3.07Å; R695-R698 PolarHBondContact O-N 3.04Å; R698-S701 VanDerWaalsContact O-O 3.13Å; R698-D708 IonicContact CZ-OD1 2.82Å; R698-D708 IonicContact NH1-OD1 3.82Å; R698-D708 PolarHBondContact NH1-OD1 3.27Å; R698-D708 IonicContact NH1-OD2 2.95Å
699	M	72.9	Confident	75.6	Confident	89 Å²	89	92.7 Å²	92.7	44%	0.438	46%	0.458	S	S	.	.	H	α-helix	trans	-81.6	-28.6	166.4	-74.1	-165.7	130.1	0	0	112.4	E124 R695 K696 A697 S701	E124-M699 HydrophobicContact CG-CE 3.53Å; E124-M699 HydrophobicContact CG-SD 4.25Å; R695-M699 PolarHBondContact O-N 3.38Å; R695-M699 VanDerWaalsContact O-N 3.08Å; K696-M699 PolarHBondContact O-N 2.54Å; A697-M699 VanDerWaalsContact C-N 3.35Å; M699-S701 VanDerWaalsContact C-N 3.27Å; M699-S701 PolarHBondContact O-N 2.82Å
700	M	72.1	Confident	76	Confident	155 Å²	155	94.8 Å²	94.8	76%	0.764	47%	0.471	S	S	*	.	S	Bend	trans	-83.8	1	176.9	-162.6	-176.8	-71	0	0	113.2	K696 A697	K696-M700 PolarHBondContact O-N 3.06Å; K696-M700 VanDerWaalsContact O-N 3.08Å; A697-M700 PolarHBondContact O-N 3.2Å
701	S	68.2	Low	76.7	Confident	60 Å²	60	90.2 Å²	90.2	42%	0.42	45%	0.451	S	S	.	.	S	Bend	trans	-131.2	141	-177.3	-174.6	0	0	0	0	110.5	A697 R698 M699 M703	A697-S701 PolarHBondContact O-N 2.96Å; R698-S701 VanDerWaalsContact O-O 3.13Å; M699-S701 VanDerWaalsContact C-N 3.27Å; M699-S701 PolarHBondContact O-N 2.82Å; S701-M703 PolarHBondContact O-N 3.08Å; S701-M703 VanDerWaalsContact O-N 3.14Å; S701-M703 PolarHBondContact OG-N 2.8Å
702	E	69.6	Low	77.7	Confident	203 Å²	203	87.6 Å²	87.6	95%	0.949	43%	0.432	S	S	*	.	S	Bend	trans	-61.3	-19.9	174.6	-59.2	-179.6	155.4	0	0	112.2	K704	E702-K704 VanDerWaalsContact C-N 3.3Å; E702-K704 PolarHBondContact O-N 3.37Å
703	M	58.8	Low	78.6	Confident	104 Å²	104	82.3 Å²	82.3	51%	0.512	40%	0.403	S	S	.	.			trans	-82.6	60.9	177.7	-66	-59.3	-165.9	0	0	113.2	S701 D705 E706	S701-M703 PolarHBondContact O-N 3.08Å; S701-M703 VanDerWaalsContact O-N 3.14Å; S701-M703 PolarHBondContact OG-N 2.8Å; M703-D705 PolarHBondContact O-N 3.31Å; M703-E706 HydrophobicContact CB-CB 4.29Å; M703-E706 HydrophobicContact CB-CG 3.88Å; M703-E706 HydrophobicContact CG-CG 4.27Å; M703-E706 PolarHBondContact O-N 3.34Å; M703-E706 HydrophobicContact SD-CG 4.4Å
704	K	62.9	Low	79.5	Confident	119 Å²	119	76.7 Å²	76.7	52%	0.517	39%	0.386	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60	-14.6	-175.8	-162.2	165.6	-176.4	168.9	0	115.1	K688 E702	K688-K704 VanDerWaalsContact CE-O 3.23Å; K688-K704 WeakPolarHBondContact CE-O 3.2Å; K688-K704 PolarHBondContact NZ-O 3.15Å; E702-K704 VanDerWaalsContact C-N 3.3Å; E702-K704 PolarHBondContact O-N 3.37Å
705	D	67.4	Low	80.5	Confident	126 Å²	126	78.3 Å²	78.3	67%	0.674	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	-122	7.1	-174.9	-77.5	-52.5	0	0	0	116.3	K688 M703	K688-D705 IonicContact NZ-OD1 2.79Å; K688-D705 PolarHBondContact NZ-OD1 3.37Å; M703-D705 PolarHBondContact O-N 3.31Å
706	E	77.1	Confident	81.4	Confident	113 Å²	113	75.9 Å²	75.9	53%	0.528	38%	0.381	S	S	.	.			trans	-69	147.9	174.2	-78.9	-173.3	158.6	0	0	113	M703 D708	M703-E706 HydrophobicContact CB-CB 4.29Å; M703-E706 HydrophobicContact CB-CG 3.88Å; M703-E706 HydrophobicContact CG-CG 4.27Å; M703-E706 PolarHBondContact O-N 3.34Å; M703-E706 HydrophobicContact SD-CG 4.4Å; E706-D708 PolarHBondContact O-N 3.25Å
707	N	83.3	Confident	82.3	Confident	87 Å²	87	69.2 Å²	69.2	47%	0.465	35%	0.353	S	S	.	.			trans	-86.3	96.6	179.3	-74.4	-67.9	0	0	0	110.1	M686 V687 K688	M686-N707 HydrophobicContact CB-CB 3.8Å; M686-N707 WeakPolarHBondContact CE-O 3.37Å; V687-N707 VanDerWaalsContact CA-OD1 3.28Å; V687-N707 WeakPolarHBondContact CA-OD1 3.49Å; K688-N707 PolarHBondContact N-OD1 3.09Å
708	D	85.9	Confident	83.2	Confident	59 Å²	59	70.2 Å²	70.2	32%	0.316	35%	0.348	S	S	.	.			trans	-86.1	-19.3	-170.6	58	-71.1	0	0	0	116	V687 G689 S694 R698 E706 P710	V687-D708 PolarHBondContact O-N 3.38Å; G689-D708 WeakPolarHBondContact CA-OD2 3.24Å; G689-D708 PolarHBondContact N-OD1 3.45Å; G689-D708 PolarHBondContact N-OD2 3.14Å; S694-D708 WeakPolarHBondContact CB-OD2 3.31Å; S694-D708 PolarHBondContact OG-OD2 3.46Å; R698-D708 IonicContact CZ-OD1 2.82Å; R698-D708 IonicContact NH1-OD1 3.82Å; R698-D708 PolarHBondContact NH1-OD1 3.27Å; R698-D708 IonicContact NH1-OD2 2.95Å; E706-D708 PolarHBondContact O-N 3.25Å; D708-P710 VanDerWaalsContact O-CD 3.29Å; D708-P710 WeakPolarHBondContact O-CD 3.24Å
709	L	90.8	Very high	84	Confident	45 Å²	45	75.8 Å²	75.8	24%	0.236	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	111.6	-175	-176.4	65.4	0	0	0	111.8	Y636 V687 L711	Y636-L709 HydrophobicContact CE1-CD2 4.3Å; V687-L709 HydrophobicContact CG2-CB 4.05Å; V687-L709 HydrophobicContact CG2-CD2 4.08Å; V687-L709 HydrophobicContact CG2-CG 4.35Å; V687-L709 PolarHBondContact N-O 3.06Å; V687-L709 WeakPolarHBondContact O-CA 3.32Å; V687-L709 VanDerWaalsContact O-CB 3.27Å; V687-L709 WeakPolarHBondContact O-CB 3.49Å; V687-L709 PolarHBondContact O-N 3.24Å; L709-L711 HydrophobicContact CD2-CD2 4.11Å; L709-L711 HydrophobicContact CG-CD2 4.15Å
710	P	94.3	Very high	85	Confident	45 Å²	45	74.6 Å²	74.6	29%	0.292	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	129.7	173.5	30.2	-34.9	0	0	0	112	P683 M686 D708 F712	P683-P710 HydrophobicContact CB-CB 3.67Å; P683-P710 HydrophobicContact CG-CB 3.51Å; M686-P710 HydrophobicContact CE-CB 4.12Å; M686-P710 VanDerWaalsContact SD-CA 3.59Å; M686-P710 HydrophobicContact SD-CB 3.71Å; D708-P710 VanDerWaalsContact O-CD 3.29Å; D708-P710 WeakPolarHBondContact O-CD 3.24Å; P710-F712 HydrophobicContact CB-CE2 3.86Å; P710-F712 HydrophobicContact CB-CZ 4.08Å; P710-F712 HydrophobicContact CG-CE2 4.27Å
711	L	95.9	Very high	86	Confident	2 Å²	2	74.9 Å²	74.9	1%	0.01	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	142.2	174.1	-50.5	175.1	0	0	0	110.9	Y636 L664 Y684 K685 V687 L709	Y636-L711 HydrophobicContact CD1-CD1 3.67Å; Y636-L711 HydrophobicContact CD1-CD2 3.9Å; Y636-L711 HydrophobicContact CD1-CG 4.45Å; Y636-L711 HydrophobicContact CE1-CD1 4.35Å; Y636-L711 HydrophobicContact CE1-CD2 4.21Å; L664-L711 HydrophobicContact CB-CB 3.72Å; L664-L711 HydrophobicContact CB-CD1 4.29Å; L664-L711 HydrophobicContact CD1-CB 4.17Å; L664-L711 HydrophobicContact CD1-CD1 4.5Å; Y684-L711 PolarHBondContact N-O 2.79Å; K685-L711 HydrophobicContact CB-CB 4.4Å; K685-L711 HydrophobicContact CB-CD1 4.44Å; K685-L711 HydrophobicContact CD-CD1 4.38Å; K685-L711 PolarHBondContact N-O 3Å; K685-L711 WeakPolarHBondContact O-CA 3.38Å; K685-L711 VanDerWaalsContact O-CB 3.31Å; K685-L711 WeakPolarHBondContact O-CB 3.44Å; K685-L711 PolarHBondContact O-N 3.28Å; V687-L711 HydrophobicContact CB-CD1 4.41Å; V687-L711 HydrophobicContact CG1-CD1 3.7Å; V687-L711 HydrophobicContact CG2-CD1 3.77Å; V687-L711 HydrophobicContact CG2-CD2 4.33Å; V687-L711 HydrophobicContact CG2-CG 4.04Å; L709-L711 HydrophobicContact CD2-CD2 4.11Å; L709-L711 HydrophobicContact CG-CD2 4.15Å
712	F	97.2	Very high	87.1	Confident	6 Å²	6	73.7 Å²	73.7	3%	0.026	36%	0.357	C	S	.	.	B	Isolated β-bridge	trans	-126.5	147.1	-178	-56.9	-91.6	0	0	0	110.1	L664 H665 R667 W670 V677 P683 P710 Q716	L664-F712 WeakPolarHBondContact CA-O 3.39Å; H665-F712 PolarHBondContact N-O 3.37Å; H665-F712 PolarHBondContact O-N 2.84Å; R667-F712 HydrophobicContact CG-CD2 4.19Å; R667-F712 HydrophobicContact CG-CE2 3.84Å; W670-F712 PolarHBondContact NE1-O 3.49Å; V677-F712 HydrophobicContact CB-CD1 4.48Å; V677-F712 HydrophobicContact CB-CG 4.31Å; V677-F712 HydrophobicContact CG1-CB 4.14Å; V677-F712 HydrophobicContact CG1-CD1 3.41Å; V677-F712 VanDerWaalsContact CG1-CD1 3.41Å; V677-F712 HydrophobicContact CG1-CD2 4.25Å; V677-F712 HydrophobicContact CG1-CE1 3.76Å; V677-F712 HydrophobicContact CG1-CG 3.67Å; V677-F712 HydrophobicContact CG1-CZ 4.32Å; V677-F712 HydrophobicContact CG2-CB 3.7Å; V677-F712 HydrophobicContact CG2-CD1 4.31Å; V677-F712 HydrophobicContact CG2-CD2 3.79Å; V677-F712 HydrophobicContact CG2-CG 3.67Å; P683-F712 HydrophobicContact CB-CE1 4.11Å; P683-F712 HydrophobicContact CB-CZ 4.12Å; P683-F712 HydrophobicContact CG-CE1 4.03Å; P683-F712 HydrophobicContact CG-CZ 3.83Å; P710-F712 HydrophobicContact CB-CE2 3.86Å; P710-F712 HydrophobicContact CB-CZ 4.08Å; P710-F712 HydrophobicContact CG-CE2 4.27Å; F712-Q716 HydrophobicContact CB-CB 4.47Å
713	G	96.1	Very high	88.2	Confident	0 Å²	0	66.4 Å²	66.4	0%	0	33%	0.327	C	S	.	.			trans	-88.9	163.5	173.1	0	0	0	0	0	112.9	W715 Q716	G713-W715 PolarHBondContact O-N 3.18Å; G713-Q716 WeakPolarHBondContact O-CB 3.46Å; G713-Q716 PolarHBondContact O-N 3.45Å
714	E	95.3	Very high	89.7	Confident	96 Å²	96	67 Å²	67	45%	0.449	33%	0.331	S	S	.	.	G	3₁₀ helix	trans	-58.3	-35.6	-177.2	-167.3	-177.3	176.7	0	0	112.6	W670 R675 Q716 T717	W670-E714 HydrophobicContact CH2-CB 3.75Å; W670-E714 HydrophobicContact CH2-CG 4.09Å; W670-E714 HydrophobicContact CZ2-CB 4.13Å; W670-E714 HydrophobicContact CZ3-CG 4.41Å; R675-E714 IonicContact CZ-OE1 3.67Å; R675-E714 IonicContact NH1-OE1 2.7Å; E714-Q716 PolarHBondContact O-N 3.27Å; E714-Q716 VanDerWaalsContact O-N 3.13Å; E714-T717 WeakPolarHBondContact O-CB 3.42Å; E714-T717 PolarHBondContact O-N 2.91Å; E714-T717 PolarHBondContact O-OG1 3.38Å
715	W	95	Very high	91	Very high	51 Å²	51	62.5 Å²	62.5	19%	0.193	32%	0.315	C	S	.	.	G	3₁₀ helix	trans	-60.7	-21.7	177	56.7	91.3	0	0	0	114.1	Y640 H662 L664 R678 Y684 G713 T717	Y640-W715 AromaticContact CD1-CD2 3.78Å; Y640-W715 HydrophobicContact CD1-CD2 3.78Å; Y640-W715 AromaticContact CD1-CE3 3.62Å; Y640-W715 HydrophobicContact CD1-CE3 3.62Å; Y640-W715 HydrophobicContact CD1-CG 4.34Å; Y640-W715 HydrophobicContact CD1-CH2 4.37Å; Y640-W715 AromaticContact CD1-CZ3 3.94Å; Y640-W715 HydrophobicContact CD1-CZ3 3.94Å; Y640-W715 AromaticContact CD2-CD2 3.64Å; Y640-W715 HydrophobicContact CD2-CD2 3.64Å; Y640-W715 AromaticContact CD2-CE2 3.23Å; Y640-W715 HydrophobicContact CD2-CE3 4.13Å; Y640-W715 HydrophobicContact CD2-CG 4.19Å; Y640-W715 AromaticContact CD2-CH2 3.92Å; Y640-W715 HydrophobicContact CD2-CH2 3.92Å; Y640-W715 AromaticContact CD2-CZ2 3.39Å; Y640-W715 HydrophobicContact CD2-CZ2 3.39Å; Y640-W715 HydrophobicContact CD2-CZ3 4.26Å; Y640-W715 AromaticContact CD2-NE1 3.55Å; Y640-W715 HydrophobicContact CE1-CB 4.12Å; Y640-W715 AromaticContact CE1-CD2 3.8Å; Y640-W715 HydrophobicContact CE1-CD2 3.8Å; Y640-W715 AromaticContact CE1-CE3 3.98Å; Y640-W715 HydrophobicContact CE1-CE3 3.98Å; Y640-W715 AromaticContact CE1-CG 3.85Å; Y640-W715 HydrophobicContact CE1-CG 3.85Å; Y640-W715 AromaticContact CE2-CD1 3.46Å; Y640-W715 VanDerWaalsContact CE2-CD1 3.46Å; Y640-W715 AromaticContact CE2-CD2 3.66Å; Y640-W715 HydrophobicContact CE2-CD2 3.66Å; Y640-W715 AromaticContact CE2-CE2 3.46Å; Y640-W715 VanDerWaalsContact CE2-CE2 3.46Å; Y640-W715 HydrophobicContact CE2-CE3 4.46Å; Y640-W715 AromaticContact CE2-CG 3.68Å; Y640-W715 HydrophobicContact CE2-CG 3.68Å; Y640-W715 HydrophobicContact CE2-CZ2 4.11Å; Y640-W715 AromaticContact CE2-NE1 3.3Å; Y640-W715 VanDerWaalsContact CE2-NE1 3.3Å; Y640-W715 AromaticContact CG-CD2 3.7Å; Y640-W715 HydrophobicContact CG-CD2 3.7Å; Y640-W715 AromaticContact CG-CE2 3.66Å; Y640-W715 AromaticContact CG-CE3 3.7Å; Y640-W715 HydrophobicContact CG-CE3 3.7Å; Y640-W715 HydrophobicContact CG-CG 4.49Å; Y640-W715 AromaticContact CG-CH2 3.64Å; Y640-W715 HydrophobicContact CG-CH2 3.64Å; Y640-W715 AromaticContact CG-CZ2 3.64Å; Y640-W715 HydrophobicContact CG-CZ2 3.64Å; Y640-W715 AromaticContact CG-CZ3 3.67Å; Y640-W715 HydrophobicContact CG-CZ3 3.67Å; Y640-W715 AromaticContact CZ-CD1 3.64Å; Y640-W715 AromaticContact CZ-CD2 3.73Å; Y640-W715 AromaticContact CZ-CG 3.49Å; Y640-W715 VanDerWaalsContact CZ-CG 3.49Å; Y640-W715 AromaticContact CZ-NE1 3.96Å; H662-W715 HydrophobicContact CB-CH2 4.09Å; H662-W715 HydrophobicContact CB-CZ3 3.6Å; H662-W715 AromaticContact CD2-CZ3 3.98Å; H662-W715 AromaticContact CG-CZ3 3.66Å; L664-W715 HydrophobicContact CD2-CH2 3.67Å; L664-W715 HydrophobicContact CD2-CZ2 4.17Å; R678-W715 VanDerWaalsContact CZ-O 3.3Å; R678-W715 PolarHBondContact NH1-O 3.19Å; R678-W715 PolarHBondContact NH2-O 2.8Å; Y684-W715 HydrophobicContact CD1-CH2 4.31Å; Y684-W715 AromaticContact CD1-CZ2 3.75Å; Y684-W715 HydrophobicContact CD1-CZ2 3.75Å; Y684-W715 AromaticContact CD2-CZ2 4Å; Y684-W715 HydrophobicContact CD2-CZ2 4Å; Y684-W715 HydrophobicContact CE1-CH2 4.24Å; Y684-W715 AromaticContact CE1-CZ2 3.8Å; Y684-W715 HydrophobicContact CE1-CZ2 3.8Å; Y684-W715 HydrophobicContact CE2-CZ2 4.06Å; Y684-W715 AromaticContact CG-CZ2 3.83Å; Y684-W715 HydrophobicContact CG-CZ2 3.83Å; Y684-W715 AromaticContact CZ-CZ2 3.96Å; G713-W715 PolarHBondContact O-N 3.18Å; W715-T717 VanDerWaalsContact C-N 3.33Å
716	Q	96.1	Very high	92	Very high	11 Å²	11	60.8 Å²	60.8	5%	0.051	31%	0.309	C	S	.	.	G	3₁₀ helix	trans	-89.8	1.5	175.9	-49.5	-169	-90.4	0	0	113	V677 R678 E681 E682 F712 G713 E714	V677-Q716 WeakPolarHBondContact CA-O 3.32Å; V677-Q716 HydrophobicContact CG1-CB 4.44Å; R678-Q716 PolarHBondContact N-O 3.27Å; E681-Q716 HydrophobicContact CB-CB 4.42Å; E681-Q716 HydrophobicContact CG-CB 4.13Å; E681-Q716 WeakPolarHBondContact OE2-CG 3.37Å; E681-Q716 PolarHBondContact OE2-NE2 3.14Å; E682-Q716 PolarHBondContact O-NE2 3.02Å; F712-Q716 HydrophobicContact CB-CB 4.47Å; G713-Q716 WeakPolarHBondContact O-CB 3.46Å; G713-Q716 PolarHBondContact O-N 3.45Å; E714-Q716 PolarHBondContact O-N 3.27Å; E714-Q716 VanDerWaalsContact O-N 3.13Å
717	T	96.1	Very high	92.2	Very high	2 Å²	2	62.1 Å²	62.1	1%	0.012	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	155.4	-178.5	66.2	0	0	0	0	112.1	W670 R675 T676 V677 R678 E714 W715	W670-T717 HydrophobicContact CB-CG2 4.46Å; W670-T717 HydrophobicContact CD2-CG2 3.82Å; W670-T717 HydrophobicContact CE3-CG2 4.45Å; W670-T717 HydrophobicContact CG-CG2 3.81Å; R675-T717 PolarHBondContact NE-OG1 2.66Å; R675-T717 PolarHBondContact NH2-O 3.37Å; R675-T717 PolarHBondContact NH2-OG1 3.49Å; T676-T717 CarbonylContact O-C 3.56Å; T676-T717 WeakPolarHBondContact O-CA 3.35Å; T676-T717 WeakPolarHBondContact O-CB 3.27Å; V677-T717 HydrophobicContact CB-CG2 4.47Å; V677-T717 HydrophobicContact CG2-CG2 3.86Å; R678-T717 PolarHBondContact NH2-O 3.1Å; E714-T717 WeakPolarHBondContact O-CB 3.42Å; E714-T717 PolarHBondContact O-N 2.91Å; E714-T717 PolarHBondContact O-OG1 3.38Å; W715-T717 VanDerWaalsContact C-N 3.33Å
718	E	95.8	Very high	92.1	Very high	75 Å²	75	59.5 Å²	59.5	35%	0.35	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	165.4	164.9	66.5	-146.6	148.5	0	0	109.4	R675 T676 R678	R675-E718 CarbonylContact C-O 3.51Å; R675-E718 VanDerWaalsContact CA-O 3.32Å; R675-E718 WeakPolarHBondContact CA-O 3.16Å; T676-E718 PolarHBondContact N-O 2.9Å; T676-E718 PolarHBondContact O-N 3.29Å; R678-E718 HydrophobicContact CG-CB 4.37Å; R678-E718 HydrophobicContact CG-CG 4.35Å
719	E	94.3	Very high	92.3	Very high	144 Å²	144	62.9 Å²	62.9	67%	0.673	33%	0.326	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-68.4	138.2	176	-65.3	179	178.2	0	0	109.8	Q721	E719-Q721 PolarHBondContact O-N 3.37Å; E719-Q721 VanDerWaalsContact O-N 3.14Å
720	Y	93.8	Very high	92.3	Very high	63 Å²	63	61 Å²	61	25%	0.247	32%	0.316	C	S	.	.			trans	-64.7	115.8	-179.9	174.5	-105.9	0	0	0	110	L671 A674 T676 P722 P723 M745	L671-Y720 HydrophobicContact CD1-CD2 3.83Å; L671-Y720 HydrophobicContact CD1-CE2 3.94Å; L671-Y720 HydrophobicContact CD1-CG 4.43Å; A674-Y720 VanDerWaalsContact C-CB 3.43Å; A674-Y720 VanDerWaalsContact O-CB 3.22Å; A674-Y720 WeakPolarHBondContact O-CB 3.48Å; A674-Y720 PolarHBondContact O-N 2.95Å; T676-Y720 HydrophobicContact CG2-CD2 3.88Å; Y720-P722 HydrophobicContact CE1-CB 4.09Å; Y720-P722 VanDerWaalsContact O-CD 3.3Å; Y720-P722 WeakPolarHBondContact O-CD 2.84Å; Y720-P723 WeakPolarHBondContact OH-CD 3.34Å; Y720-M745 HydrophobicContact CD1-CB 4.17Å; Y720-M745 HydrophobicContact CD1-CE 3.96Å; Y720-M745 HydrophobicContact CD1-CG 3.86Å; Y720-M745 HydrophobicContact CE1-CB 4.01Å; Y720-M745 HydrophobicContact CE1-CE 3.9Å; Y720-M745 HydrophobicContact CE1-CG 4.16Å; Y720-M745 HydrophobicContact CG-CE 4.4Å
721	Q	92.1	Very high	92.2	Very high	161 Å²	161	60.5 Å²	60.5	75%	0.752	31%	0.313	S	S	*	.			trans	-83.1	112.2	171.8	-62.5	-178	21.1	0	0	108.2	E719	E719-Q721 PolarHBondContact O-N 3.37Å; E719-Q721 VanDerWaalsContact O-N 3.14Å
722	P	91.8	Very high	92	Very high	36 Å²	36	65.3 Å²	65.3	23%	0.234	33%	0.331	C	S	.	.	P	Polyproline II helix	trans	-66.6	143.2	178.9	27.5	-34.1	0	0	0	110.6	Y720 I746 V748	Y720-P722 HydrophobicContact CE1-CB 4.09Å; Y720-P722 VanDerWaalsContact O-CD 3.3Å; Y720-P722 WeakPolarHBondContact O-CD 2.84Å; P722-I746 VanDerWaalsContact CB-O 3.25Å; P722-I746 WeakPolarHBondContact CB-O 3.32Å; P722-V748 HydrophobicContact CG-CG2 4.04Å
723	P	91.8	Very high	91.7	Very high	50 Å²	50	66.6 Å²	66.6	33%	0.325	34%	0.338	S	S	.	.	P	Polyproline II helix	trans	-64.7	154.2	177.3	29.2	-36.3	0	0	0	111	Y720 P731 P747 V748	Y720-P723 WeakPolarHBondContact OH-CD 3.34Å; P723-P731 HydrophobicContact CB-CB 3.72Å; P723-P731 HydrophobicContact CB-CG 3.93Å; P723-P731 HydrophobicContact CG-CB 3.59Å; P723-P731 HydrophobicContact CG-CG 4.03Å; P723-P747 HydrophobicContact CG-CB 4.41Å; P723-P747 HydrophobicContact CG-CG 4.41Å; P723-P747 CarbonylContact O-C 3.54Å; P723-P747 WeakPolarHBondContact O-CA 3.47Å; P723-P747 VanDerWaalsContact O-CB 3.31Å; P723-P747 WeakPolarHBondContact O-CB 3.45Å; P723-V748 PolarHBondContact O-N 3.29Å
724	I	89.8	Confident	91.4	Very high	117 Å²	117	74.6 Å²	74.6	60%	0.6	38%	0.381	S	S	*	.	B	Isolated β-bridge	trans	-91.3	136.5	178	-49.9	177.6	0	0	0	108.7	P731 V748	I724-P731 VanDerWaalsContact O-CG 3.28Å; I724-P731 WeakPolarHBondContact O-CG 3.48Å; I724-V748 HydrophobicContact CB-CB 4.42Å; I724-V748 HydrophobicContact CG1-CB 4.16Å; I724-V748 HydrophobicContact CG1-CG2 4.39Å; I724-V748 HydrophobicContact CG2-CB 4.3Å
725	A	91	Very high	91	Very high	23 Å²	23	78.3 Å²	78.3	19%	0.19	39%	0.392	C	S	.	.	P	Polyproline II helix	trans	-71.8	140.8	171.1	0	0	0	0	0	111.1	V748	A725-V748 PolarHBondContact N-O 2.85Å
726	V	88.1	Confident	90.8	Very high	90 Å²	90	77.4 Å²	77.4	55%	0.545	40%	0.398	S	S	.	.	B	Isolated β-bridge	trans	-139.3	141.6	-175.3	-175.2	0	0	0	0	108.8	G728 K729	V726-G728 VanDerWaalsContact C-N 3.26Å; V726-G728 PolarHBondContact O-N 2.65Å; V726-K729 PolarHBondContact N-O 2.65Å; V726-K729 WeakPolarHBondContact O-CB 3.46Å; V726-K729 PolarHBondContact O-N 3.39Å
727	D	82.4	Confident	90.7	Very high	141 Å²	141	78.9 Å²	78.9	75%	0.754	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.2	41.3	179.2	-54.4	-27.4	0	0	0	114.2	K729	D727-K729 PolarHBondContact O-N 3.47Å
728	G	81.2	Confident	90.5	Very high	32 Å²	32	79.3 Å²	79.3	33%	0.33	41%	0.409	S	S	.	.	T	Hydrogen-bonded Turn	trans	67.5	14.4	-178.8	0	0	0	0	0	114.8	V726 C793	V726-G728 VanDerWaalsContact C-N 3.26Å; V726-G728 PolarHBondContact O-N 2.65Å; G728-C793 PolarHBondContact O-SG 3.39Å
729	K	88.6	Confident	90.4	Very high	130 Å²	130	78.8 Å²	78.8	57%	0.565	40%	0.404	S	S	*	.	B	Isolated β-bridge	trans	-112.2	136.3	-175.9	-69.3	163.2	-172	163.7	0	112.7	V726 D727 D768	V726-K729 PolarHBondContact N-O 2.65Å; V726-K729 WeakPolarHBondContact O-CB 3.46Å; V726-K729 PolarHBondContact O-N 3.39Å; D727-K729 PolarHBondContact O-N 3.47Å; K729-D768 WeakPolarHBondContact CA-OD2 3.41Å
730	V	91.9	Very high	90.4	Very high	6 Å²	6	72.4 Å²	72.4	4%	0.036	38%	0.375	C	S	.	.			trans	-77.6	124.7	177.6	-176.1	0	0	0	0	109.6	R732 V738 D768 A770 I791	V730-R732 PolarHBondContact O-N 3.25Å; V730-R732 PolarHBondContact O-NH1 3.18Å; V730-V738 HydrophobicContact CG1-CG2 3.74Å; V730-D768 PolarHBondContact N-OD2 2.94Å; V730-A770 HydrophobicContact CB-CB 4.19Å; V730-A770 HydrophobicContact CG1-CB 3.86Å; V730-I791 HydrophobicContact CG1-CB 3.98Å; V730-I791 HydrophobicContact CG1-CG2 3.51Å; V730-I791 HydrophobicContact CG2-CG2 4.33Å
731	P	92.2	Very high	90.3	Very high	34 Å²	34	71.4 Å²	71.4	22%	0.221	37%	0.372	C	S	.	.			trans	-63.1	127.1	173.5	-21.8	34	0	0	0	111.2	P723 I724 V738 P747	P723-P731 HydrophobicContact CB-CB 3.72Å; P723-P731 HydrophobicContact CB-CG 3.93Å; P723-P731 HydrophobicContact CG-CB 3.59Å; P723-P731 HydrophobicContact CG-CG 4.03Å; I724-P731 VanDerWaalsContact O-CG 3.28Å; I724-P731 WeakPolarHBondContact O-CG 3.48Å; P731-V738 WeakPolarHBondContact O-CG2 3.47Å; P731-P747 HydrophobicContact CG-CB 4.25Å
732	R	91.9	Very high	90.3	Very high	104 Å²	104	68 Å²	68	39%	0.392	35%	0.354	S	S	.	.			trans	-116.3	156.8	-175.2	-72.6	167.6	170.9	98.6	-10.6	111.9	V730 G736 D768 A769 A770	V730-R732 PolarHBondContact O-N 3.25Å; V730-R732 PolarHBondContact O-NH1 3.18Å; R732-G736 WeakPolarHBondContact CD-O 3.34Å; R732-G736 WeakPolarHBondContact CG-O 3.44Å; R732-G736 PolarHBondContact NE-O 2.97Å; R732-D768 IonicContact CZ-OD1 2.71Å; R732-D768 VanDerWaalsContact CZ-OD1 3.31Å; R732-D768 IonicContact CZ-OD2 3.05Å; R732-D768 VanDerWaalsContact NH1-CG 3.3Å; R732-D768 IonicContact NH1-OD1 2.9Å; R732-D768 PolarHBondContact NH1-OD1 3.34Å; R732-D768 IonicContact NH1-OD2 3.77Å; R732-D768 PolarHBondContact NH1-OD2 3.19Å; R732-D768 IonicContact NH2-OD1 3.85Å; R732-D768 PolarHBondContact NH2-OD1 3.47Å; R732-D768 IonicContact NH2-OD2 3.21Å; R732-A769 PolarHBondContact NH2-O 3.09Å; R732-A770 HydrophobicContact CG-CB 4Å
733	N	91.1	Very high	90.3	Very high	33 Å²	33	70.2 Å²	70.2	18%	0.176	38%	0.376	C	S	.	.			trans	-79.9	175.9	164.3	67.5	18.3	0	0	0	111.7	Y735 G736 N737 Y739	N733-Y735 PolarHBondContact O-N 3.18Å; N733-Y735 WeakPolarHBondContact OD1-CA 3.34Å; N733-Y735 WeakPolarHBondContact OD1-CB 3.45Å; N733-Y735 PolarHBondContact OD1-N 2.85Å; N733-G736 PolarHBondContact O-N 3.47Å; N733-G736 PolarHBondContact OD1-N 3.13Å; N733-N737 PolarHBondContact N-O 2.9Å; N733-N737 PolarHBondContact OD1-N 2.92Å; N733-N737 PolarHBondContact OD1-O 3.36Å; N733-N737 VanDerWaalsContact OD1-O 3.08Å; N733-Y739 HydrophobicContact CB-CD2 4.41Å; N733-Y739 HydrophobicContact CB-CE2 4.15Å; N733-Y739 WeakPolarHBondContact ND2-CD2 3.41Å; N733-Y739 WeakPolarHBondContact ND2-CE2 3.26Å
734	D	88.8	Confident	90.3	Very high	168 Å²	168	71.5 Å²	71.5	90%	0.898	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.7	-17.5	-179.9	-49	-51.3	0	0	0	114.1
735	Y	88.1	Confident	90.4	Very high	174 Å²	174	66 Å²	66	68%	0.682	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.5	5.9	176.4	-57.8	-75.8	0	0	0	113.5	N733 N737	N733-Y735 PolarHBondContact O-N 3.18Å; N733-Y735 WeakPolarHBondContact OD1-CA 3.34Å; N733-Y735 WeakPolarHBondContact OD1-CB 3.45Å; N733-Y735 PolarHBondContact OD1-N 2.85Å; Y735-N737 VanDerWaalsContact C-N 3.32Å; Y735-N737 PolarHBondContact O-N 3.24Å; Y735-N737 PolarHBondContact O-ND2 2.95Å; Y735-N737 PolarHBondContact O-OD1 2.97Å
736	G	90.1	Very high	90.5	Very high	31 Å²	31	67.1 Å²	67.1	32%	0.32	36%	0.359	S	S	.	.	S	Bend	trans	78.5	9.7	-179.9	0	0	0	0	0	115.2	R732 N733	R732-G736 WeakPolarHBondContact CD-O 3.34Å; R732-G736 WeakPolarHBondContact CG-O 3.44Å; R732-G736 PolarHBondContact NE-O 2.97Å; N733-G736 PolarHBondContact O-N 3.47Å; N733-G736 PolarHBondContact OD1-N 3.13Å
737	N	93.1	Very high	90.8	Very high	43 Å²	43	63 Å²	63	23%	0.23	33%	0.334	C	S	.	.	S	Bend	trans	-119.2	172.7	-169.6	-53.6	-37.8	0	0	0	111.3	N733 Y735 P771 V773	N733-N737 PolarHBondContact N-O 2.9Å; N733-N737 PolarHBondContact OD1-N 2.92Å; N733-N737 PolarHBondContact OD1-O 3.36Å; N733-N737 VanDerWaalsContact OD1-O 3.08Å; Y735-N737 VanDerWaalsContact C-N 3.32Å; Y735-N737 PolarHBondContact O-N 3.24Å; Y735-N737 PolarHBondContact O-ND2 2.95Å; Y735-N737 PolarHBondContact O-OD1 2.97Å; N737-P771 HydrophobicContact CB-CG 4.16Å; N737-P771 WeakPolarHBondContact OD1-CG 3.05Å; N737-V773 HydrophobicContact CB-CG2 3.98Å
738	V	93	Very high	91.3	Very high	10 Å²	10	60 Å²	60	6%	0.061	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	133	171	-173.7	0	0	0	0	109.9	V730 P731 P747 A770 P771 V773 I791	V730-V738 HydrophobicContact CG1-CG2 3.74Å; P731-V738 WeakPolarHBondContact O-CG2 3.47Å; V738-P747 HydrophobicContact CG1-CG 4.17Å; V738-A770 HydrophobicContact CG2-CB 3.76Å; V738-P771 PolarHBondContact N-O 2.88Å; V738-P771 VanDerWaalsContact N-O 3.07Å; V738-V773 PolarHBondContact O-N 3.01Å; V738-I791 HydrophobicContact CB-CG1 3.88Å; V738-I791 HydrophobicContact CG1-CG1 4.05Å; V738-I791 HydrophobicContact CG2-CB 4.15Å; V738-I791 HydrophobicContact CG2-CG1 3.98Å
739	Y	93.4	Very high	91.7	Very high	64 Å²	64	60.1 Å²	60.1	25%	0.251	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	117.3	171.2	-70.6	-50.9	0	0	0	110.3	L671 N733 F741 V773 F776	L671-Y739 HydrophobicContact CD2-CD2 4.26Å; N733-Y739 HydrophobicContact CB-CD2 4.41Å; N733-Y739 HydrophobicContact CB-CE2 4.15Å; N733-Y739 WeakPolarHBondContact ND2-CD2 3.41Å; N733-Y739 WeakPolarHBondContact ND2-CE2 3.26Å; Y739-F741 HydrophobicContact CD1-CE1 4.44Å; Y739-F741 AromaticContact CD1-CE2 3.94Å; Y739-F741 HydrophobicContact CD1-CE2 3.94Å; Y739-F741 AromaticContact CD1-CZ 3.54Å; Y739-F741 HydrophobicContact CD1-CZ 3.54Å; Y739-F741 HydrophobicContact CE1-CZ 4.21Å; Y739-F741 AromaticContact CG-CE2 3.86Å; Y739-F741 HydrophobicContact CG-CE2 3.86Å; Y739-F741 AromaticContact CG-CZ 3.98Å; Y739-F741 HydrophobicContact CG-CZ 3.98Å; Y739-V773 HydrophobicContact CD1-CB 4.14Å; Y739-V773 HydrophobicContact CD1-CG1 4.12Å; Y739-V773 HydrophobicContact CE1-CG1 4.31Å; Y739-F776 HydrophobicContact CE1-CE2 4.45Å; Y739-F776 HydrophobicContact CE1-CZ 4.05Å
740	L	93.7	Very high	92	Very high	11 Å²	11	54.5 Å²	54.5	6%	0.058	30%	0.299	C	S	.	.			trans	-127.7	64.2	-175.4	-172.1	73.2	0	0	0	110.6	M745 I746 H752 A772 V773 T774 I791	L740-M745 HydrophobicContact CD1-CB 4.36Å; L740-I746 HydrophobicContact CD1-CB 4.4Å; L740-I746 HydrophobicContact CD1-CG1 3.44Å; L740-I746 VanDerWaalsContact CD1-CG1 3.44Å; L740-H752 HydrophobicContact CD2-CB 4.38Å; L740-A772 HydrophobicContact CB-CB 4.22Å; L740-A772 HydrophobicContact CD2-CB 3.91Å; L740-V773 PolarHBondContact N-O 2.88Å; L740-T774 HydrophobicContact CB-CG2 4.33Å; L740-T774 HydrophobicContact CD2-CG2 4.29Å; L740-T774 WeakPolarHBondContact O-CA 3.5Å; L740-I791 HydrophobicContact CD2-CD1 4.12Å
741	F	92.6	Very high	92.1	Very high	42 Å²	42	55.8 Å²	55.8	18%	0.184	31%	0.307	C	S	.	.	S	Bend	trans	-77.8	-26	179.4	-51.7	-64.5	0	0	0	112.7	L671 K672 Y739 M745 F776	L671-F741 HydrophobicContact CG-CE2 4.5Å; K672-F741 HydrophobicContact CB-CD2 4.26Å; K672-F741 HydrophobicContact CB-CG 4.23Å; K672-F741 HydrophobicContact CG-CD1 4.26Å; K672-F741 HydrophobicContact CG-CD2 4.05Å; K672-F741 HydrophobicContact CG-CE1 4.24Å; K672-F741 HydrophobicContact CG-CE2 3.99Å; K672-F741 HydrophobicContact CG-CG 4.17Å; K672-F741 HydrophobicContact CG-CZ 4.1Å; K672-F741 VanDerWaalsContact O-CB 3.3Å; K672-F741 WeakPolarHBondContact O-CB 3.43Å; Y739-F741 HydrophobicContact CD1-CE1 4.44Å; Y739-F741 AromaticContact CD1-CE2 3.94Å; Y739-F741 HydrophobicContact CD1-CE2 3.94Å; Y739-F741 AromaticContact CD1-CZ 3.54Å; Y739-F741 HydrophobicContact CD1-CZ 3.54Å; Y739-F741 HydrophobicContact CE1-CZ 4.21Å; Y739-F741 AromaticContact CG-CE2 3.86Å; Y739-F741 HydrophobicContact CG-CE2 3.86Å; Y739-F741 AromaticContact CG-CZ 3.98Å; Y739-F741 HydrophobicContact CG-CZ 3.98Å; F741-M745 HydrophobicContact CB-SD 3.89Å; F741-M745 HydrophobicContact CD2-CE 4Å; F741-M745 HydrophobicContact CD2-SD 3.88Å; F741-M745 HydrophobicContact CG-SD 4.34Å; F741-F776 HydrophobicContact CE1-CD2 4.43Å; F741-F776 HydrophobicContact CE1-CE2 4.08Å; F741-F776 HydrophobicContact CZ-CE2 4.03Å
742	K	92.3	Very high	92.2	Very high	90 Å²	90	56.1 Å²	56.1	39%	0.391	31%	0.305	S	S	.	.	S	Bend	trans	-136.6	155.4	172.4	-67.1	-176.1	178.5	173	0	110.2	E673 A674 C744 M745	E673-K742 WeakPolarHBondContact O-CE 3.46Å; E673-K742 PolarHBondContact O-NZ 3.47Å; A674-K742 HydrophobicContact CB-CB 4.17Å; A674-K742 HydrophobicContact CB-CD 3.9Å; A674-K742 HydrophobicContact CB-CG 4.38Å; K742-C744 PolarHBondContact O-N 3.22Å; K742-M745 HydrophobicContact CB-CG 4.43Å; K742-M745 WeakPolarHBondContact O-CB 3.37Å; K742-M745 PolarHBondContact O-N 3.3Å
743	A	90.9	Very high	92.3	Very high	82 Å²	82	51.4 Å²	51.4	68%	0.678	29%	0.288	S	S	*	.	G	3₁₀ helix	trans	-62.3	-23.1	-179.3	0	0	0	0	0	114.2	M745 I746	A743-M745 PolarHBondContact O-N 3.4Å; A743-I746 WeakPolarHBondContact O-CG1 3.47Å
744	C	91.4	Very high	92.3	Very high	77 Å²	77	57.8 Å²	57.8	52%	0.52	31%	0.309	S	S	.	.	G	3₁₀ helix	trans	-73.1	-5.2	172.7	52.6	0	0	0	0	114.4	A674 K742	A674-C744 VanDerWaalsContact CB-SG 3.59Å; K742-C744 PolarHBondContact O-N 3.22Å
745	M	92.8	Very high	92.4	Very high	0 Å²	0	51.5 Å²	51.5	0%	0	28%	0.275	C	S	.	.	G	3₁₀ helix	trans	-92.3	2.9	177.2	-54	-176.4	72	0	0	113.5	L671 A674 Y720 L740 F741 K742 A743	L671-M745 HydrophobicContact CD1-CE 3.74Å; L671-M745 HydrophobicContact CG-CE 4.16Å; L671-M745 WeakPolarHBondContact O-CE 3.4Å; A674-M745 HydrophobicContact CB-CG 3.6Å; A674-M745 HydrophobicContact CB-SD 3.86Å; Y720-M745 HydrophobicContact CD1-CB 4.17Å; Y720-M745 HydrophobicContact CD1-CE 3.96Å; Y720-M745 HydrophobicContact CD1-CG 3.86Å; Y720-M745 HydrophobicContact CE1-CB 4.01Å; Y720-M745 HydrophobicContact CE1-CE 3.9Å; Y720-M745 HydrophobicContact CE1-CG 4.16Å; Y720-M745 HydrophobicContact CG-CE 4.4Å; L740-M745 HydrophobicContact CD1-CB 4.36Å; F741-M745 HydrophobicContact CB-SD 3.89Å; F741-M745 HydrophobicContact CD2-CE 4Å; F741-M745 HydrophobicContact CD2-SD 3.88Å; F741-M745 HydrophobicContact CG-SD 4.34Å; K742-M745 HydrophobicContact CB-CG 4.43Å; K742-M745 WeakPolarHBondContact O-CB 3.37Å; K742-M745 PolarHBondContact O-N 3.3Å; A743-M745 PolarHBondContact O-N 3.4Å
746	I	93.6	Very high	92.4	Very high	47 Å²	47	47 Å²	47	24%	0.241	27%	0.268	C	S	.	.	S	Bend	trans	-64.7	128.2	173.7	-59.8	172.9	0	0	0	108.4	P722 L740 A743 C750 H752	P722-I746 VanDerWaalsContact CB-O 3.25Å; P722-I746 WeakPolarHBondContact CB-O 3.32Å; L740-I746 HydrophobicContact CD1-CB 4.4Å; L740-I746 HydrophobicContact CD1-CG1 3.44Å; L740-I746 VanDerWaalsContact CD1-CG1 3.44Å; A743-I746 WeakPolarHBondContact O-CG1 3.47Å; I746-C750 HydrophobicContact CG2-CB 4.26Å; I746-C750 WeakPolarHBondContact CG2-O 3.47Å; I746-H752 HydrophobicContact CD1-CB 4.09Å
747	P	94	Very high	92.1	Very high	3 Å²	3	50 Å²	50	2%	0.019	28%	0.276	C	S	.	.	P	Polyproline II helix	trans	-54.6	141.3	173.9	-26.9	35.7	0	0	0	112.4	P723 P731 V738 G749 C750 I791	P723-P747 HydrophobicContact CG-CB 4.41Å; P723-P747 HydrophobicContact CG-CG 4.41Å; P723-P747 CarbonylContact O-C 3.54Å; P723-P747 WeakPolarHBondContact O-CA 3.47Å; P723-P747 VanDerWaalsContact O-CB 3.31Å; P723-P747 WeakPolarHBondContact O-CB 3.45Å; P731-P747 HydrophobicContact CG-CB 4.25Å; V738-P747 HydrophobicContact CG1-CG 4.17Å; P747-G749 PolarHBondContact O-N 3.37Å; P747-C750 HydrophobicContact CB-CB 4.09Å; P747-C750 WeakPolarHBondContact O-CB 3.16Å; P747-C750 PolarHBondContact O-N 2.7Å; P747-I791 HydrophobicContact CG-CG2 4.29Å
748	V	92.4	Very high	91.9	Very high	78 Å²	78	48 Å²	48	47%	0.473	27%	0.265	S	S	.	.	B	Isolated β-bridge	trans	-68	126.6	-179.2	-173.3	0	0	0	0	109.1	P722 P723 I724 A725	P722-V748 HydrophobicContact CG-CG2 4.04Å; P723-V748 PolarHBondContact O-N 3.29Å; I724-V748 HydrophobicContact CB-CB 4.42Å; I724-V748 HydrophobicContact CG1-CB 4.16Å; I724-V748 HydrophobicContact CG1-CG2 4.39Å; I724-V748 HydrophobicContact CG2-CB 4.3Å; A725-V748 PolarHBondContact N-O 2.85Å
749	G	90.9	Very high	91.6	Very high	35 Å²	35	51.5 Å²	51.5	36%	0.361	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	87.6	9.5	-171	0	0	0	0	0	114.4	P747 E794	P747-G749 PolarHBondContact O-N 3.37Å; G749-E794 PolarHBondContact O-N 2.88Å
750	C	93.5	Very high	91.4	Very high	12 Å²	12	56 Å²	56	8%	0.081	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	159	174.2	-68.1	0	0	0	0	113.4	I746 P747 I791 V792	I746-C750 HydrophobicContact CG2-CB 4.26Å; I746-C750 WeakPolarHBondContact CG2-O 3.47Å; P747-C750 HydrophobicContact CB-CB 4.09Å; P747-C750 WeakPolarHBondContact O-CB 3.16Å; P747-C750 PolarHBondContact O-N 2.7Å; C750-I791 HydrophobicContact CB-CG2 3.46Å; C750-I791 VanDerWaalsContact CB-CG2 3.46Å; C750-V792 CarbonylContact C-O 3.59Å; C750-V792 WeakPolarHBondContact CA-O 3.41Å; C750-V792 WeakPolarHBondContact CB-O 3.49Å
751	V	93.5	Very high	91.3	Very high	33 Å²	33	55.8 Å²	55.8	20%	0.2	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	148.1	177.4	-174.2	0	0	0	0	111	I791 V792 E794 E797	V751-I791 WeakPolarHBondContact O-CA 3.36Å; V751-V792 PolarHBondContact N-O 2.92Å; V751-V792 PolarHBondContact O-N 2.97Å; V751-V792 VanDerWaalsContact O-N 3.11Å; V751-E794 HydrophobicContact CG2-CB 4.04Å; V751-E794 HydrophobicContact CG2-CG 4Å; V751-E797 VanDerWaalsContact CG1-OE1 3.3Å; V751-E797 WeakPolarHBondContact CG1-OE1 3.16Å
752	H	95.1	Very high	91.2	Very high	41 Å²	41	53.9 Å²	53.9	19%	0.19	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	106.8	179.1	-178.9	-142.8	0	0	0	112.4	L740 I746 R754 D788 I791	L740-H752 HydrophobicContact CD2-CB 4.38Å; I746-H752 HydrophobicContact CD1-CB 4.09Å; H752-R754 VanDerWaalsContact CE1-CG 3.45Å; H752-R754 WeakPolarHBondContact CE1-CG 3.18Å; H752-D788 PolarHBondContact NE2-O 3.27Å; H752-I791 HydrophobicContact CB-CD1 3.97Å
753	L	93.3	Very high	91.1	Very high	5 Å²	5	58.1 Å²	58.1	3%	0.026	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	104.1	179.4	-69.4	-175.1	0	0	0	112.4	L755 L758 G789 Y790 V792 E797 R801	L753-L755 PolarHBondContact O-N 2.88Å; L753-L758 HydrophobicContact CB-CD2 3.77Å; L753-L758 HydrophobicContact CD1-CD2 3.66Å; L753-L758 HydrophobicContact CG-CD2 4.38Å; L753-G789 VanDerWaalsContact O-CA 3.31Å; L753-G789 WeakPolarHBondContact O-CA 3.35Å; L753-Y790 PolarHBondContact N-O 3.47Å; L753-Y790 PolarHBondContact O-N 2.96Å; L753-V792 HydrophobicContact CD1-CG1 4.22Å; L753-V792 HydrophobicContact CD1-CG2 3.56Å; L753-V792 HydrophobicContact CG-CG2 3.93Å; L753-E797 HydrophobicContact CD2-CG 4.3Å; L753-E797 WeakPolarHBondContact CD2-OE1 3.35Å; L753-R801 HydrophobicContact CD1-CG 4.43Å; L753-R801 HydrophobicContact CD2-CG 4.25Å
754	R	92.8	Very high	91.1	Very high	168 Å²	168	60.3 Å²	60.3	63%	0.634	30%	0.301	S	S	*	.			trans	-81.9	59.2	173.1	-66	-176	-71.2	-167.6	-4.4	112.4	H752 D788	H752-R754 VanDerWaalsContact CE1-CG 3.45Å; H752-R754 WeakPolarHBondContact CE1-CG 3.18Å; R754-D788 VanDerWaalsContact CD-CG 3.5Å; R754-D788 WeakPolarHBondContact CD-OD1 3.46Å; R754-D788 WeakPolarHBondContact CD-OD2 3.47Å; R754-D788 WeakPolarHBondContact CG-OD1 3.49Å; R754-D788 IonicContact NH1-OD2 3.8Å
755	L	89.8	Confident	91	Very high	35 Å²	35	60.2 Å²	60.2	18%	0.183	30%	0.296	C	S	.	.			trans	-111.9	123.3	178.6	-63.2	178.9	0	0	0	110.6	L753 L758 R801 W804	L753-L755 PolarHBondContact O-N 2.88Å; L755-L758 HydrophobicContact CB-CB 4.23Å; L755-L758 HydrophobicContact CB-CD1 4.33Å; L755-L758 HydrophobicContact CB-CD2 4.39Å; L755-L758 HydrophobicContact CD1-CD1 4.09Å; L755-L758 HydrophobicContact CD1-CD2 4.47Å; L755-R801 HydrophobicContact CD1-CG 4.29Å; L755-W804 HydrophobicContact CB-CD2 4.29Å; L755-W804 HydrophobicContact CB-CG 4.43Å; L755-W804 HydrophobicContact CB-CZ2 4.45Å; L755-W804 HydrophobicContact CD1-CB 4.39Å; L755-W804 HydrophobicContact CD1-CD2 4.07Å; L755-W804 HydrophobicContact CD1-CE3 4.28Å; L755-W804 HydrophobicContact CD1-CG 4.11Å; L755-W804 HydrophobicContact CD2-CD2 4.22Å; L755-W804 HydrophobicContact CD2-CE3 4.09Å; L755-W804 HydrophobicContact CD2-CH2 4.05Å; L755-W804 HydrophobicContact CD2-CZ2 4.17Å; L755-W804 HydrophobicContact CD2-CZ3 4.01Å; L755-W804 HydrophobicContact CG-CD2 4.43Å
756	P	87.8	Confident	90.9	Very high	81 Å²	81	67.8 Å²	67.8	53%	0.526	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67	141.4	-178.8	27.3	-35.1	0	0	0	111.6	L758 W804	P756-L758 PolarHBondContact O-N 3.13Å; P756-W804 HydrophobicContact CG-CZ2 3.96Å; P756-W804 PolarHBondContact O-NE1 3.11Å
757	N	84.8	Confident	90.7	Very high	93 Å²	93	67.7 Å²	67.7	50%	0.497	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	60.2	16	-179.5	-60.5	-43.5	0	0	0	116.1	H759 R760	N757-H759 PolarHBondContact O-N 2.86Å; N757-H759 VanDerWaalsContact O-N 3.13Å; N757-R760 WeakPolarHBondContact O-CB 3.34Å; N757-R760 PolarHBondContact O-N 3.25Å
758	L	88.9	Confident	90.6	Very high	0 Å²	0	69.4 Å²	69.4	0%	0	35%	0.345	C	S	.	.	H	α-helix	trans	-56.3	-33.1	-176.5	-168.8	67.3	0	0	0	113.6	L753 L755 P756 R760 V761 A762 Y790 V792 L800 W804	L753-L758 HydrophobicContact CB-CD2 3.77Å; L753-L758 HydrophobicContact CD1-CD2 3.66Å; L753-L758 HydrophobicContact CG-CD2 4.38Å; L755-L758 HydrophobicContact CB-CB 4.23Å; L755-L758 HydrophobicContact CB-CD1 4.33Å; L755-L758 HydrophobicContact CB-CD2 4.39Å; L755-L758 HydrophobicContact CD1-CD1 4.09Å; L755-L758 HydrophobicContact CD1-CD2 4.47Å; P756-L758 PolarHBondContact O-N 3.13Å; L758-R760 PolarHBondContact O-N 3.36Å; L758-R760 VanDerWaalsContact O-N 3.1Å; L758-V761 HydrophobicContact CD1-CB 4.38Å; L758-V761 WeakPolarHBondContact O-CA 3.41Å; L758-V761 WeakPolarHBondContact O-CB 3.43Å; L758-V761 PolarHBondContact O-N 2.9Å; L758-A762 PolarHBondContact O-N 2.86Å; L758-Y790 HydrophobicContact CB-CD2 3.62Å; L758-Y790 HydrophobicContact CB-CE2 3.94Å; L758-Y790 HydrophobicContact CB-CG 4.39Å; L758-Y790 HydrophobicContact CD2-CD2 4.45Å; L758-V792 HydrophobicContact CD2-CG1 4.29Å; L758-L800 HydrophobicContact CD1-CB 4.43Å; L758-W804 HydrophobicContact CD1-CB 3.76Å; L758-W804 HydrophobicContact CD1-CG 3.95Å
759	H	87	Confident	90.6	Very high	85 Å²	85	66.6 Å²	66.6	39%	0.394	33%	0.33	S	S	.	.	H	α-helix	trans	-54.1	-30.5	174.7	76	-90.2	0	0	0	113.8	N757 V761 K763 Y790	N757-H759 PolarHBondContact O-N 2.86Å; N757-H759 VanDerWaalsContact O-N 3.13Å; H759-V761 VanDerWaalsContact C-N 3.31Å; H759-K763 VanDerWaalsContact O-CB 3.27Å; H759-K763 WeakPolarHBondContact O-CB 3.49Å; H759-K763 PolarHBondContact O-N 2.7Å; H759-Y790 HydrophobicContact CB-CD1 4.45Å; H759-Y790 HydrophobicContact CB-CE1 3.75Å; H759-Y790 AromaticContact ND1-CZ 3.71Å; H759-Y790 PolarHBondContact ND1-OH 3.39Å
760	R	88.3	Confident	90.7	Very high	158 Å²	158	64.9 Å²	64.9	60%	0.596	31%	0.312	S	S	*	.	H	α-helix	trans	-74.4	-24.3	177.4	-56.3	-170.7	74.8	177.9	5.9	112.4	N757 L758 K764	N757-R760 WeakPolarHBondContact O-CB 3.34Å; N757-R760 PolarHBondContact O-N 3.25Å; L758-R760 PolarHBondContact O-N 3.36Å; L758-R760 VanDerWaalsContact O-N 3.1Å; R760-K764 WeakPolarHBondContact O-CG 3.31Å
761	V	91	Very high	90.8	Very high	7 Å²	7	65.8 Å²	65.8	4%	0.042	32%	0.318	C	S	.	.	H	α-helix	trans	-83.7	-48.5	175.9	-176.3	0	0	0	0	109.1	L758 H759 K763 K764 L765 A803 W804 E807	L758-V761 HydrophobicContact CD1-CB 4.38Å; L758-V761 WeakPolarHBondContact O-CA 3.41Å; L758-V761 WeakPolarHBondContact O-CB 3.43Å; L758-V761 PolarHBondContact O-N 2.9Å; H759-V761 VanDerWaalsContact C-N 3.31Å; V761-K763 PolarHBondContact O-N 3.42Å; V761-K764 WeakPolarHBondContact O-CB 3.3Å; V761-K764 PolarHBondContact O-N 3.18Å; V761-L765 HydrophobicContact CG1-CD1 4.4Å; V761-L765 PolarHBondContact O-N 3.49Å; V761-A803 HydrophobicContact CG1-CB 3.59Å; V761-W804 HydrophobicContact CG2-CB 4.33Å; V761-E807 HydrophobicContact CG2-CB 4.01Å; V761-E807 HydrophobicContact CG2-CG 4.18Å
762	A	91.1	Very high	90.8	Very high	2 Å²	2	64.2 Å²	64.2	2%	0.017	31%	0.308	C	S	.	.	H	α-helix	trans	-54.3	-48.9	175.4	0	0	0	0	0	111.8	L758 K764 L765 D766 L767 A769 L800	L758-A762 PolarHBondContact O-N 2.86Å; A762-K764 PolarHBondContact O-N 3.12Å; A762-L765 CarbonylContact O-C 3.49Å; A762-L765 PolarHBondContact O-N 3.26Å; A762-D766 PolarHBondContact O-N 2.99Å; A762-L767 PolarHBondContact O-N 2.97Å; A762-L767 VanDerWaalsContact O-N 3.15Å; A762-A769 HydrophobicContact CB-CB 3.82Å; A762-L800 HydrophobicContact CB-CD2 3.8Å
763	K	90.8	Very high	90.8	Very high	179 Å²	179	62.3 Å²	62.3	78%	0.778	30%	0.3	S	S	*	.	H	α-helix	trans	-66.5	-14	176.3	-172.6	165	-177.8	172.7	0	115	H759 V761	H759-K763 VanDerWaalsContact O-CB 3.27Å; H759-K763 WeakPolarHBondContact O-CB 3.49Å; H759-K763 PolarHBondContact O-N 2.7Å; V761-K763 PolarHBondContact O-N 3.42Å
764	K	90.4	Very high	90.8	Very high	127 Å²	127	64.3 Å²	64.3	55%	0.552	31%	0.312	S	S	*	.	H	α-helix	trans	-85.5	-20.6	169.9	-76.7	-179.1	-169.6	-169	0	113.2	R760 V761 A762 E807	R760-K764 WeakPolarHBondContact O-CG 3.31Å; V761-K764 WeakPolarHBondContact O-CB 3.3Å; V761-K764 PolarHBondContact O-N 3.18Å; A762-K764 PolarHBondContact O-N 3.12Å; K764-E807 IonicContact NZ-OE1 2.65Å; K764-E807 PolarHBondContact NZ-OE1 3.37Å; K764-E807 IonicContact NZ-OE2 3.99Å; K764-E807 PolarHBondContact NZ-OE2 2.96Å
765	L	89.4	Confident	90.8	Very high	76 Å²	76	57.2 Å²	57.2	40%	0.398	29%	0.291	S	S	.	.	H	α-helix	trans	-105.3	-1.8	-178.7	-62.3	177.5	0	0	0	112.8	V761 A762 L767 V799 L800 A803	V761-L765 HydrophobicContact CG1-CD1 4.4Å; V761-L765 PolarHBondContact O-N 3.49Å; A762-L765 CarbonylContact O-C 3.49Å; A762-L765 PolarHBondContact O-N 3.26Å; L765-L767 HydrophobicContact CB-CD1 3.96Å; L765-L767 HydrophobicContact CB-CG 3.79Å; L765-L767 HydrophobicContact CD1-CD1 4.09Å; L765-L767 PolarHBondContact O-N 2.87Å; L765-V799 HydrophobicContact CD1-CG1 4.13Å; L765-L800 HydrophobicContact CD1-CD2 4.31Å; L765-A803 HydrophobicContact CD1-CB 3.61Å
766	D	89.9	Confident	90.8	Very high	159 Å²	159	59.3 Å²	59.3	85%	0.85	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.2	30.5	-173.3	-143.7	31.8	0	0	0	114	A762	A762-D766 PolarHBondContact O-N 2.99Å
767	L	90.8	Very high	90.9	Very high	45 Å²	45	59.3 Å²	59.3	24%	0.236	30%	0.295	C	S	.	.			trans	-96.1	146.8	179	-57.5	-178.8	0	0	0	111.5	A762 L765 D796 V799 L800	A762-L767 PolarHBondContact O-N 2.97Å; A762-L767 VanDerWaalsContact O-N 3.15Å; L765-L767 HydrophobicContact CB-CD1 3.96Å; L765-L767 HydrophobicContact CB-CG 3.79Å; L765-L767 HydrophobicContact CD1-CD1 4.09Å; L765-L767 PolarHBondContact O-N 2.87Å; L767-D796 HydrophobicContact CD1-CB 4.3Å; L767-D796 WeakPolarHBondContact CD2-OD1 3.25Å; L767-V799 HydrophobicContact CD1-CB 4.38Å; L767-V799 HydrophobicContact CD1-CG1 4.07Å; L767-L800 HydrophobicContact CB-CD2 4.2Å; L767-L800 HydrophobicContact CD1-CD2 3.87Å; L767-L800 HydrophobicContact CD1-CG 3.88Å
768	D	91.4	Very high	90.8	Very high	38 Å²	38	63.1 Å²	63.1	20%	0.203	30%	0.303	C	S	.	.			trans	-83.8	126.3	-172.5	-163.2	40.1	0	0	0	112.9	K729 V730 R732	K729-D768 WeakPolarHBondContact CA-OD2 3.41Å; V730-D768 PolarHBondContact N-OD2 2.94Å; R732-D768 IonicContact CZ-OD1 2.71Å; R732-D768 VanDerWaalsContact CZ-OD1 3.31Å; R732-D768 IonicContact CZ-OD2 3.05Å; R732-D768 VanDerWaalsContact NH1-CG 3.3Å; R732-D768 IonicContact NH1-OD1 2.9Å; R732-D768 PolarHBondContact NH1-OD1 3.34Å; R732-D768 IonicContact NH1-OD2 3.77Å; R732-D768 PolarHBondContact NH1-OD2 3.19Å; R732-D768 IonicContact NH2-OD1 3.85Å; R732-D768 PolarHBondContact NH2-OD1 3.47Å; R732-D768 IonicContact NH2-OD2 3.21Å
769	A	92.3	Very high	90.3	Very high	19 Å²	19	67.8 Å²	67.8	16%	0.157	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140	133.1	177.5	0	0	0	0	0	110.9	R732 A762 V792	R732-A769 PolarHBondContact NH2-O 3.09Å; A762-A769 HydrophobicContact CB-CB 3.82Å; A769-V792 HydrophobicContact CB-CG1 4.05Å
770	A	93.5	Very high	89.7	Confident	0 Å²	0	67.4 Å²	67.4	0%	0	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	136.3	175.8	0	0	0	0	0	109.9	V730 R732 V738 Y790 I791	V730-A770 HydrophobicContact CB-CB 4.19Å; V730-A770 HydrophobicContact CG1-CB 3.86Å; R732-A770 HydrophobicContact CG-CB 4Å; V738-A770 HydrophobicContact CG2-CB 3.76Å; A770-Y790 CarbonylContact O-C 3.53Å; A770-Y790 VanDerWaalsContact O-CA 3.3Å; A770-Y790 WeakPolarHBondContact O-CA 3.45Å; A770-I791 PolarHBondContact N-O 3.41Å; A770-I791 PolarHBondContact O-N 3.04Å
771	P	94.2	Very high	89.1	Confident	30 Å²	30	63 Å²	63	20%	0.195	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	138.6	178.2	31.2	-35.7	0	0	0	110.7	N737 V738 T787 Y790	N737-P771 HydrophobicContact CB-CG 4.16Å; N737-P771 WeakPolarHBondContact OD1-CG 3.05Å; V738-P771 PolarHBondContact N-O 2.88Å; V738-P771 VanDerWaalsContact N-O 3.07Å; P771-T787 HydrophobicContact CB-CG2 4.08Å; P771-Y790 HydrophobicContact CB-CD1 4.04Å; P771-Y790 HydrophobicContact CB-CE1 3.9Å
772	A	94.9	Very high	88.5	Confident	0 Å²	0	70.8 Å²	70.8	0%	0	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	108.6	179.5	0	0	0	0	0	110.2	L740 T774 T787 D788 G789 I791	L740-A772 HydrophobicContact CB-CB 4.22Å; L740-A772 HydrophobicContact CD2-CB 3.91Å; A772-T774 PolarHBondContact O-N 2.97Å; A772-T787 CarbonylContact O-C 3.44Å; A772-T787 VanDerWaalsContact O-CA 3.22Å; A772-T787 WeakPolarHBondContact O-CA 3.24Å; A772-D788 PolarHBondContact O-N 2.66Å; A772-G789 PolarHBondContact N-O 3.3Å; A772-I791 HydrophobicContact CB-CD1 4.17Å; A772-I791 HydrophobicContact CB-CG1 4.12Å
773	V	94.7	Very high	88.1	Confident	2 Å²	2	73.2 Å²	73.2	1%	0.012	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	105.7	174.2	176.8	0	0	0	0	108.7	N737 V738 Y739 L740 F776 A785 V786 T787	N737-V773 HydrophobicContact CB-CG2 3.98Å; V738-V773 PolarHBondContact O-N 3.01Å; Y739-V773 HydrophobicContact CD1-CB 4.14Å; Y739-V773 HydrophobicContact CD1-CG1 4.12Å; Y739-V773 HydrophobicContact CE1-CG1 4.31Å; L740-V773 PolarHBondContact N-O 2.88Å; V773-F776 HydrophobicContact CG1-CE2 4.43Å; V773-F776 HydrophobicContact CG1-CZ 4.38Å; V773-A785 HydrophobicContact CG1-CB 3.94Å; V773-A785 HydrophobicContact CG2-CB 4.16Å; V773-V786 CarbonylContact C-O 3.58Å; V773-V786 WeakPolarHBondContact CA-O 3.22Å; V773-T787 HydrophobicContact CG2-CG2 3.94Å
774	T	93	Very high	87.9	Confident	47 Å²	47	68.5 Å²	68.5	29%	0.288	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	-9.2	-177.2	57.3	0	0	0	0	113.4	L740 A772 V786 D788	L740-T774 HydrophobicContact CB-CG2 4.33Å; L740-T774 HydrophobicContact CD2-CG2 4.29Å; L740-T774 WeakPolarHBondContact O-CA 3.5Å; A772-T774 PolarHBondContact O-N 2.97Å; T774-V786 PolarHBondContact N-O 3.47Å; T774-D788 HydrophobicContact CG2-CB 3.86Å
775	G	92.4	Very high	88	Confident	18 Å²	18	64.9 Å²	64.9	19%	0.186	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-177.9	-168.2	178.9	0	0	0	0	0	112.9	V786	G775-V786 PolarHBondContact N-O 3.37Å; G775-V786 PolarHBondContact O-N 3.32Å
776	F	90.9	Very high	88.1	Confident	80 Å²	80	64.2 Å²	64.2	35%	0.351	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	137.5	174.3	-66.9	-95.9	0	0	0	109.5	Y739 F741 V773 H784 A785	Y739-F776 HydrophobicContact CE1-CE2 4.45Å; Y739-F776 HydrophobicContact CE1-CZ 4.05Å; F741-F776 HydrophobicContact CE1-CD2 4.43Å; F741-F776 HydrophobicContact CE1-CE2 4.08Å; F741-F776 HydrophobicContact CZ-CE2 4.03Å; V773-F776 HydrophobicContact CG1-CE2 4.43Å; V773-F776 HydrophobicContact CG1-CZ 4.38Å; F776-H784 CarbonylContact C-O 3.59Å; F776-H784 VanDerWaalsContact CA-O 3.28Å; F776-H784 WeakPolarHBondContact CA-O 3.23Å; F776-A785 HydrophobicContact CD1-CB 4.23Å; F776-A785 HydrophobicContact CE1-CB 4.01Å
777	D	89.8	Confident	88.3	Confident	81 Å²	81	60.5 Å²	60.5	43%	0.433	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	154.5	171.8	-169.5	15.8	0	0	0	109.5	H779 S783 H784 V786	D777-H779 IonicContact OD2-CD2 3.33Å; D777-S783 CarbonylContact O-C 3.58Å; D777-S783 WeakPolarHBondContact O-CA 3.42Å; D777-H784 PolarHBondContact N-O 3.13Å; D777-H784 PolarHBondContact O-N 2.58Å; D777-V786 HydrophobicContact CB-CG2 3.78Å
778	Y	82	Confident	88.3	Confident	173 Å²	173	61.3 Å²	61.3	68%	0.678	36%	0.355	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-120.5	100.4	-176.9	-74.2	-99.8	0	0	0	109.6	Y782	Y778-Y782 WeakPolarHBondContact CA-O 3.47Å
779	H	79.1	Confident	88.4	Confident	97 Å²	97	60.1 Å²	60.1	45%	0.449	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	141.8	-177.7	63	45.9	0	0	0	111.9	D777 G781 Y782 H784	D777-H779 IonicContact OD2-CD2 3.33Å; H779-G781 PolarHBondContact O-N 3.22Å; H779-Y782 PolarHBondContact N-O 3.38Å; H779-Y782 VanDerWaalsContact N-O 3.11Å; H779-Y782 PolarHBondContact O-N 3.41Å; H779-H784 AromaticContact CE1-CD2 3.09Å; H779-H784 PolarHBondContact CE1-CD2 2.7Å; H779-H784 AromaticContact CE1-CE1 3.78Å; H779-H784 AromaticContact CE1-CG 3.38Å; H779-H784 AromaticContact CE1-ND1 3.8Å; H779-H784 AromaticContact CE1-NE2 3.36Å; H779-H784 PolarHBondContact CE1-NE2 2.9Å; H779-H784 AromaticContact ND1-CD2 3.17Å; H779-H784 PolarHBondContact ND1-CD2 3.48Å; H779-H784 AromaticContact ND1-CG 3.93Å; H779-H784 AromaticContact ND1-NE2 3.36Å; H779-H784 PolarHBondContact ND1-NE2 2.96Å; H779-H784 AromaticContact NE2-CD2 3.94Å; H779-H784 AromaticContact NE2-CG 3.98Å
780	G	73.9	Confident	88.5	Confident	78 Å²	78	61 Å²	61	80%	0.804	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.6	18.9	-178.6	0	0	0	0	0	115	Y782	G780-Y782 WeakPolarHBondContact O-CD2 3.49Å
781	G	75.6	Confident	88.5	Confident	64 Å²	64	61 Å²	61	66%	0.66	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	88.5	-0.5	-178.8	0	0	0	0	0	115.1	H779	H779-G781 PolarHBondContact O-N 3.22Å
782	Y	77.5	Confident	88.5	Confident	171 Å²	171	59.6 Å²	59.6	67%	0.671	34%	0.342	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-124.7	158.9	-178.8	-62.2	-83.6	0	0	0	111.7	Y778 H779 G780 H784	Y778-Y782 WeakPolarHBondContact CA-O 3.47Å; H779-Y782 PolarHBondContact N-O 3.38Å; H779-Y782 VanDerWaalsContact N-O 3.11Å; H779-Y782 PolarHBondContact O-N 3.41Å; G780-Y782 WeakPolarHBondContact O-CD2 3.49Å; Y782-H784 PolarHBondContact O-CD2 3.13Å
783	S	83.8	Confident	88.5	Confident	53 Å²	53	59.9 Å²	59.9	37%	0.371	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	129.2	173.6	-165.4	0	0	0	0	109.9	D777	D777-S783 CarbonylContact O-C 3.58Å; D777-S783 WeakPolarHBondContact O-CA 3.42Å
784	H	87.1	Confident	88.4	Confident	80 Å²	80	65.9 Å²	65.9	37%	0.37	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	131.7	-177.1	-66.2	-95.2	0	0	0	110.1	F776 D777 H779 Y782 V786	F776-H784 CarbonylContact C-O 3.59Å; F776-H784 VanDerWaalsContact CA-O 3.28Å; F776-H784 WeakPolarHBondContact CA-O 3.23Å; D777-H784 PolarHBondContact N-O 3.13Å; D777-H784 PolarHBondContact O-N 2.58Å; H779-H784 AromaticContact CE1-CD2 3.09Å; H779-H784 PolarHBondContact CE1-CD2 2.7Å; H779-H784 AromaticContact CE1-CE1 3.78Å; H779-H784 AromaticContact CE1-CG 3.38Å; H779-H784 AromaticContact CE1-ND1 3.8Å; H779-H784 AromaticContact CE1-NE2 3.36Å; H779-H784 PolarHBondContact CE1-NE2 2.9Å; H779-H784 AromaticContact ND1-CD2 3.17Å; H779-H784 PolarHBondContact ND1-CD2 3.48Å; H779-H784 AromaticContact ND1-CG 3.93Å; H779-H784 AromaticContact ND1-NE2 3.36Å; H779-H784 PolarHBondContact ND1-NE2 2.96Å; H779-H784 AromaticContact NE2-CD2 3.94Å; H779-H784 AromaticContact NE2-CG 3.98Å; Y782-H784 PolarHBondContact O-CD2 3.13Å; H784-V786 PolarHBondContact O-N 2.82Å
785	A	91.2	Very high	88.3	Confident	51 Å²	51	71.9 Å²	71.9	42%	0.421	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67	122.6	178.8	0	0	0	0	0	110.8	V773 F776	V773-A785 HydrophobicContact CG1-CB 3.94Å; V773-A785 HydrophobicContact CG2-CB 4.16Å; F776-A785 HydrophobicContact CD1-CB 4.23Å; F776-A785 HydrophobicContact CE1-CB 4.01Å
786	V	92.8	Very high	88.3	Confident	63 Å²	63	72.3 Å²	72.3	38%	0.382	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	115.9	174.7	178.8	0	0	0	0	108.2	V773 T774 G775 D777 H784	V773-V786 CarbonylContact C-O 3.58Å; V773-V786 WeakPolarHBondContact CA-O 3.22Å; T774-V786 PolarHBondContact N-O 3.47Å; G775-V786 PolarHBondContact N-O 3.37Å; G775-V786 PolarHBondContact O-N 3.32Å; D777-V786 HydrophobicContact CB-CG2 3.78Å; H784-V786 PolarHBondContact O-N 2.82Å
787	T	92.7	Very high	88.3	Confident	80 Å²	80	70.2 Å²	70.2	49%	0.491	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	129.6	175.7	53.6	0	0	0	0	111.6	P771 A772 V773	P771-T787 HydrophobicContact CB-CG2 4.08Å; A772-T787 CarbonylContact O-C 3.44Å; A772-T787 VanDerWaalsContact O-CA 3.22Å; A772-T787 WeakPolarHBondContact O-CA 3.24Å; V773-T787 HydrophobicContact CG2-CG2 3.94Å
788	D	92.3	Very high	88.4	Confident	62 Å²	62	74.1 Å²	74.1	33%	0.332	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	97.7	171.1	179.1	21.3	0	0	0	108.8	H752 R754 A772 T774	H752-D788 PolarHBondContact NE2-O 3.27Å; R754-D788 VanDerWaalsContact CD-CG 3.5Å; R754-D788 WeakPolarHBondContact CD-OD1 3.46Å; R754-D788 WeakPolarHBondContact CD-OD2 3.47Å; R754-D788 WeakPolarHBondContact CG-OD1 3.49Å; R754-D788 IonicContact NH1-OD2 3.8Å; A772-D788 PolarHBondContact O-N 2.66Å; T774-D788 HydrophobicContact CG2-CB 3.86Å
789	G	92.4	Very high	88.9	Confident	14 Å²	14	69.6 Å²	69.6	14%	0.144	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	70.5	-159.2	-179.9	0	0	0	0	0	115.2	L753 A772	L753-G789 VanDerWaalsContact O-CA 3.31Å; L753-G789 WeakPolarHBondContact O-CA 3.35Å; A772-G789 PolarHBondContact N-O 3.3Å
790	Y	94.2	Very high	89.6	Confident	38 Å²	38	65 Å²	65	15%	0.149	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	147.3	-171.9	-61.2	-87.7	0	0	0	111	L753 L758 H759 A770 P771	L753-Y790 PolarHBondContact N-O 3.47Å; L753-Y790 PolarHBondContact O-N 2.96Å; L758-Y790 HydrophobicContact CB-CD2 3.62Å; L758-Y790 HydrophobicContact CB-CE2 3.94Å; L758-Y790 HydrophobicContact CB-CG 4.39Å; L758-Y790 HydrophobicContact CD2-CD2 4.45Å; H759-Y790 HydrophobicContact CB-CD1 4.45Å; H759-Y790 HydrophobicContact CB-CE1 3.75Å; H759-Y790 AromaticContact ND1-CZ 3.71Å; H759-Y790 PolarHBondContact ND1-OH 3.39Å; A770-Y790 CarbonylContact O-C 3.53Å; A770-Y790 VanDerWaalsContact O-CA 3.3Å; A770-Y790 WeakPolarHBondContact O-CA 3.45Å; P771-Y790 HydrophobicContact CB-CD1 4.04Å; P771-Y790 HydrophobicContact CB-CE1 3.9Å
791	I	94.5	Very high	90.5	Very high	0 Å²	0	67.3 Å²	67.3	0%	0	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	135.1	162	-56.4	-55	0	0	0	107.9	V730 V738 L740 P747 C750 V751 H752 A770 A772	V730-I791 HydrophobicContact CG1-CB 3.98Å; V730-I791 HydrophobicContact CG1-CG2 3.51Å; V730-I791 HydrophobicContact CG2-CG2 4.33Å; V738-I791 HydrophobicContact CB-CG1 3.88Å; V738-I791 HydrophobicContact CG1-CG1 4.05Å; V738-I791 HydrophobicContact CG2-CB 4.15Å; V738-I791 HydrophobicContact CG2-CG1 3.98Å; L740-I791 HydrophobicContact CD2-CD1 4.12Å; P747-I791 HydrophobicContact CG-CG2 4.29Å; C750-I791 HydrophobicContact CB-CG2 3.46Å; C750-I791 VanDerWaalsContact CB-CG2 3.46Å; V751-I791 WeakPolarHBondContact O-CA 3.36Å; H752-I791 HydrophobicContact CB-CD1 3.97Å; A770-I791 PolarHBondContact N-O 3.41Å; A770-I791 PolarHBondContact O-N 3.04Å; A772-I791 HydrophobicContact CB-CD1 4.17Å; A772-I791 HydrophobicContact CB-CG1 4.12Å
792	V	93.9	Very high	91.3	Very high	0 Å²	0	67.2 Å²	67.2	0%	0	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	160.8	176	-56.4	0	0	0	0	108.9	C750 V751 L753 L758 A769 L800	C750-V792 CarbonylContact C-O 3.59Å; C750-V792 WeakPolarHBondContact CA-O 3.41Å; C750-V792 WeakPolarHBondContact CB-O 3.49Å; V751-V792 PolarHBondContact N-O 2.92Å; V751-V792 PolarHBondContact O-N 2.97Å; V751-V792 VanDerWaalsContact O-N 3.11Å; L753-V792 HydrophobicContact CD1-CG1 4.22Å; L753-V792 HydrophobicContact CD1-CG2 3.56Å; L753-V792 HydrophobicContact CG-CG2 3.93Å; L758-V792 HydrophobicContact CD2-CG1 4.29Å; A769-V792 HydrophobicContact CB-CG1 4.05Å; V792-L800 HydrophobicContact CB-CD1 3.86Å; V792-L800 HydrophobicContact CG1-CD1 3.6Å; V792-L800 HydrophobicContact CG2-CD1 4.32Å
793	C	94.3	Very high	92	Very high	5 Å²	5	60.4 Å²	60.4	3%	0.034	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67	146.6	171.5	-63.1	0	0	0	0	111.1	G728 E795 D796 E797	G728-C793 PolarHBondContact O-SG 3.39Å; C793-E795 PolarHBondContact O-N 3.46Å; C793-D796 PolarHBondContact O-N 3.21Å; C793-D796 VanDerWaalsContact O-N 3.13Å; C793-E797 PolarHBondContact O-N 3.09Å
794	E	93.3	Very high	92.5	Very high	128 Å²	128	60.2 Å²	60.2	60%	0.598	32%	0.318	S	S	*	.	G	3₁₀ helix	trans	-60.5	-35.5	-179	-172.3	172.5	178.8	0	0	111.6	G749 V751 D796 E797	G749-E794 PolarHBondContact O-N 2.88Å; V751-E794 HydrophobicContact CG2-CB 4.04Å; V751-E794 HydrophobicContact CG2-CG 4Å; E794-D796 VanDerWaalsContact C-N 3.29Å; E794-D796 PolarHBondContact O-N 3.41Å; E794-E797 WeakPolarHBondContact O-CB 3.42Å; E794-E797 PolarHBondContact O-N 3.28Å
795	E	91.3	Very high	92.8	Very high	174 Å²	174	59.8 Å²	59.8	81%	0.813	32%	0.322	S	S	*	.	G	3₁₀ helix	trans	-61.2	-32.5	176	-59.1	179.4	-170.4	0	0	113.3	C793	C793-E795 PolarHBondContact O-N 3.46Å
796	D	91.3	Very high	92.9	Very high	27 Å²	27	61.2 Å²	61.2	14%	0.144	33%	0.325	C	S	.	.	G	3₁₀ helix	trans	-89.1	-10.6	-177.1	-69	-43.9	0	0	0	113.5	L767 C793 E794 E798 V799 L800	L767-D796 HydrophobicContact CD1-CB 4.3Å; L767-D796 WeakPolarHBondContact CD2-OD1 3.25Å; C793-D796 PolarHBondContact O-N 3.21Å; C793-D796 VanDerWaalsContact O-N 3.13Å; E794-D796 VanDerWaalsContact C-N 3.29Å; E794-D796 PolarHBondContact O-N 3.41Å; D796-E798 PolarHBondContact O-N 2.96Å; D796-V799 PolarHBondContact O-N 3.3Å; D796-L800 HydrophobicContact CB-CD1 3.87Å; D796-L800 HydrophobicContact CB-CG 4.32Å; D796-L800 WeakPolarHBondContact O-CB 3.35Å; D796-L800 WeakPolarHBondContact O-CG 3.44Å; D796-L800 PolarHBondContact O-N 3.01Å
797	E	91.8	Very high	92.7	Very high	36 Å²	36	60.4 Å²	60.4	17%	0.168	32%	0.317	C	S	.	.	H	α-helix	trans	-58.4	-48.4	-168.6	170.9	162.8	-130.7	0	0	112.6	V751 L753 C793 E794 R801	V751-E797 VanDerWaalsContact CG1-OE1 3.3Å; V751-E797 WeakPolarHBondContact CG1-OE1 3.16Å; L753-E797 HydrophobicContact CD2-CG 4.3Å; L753-E797 WeakPolarHBondContact CD2-OE1 3.35Å; C793-E797 PolarHBondContact O-N 3.09Å; E794-E797 WeakPolarHBondContact O-CB 3.42Å; E794-E797 PolarHBondContact O-N 3.28Å; E797-R801 HydrophobicContact CG-CG 4.31Å; E797-R801 VanDerWaalsContact CG-NE 3.34Å; E797-R801 VanDerWaalsContact O-CB 3.3Å; E797-R801 WeakPolarHBondContact O-CB 3.44Å; E797-R801 WeakPolarHBondContact O-CG 3.05Å; E797-R801 PolarHBondContact O-N 3.45Å; E797-R801 IonicContact OE1-CZ 2.78Å; E797-R801 IonicContact OE1-NE 2.8Å; E797-R801 PolarHBondContact OE1-NE 3.29Å; E797-R801 IonicContact OE1-NH2 2.73Å; E797-R801 PolarHBondContact OE1-NH2 3.1Å
798	E	92.1	Very high	92.6	Very high	163 Å²	163	58.6 Å²	58.6	76%	0.762	30%	0.303	S	S	*	.	H	α-helix	trans	-65.6	-41.9	-177.5	-62.4	-160.1	151.5	0	0	111.6	D796 R801 A802	D796-E798 PolarHBondContact O-N 2.96Å; E798-R801 PolarHBondContact O-N 3.31Å; E798-A802 WeakPolarHBondContact O-CB 3.5Å; E798-A802 PolarHBondContact O-N 3.49Å
799	V	92.8	Very high	92.6	Very high	77 Å²	77	61.6 Å²	61.6	47%	0.467	32%	0.315	S	S	.	.	H	α-helix	trans	-65	-47.9	-179.8	-174.7	0	0	0	0	110.5	L765 L767 D796 A802 A803	L765-V799 HydrophobicContact CD1-CG1 4.13Å; L767-V799 HydrophobicContact CD1-CB 4.38Å; L767-V799 HydrophobicContact CD1-CG1 4.07Å; D796-V799 PolarHBondContact O-N 3.3Å; V799-A802 PolarHBondContact O-N 3.04Å; V799-A803 WeakPolarHBondContact O-CB 3.39Å; V799-A803 PolarHBondContact O-N 3.04Å
800	L	92.4	Very high	92.5	Very high	0 Å²	0	63.4 Å²	63.4	0%	0	32%	0.321	C	S	.	.	H	α-helix	trans	-65.7	-39.6	178.8	-74	174.1	0	0	0	112.4	L758 A762 L765 L767 V792 D796 W804	L758-L800 HydrophobicContact CD1-CB 4.43Å; A762-L800 HydrophobicContact CB-CD2 3.8Å; L765-L800 HydrophobicContact CD1-CD2 4.31Å; L767-L800 HydrophobicContact CB-CD2 4.2Å; L767-L800 HydrophobicContact CD1-CD2 3.87Å; L767-L800 HydrophobicContact CD1-CG 3.88Å; V792-L800 HydrophobicContact CB-CD1 3.86Å; V792-L800 HydrophobicContact CG1-CD1 3.6Å; V792-L800 HydrophobicContact CG2-CD1 4.32Å; D796-L800 HydrophobicContact CB-CD1 3.87Å; D796-L800 HydrophobicContact CB-CG 4.32Å; D796-L800 WeakPolarHBondContact O-CB 3.35Å; D796-L800 WeakPolarHBondContact O-CG 3.44Å; D796-L800 PolarHBondContact O-N 3.01Å; L800-W804 WeakPolarHBondContact O-CB 3.45Å; L800-W804 PolarHBondContact O-N 3Å
801	R	93.3	Very high	92.2	Very high	127 Å²	127	65.4 Å²	65.4	48%	0.479	33%	0.331	S	S	.	.	H	α-helix	trans	-62.7	-48	174.1	-76.5	172.2	175.4	-134.9	4.3	111.4	L753 L755 E797 E798 W804 V805	L753-R801 HydrophobicContact CD1-CG 4.43Å; L753-R801 HydrophobicContact CD2-CG 4.25Å; L755-R801 HydrophobicContact CD1-CG 4.29Å; E797-R801 HydrophobicContact CG-CG 4.31Å; E797-R801 VanDerWaalsContact CG-NE 3.34Å; E797-R801 VanDerWaalsContact O-CB 3.3Å; E797-R801 WeakPolarHBondContact O-CB 3.44Å; E797-R801 WeakPolarHBondContact O-CG 3.05Å; E797-R801 PolarHBondContact O-N 3.45Å; E797-R801 IonicContact OE1-CZ 2.78Å; E797-R801 IonicContact OE1-NE 2.8Å; E797-R801 PolarHBondContact OE1-NE 3.29Å; E797-R801 IonicContact OE1-NH2 2.73Å; E797-R801 PolarHBondContact OE1-NH2 3.1Å; E798-R801 PolarHBondContact O-N 3.31Å; R801-W804 PolarHBondContact O-N 3.12Å; R801-V805 WeakPolarHBondContact O-CG2 3.38Å; R801-V805 PolarHBondContact O-N 3.06Å; R801-V805 VanDerWaalsContact O-N 3.16Å
802	A	93	Very high	92	Very high	63 Å²	63	71.8 Å²	71.8	52%	0.521	36%	0.359	S	S	.	.	H	α-helix	trans	-62.9	-48.9	-179.9	0	0	0	0	0	112	E798 V799 W804 V805 V806	E798-A802 WeakPolarHBondContact O-CB 3.5Å; E798-A802 PolarHBondContact O-N 3.49Å; V799-A802 PolarHBondContact O-N 3.04Å; A802-W804 VanDerWaalsContact C-N 3.3Å; A802-W804 PolarHBondContact O-N 2.98Å; A802-V805 PolarHBondContact O-N 3.4Å; A802-V806 PolarHBondContact O-N 3.44Å
803	A	92.3	Very high	91.9	Very high	28 Å²	28	79 Å²	79	23%	0.231	39%	0.386	C	S	.	.	H	α-helix	trans	-65.4	-32.4	178.3	0	0	0	0	0	112.9	V761 L765 V799 V806 E807	V761-A803 HydrophobicContact CG1-CB 3.59Å; L765-A803 HydrophobicContact CD1-CB 3.61Å; V799-A803 WeakPolarHBondContact O-CB 3.39Å; V799-A803 PolarHBondContact O-N 3.04Å; A803-V806 PolarHBondContact O-N 3.02Å; A803-E807 PolarHBondContact O-N 3.42Å
804	W	93.9	Very high	91.9	Very high	48 Å²	48	83.2 Å²	83.2	18%	0.182	40%	0.404	C	S	.	.	H	α-helix	trans	-65.4	-41.4	174.5	179.6	90.9	0	0	0	112.1	L755 P756 L758 V761 L800 R801 A802 V806 E807 Q808	L755-W804 HydrophobicContact CB-CD2 4.29Å; L755-W804 HydrophobicContact CB-CG 4.43Å; L755-W804 HydrophobicContact CB-CZ2 4.45Å; L755-W804 HydrophobicContact CD1-CB 4.39Å; L755-W804 HydrophobicContact CD1-CD2 4.07Å; L755-W804 HydrophobicContact CD1-CE3 4.28Å; L755-W804 HydrophobicContact CD1-CG 4.11Å; L755-W804 HydrophobicContact CD2-CD2 4.22Å; L755-W804 HydrophobicContact CD2-CE3 4.09Å; L755-W804 HydrophobicContact CD2-CH2 4.05Å; L755-W804 HydrophobicContact CD2-CZ2 4.17Å; L755-W804 HydrophobicContact CD2-CZ3 4.01Å; L755-W804 HydrophobicContact CG-CD2 4.43Å; P756-W804 HydrophobicContact CG-CZ2 3.96Å; P756-W804 PolarHBondContact O-NE1 3.11Å; L758-W804 HydrophobicContact CD1-CB 3.76Å; L758-W804 HydrophobicContact CD1-CG 3.95Å; V761-W804 HydrophobicContact CG2-CB 4.33Å; L800-W804 WeakPolarHBondContact O-CB 3.45Å; L800-W804 PolarHBondContact O-N 3Å; R801-W804 PolarHBondContact O-N 3.12Å; A802-W804 VanDerWaalsContact C-N 3.3Å; A802-W804 PolarHBondContact O-N 2.98Å; W804-V806 VanDerWaalsContact C-N 3.33Å; W804-V806 PolarHBondContact O-N 2.77Å; W804-E807 PolarHBondContact O-N 2.9Å; W804-Q808 HydrophobicContact CD2-CG 3.81Å; W804-Q808 HydrophobicContact CE3-CG 4.04Å; W804-Q808 HydrophobicContact CG-CG 4.5Å; W804-Q808 HydrophobicContact CH2-CG 3.79Å; W804-Q808 HydrophobicContact CZ2-CG 3.53Å; W804-Q808 HydrophobicContact CZ3-CG 4.03Å; W804-Q808 VanDerWaalsContact O-CG 3.26Å; W804-Q808 WeakPolarHBondContact O-CG 3.23Å; W804-Q808 PolarHBondContact O-N 3.06Å
805	V	93.8	Very high	91.8	Very high	72 Å²	72	80.7 Å²	80.7	44%	0.436	39%	0.392	S	S	.	.	H	α-helix	trans	-58.6	-46.7	174.6	173.1	0	0	0	0	110.7	R801 A802 E807 Q808 E809	R801-V805 WeakPolarHBondContact O-CG2 3.38Å; R801-V805 PolarHBondContact O-N 3.06Å; R801-V805 VanDerWaalsContact O-N 3.16Å; A802-V805 PolarHBondContact O-N 3.4Å; V805-E807 PolarHBondContact O-N 3.22Å; V805-Q808 PolarHBondContact O-N 2.78Å; V805-E809 PolarHBondContact O-N 3.14Å
806	V	92.2	Very high	91.8	Very high	80 Å²	80	78.4 Å²	78.4	49%	0.485	38%	0.38	S	S	.	.	H	α-helix	trans	-61.4	-44	177.7	176.1	0	0	0	0	111.8	A802 A803 W804 Q808 E809 I810	A802-V806 PolarHBondContact O-N 3.44Å; A803-V806 PolarHBondContact O-N 3.02Å; W804-V806 VanDerWaalsContact C-N 3.33Å; W804-V806 PolarHBondContact O-N 2.77Å; V806-Q808 VanDerWaalsContact C-N 3.34Å; V806-Q808 PolarHBondContact O-N 2.78Å; V806-E809 PolarHBondContact O-N 2.81Å; V806-I810 HydrophobicContact CG1-CD1 3.86Å; V806-I810 WeakPolarHBondContact O-CG1 3.5Å; V806-I810 PolarHBondContact O-N 3.42Å
807	E	89.4	Confident	92	Very high	46 Å²	46	80.5 Å²	80.5	22%	0.215	39%	0.389	C	S	.	.	H	α-helix	trans	-64.2	-37.4	176.8	-170	69.3	-167.9	0	0	111.9	V761 K764 A803 W804 V805 I810 Q811	V761-E807 HydrophobicContact CG2-CB 4.01Å; V761-E807 HydrophobicContact CG2-CG 4.18Å; K764-E807 IonicContact NZ-OE1 2.65Å; K764-E807 PolarHBondContact NZ-OE1 3.37Å; K764-E807 IonicContact NZ-OE2 3.99Å; K764-E807 PolarHBondContact NZ-OE2 2.96Å; A803-E807 PolarHBondContact O-N 3.42Å; W804-E807 PolarHBondContact O-N 2.9Å; V805-E807 PolarHBondContact O-N 3.22Å; E807-I810 PolarHBondContact O-N 3.07Å; E807-Q811 VanDerWaalsContact O-CB 3.28Å; E807-Q811 WeakPolarHBondContact O-CB 3.41Å; E807-Q811 PolarHBondContact O-N 2.88Å
808	Q	90.3	Very high	92.1	Very high	43 Å²	43	85.5 Å²	85.5	20%	0.201	41%	0.41	C	S	.	.	H	α-helix	trans	-65.4	-37.1	175.4	-69.5	-64.6	-32	0	0	112.3	W804 V805 V806 K812	W804-Q808 HydrophobicContact CD2-CG 3.81Å; W804-Q808 HydrophobicContact CE3-CG 4.04Å; W804-Q808 HydrophobicContact CG-CG 4.5Å; W804-Q808 HydrophobicContact CH2-CG 3.79Å; W804-Q808 HydrophobicContact CZ2-CG 3.53Å; W804-Q808 HydrophobicContact CZ3-CG 4.03Å; W804-Q808 VanDerWaalsContact O-CG 3.26Å; W804-Q808 WeakPolarHBondContact O-CG 3.23Å; W804-Q808 PolarHBondContact O-N 3.06Å; V805-Q808 PolarHBondContact O-N 2.78Å; V806-Q808 VanDerWaalsContact C-N 3.34Å; V806-Q808 PolarHBondContact O-N 2.78Å; Q808-K812 WeakPolarHBondContact O-CB 3.22Å; Q808-K812 WeakPolarHBondContact O-CD 3.25Å; Q808-K812 WeakPolarHBondContact O-CG 3.47Å; Q808-K812 PolarHBondContact O-N 3.01Å
809	E	91.4	Very high	92.1	Very high	124 Å²	124	84.3 Å²	84.3	58%	0.579	40%	0.402	S	S	*	.	H	α-helix	trans	-68	-44.4	174.2	-71.2	-178.1	177.9	0	0	111.7	V805 V806 Q811 K812 R813	V805-E809 PolarHBondContact O-N 3.14Å; V806-E809 PolarHBondContact O-N 2.81Å; E809-Q811 VanDerWaalsContact C-N 3.32Å; E809-Q811 PolarHBondContact O-N 3.05Å; E809-K812 PolarHBondContact O-N 2.81Å; E809-R813 WeakPolarHBondContact O-CB 3.47Å; E809-R813 PolarHBondContact O-N 3.05Å
810	I	90.4	Very high	92.1	Very high	53 Å²	53	84.7 Å²	84.7	27%	0.272	40%	0.399	S	S	.	.	H	α-helix	trans	-59.7	-43.1	174.1	-68.8	167.7	0	0	0	110.9	V806 E807 R813 K814	V806-I810 HydrophobicContact CG1-CD1 3.86Å; V806-I810 WeakPolarHBondContact O-CG1 3.5Å; V806-I810 PolarHBondContact O-N 3.42Å; E807-I810 PolarHBondContact O-N 3.07Å; I810-R813 PolarHBondContact O-N 3.29Å; I810-K814 HydrophobicContact CG2-CD 4.03Å; I810-K814 WeakPolarHBondContact O-CB 3.37Å; I810-K814 WeakPolarHBondContact O-CG 3.24Å; I810-K814 PolarHBondContact O-N 3.37Å
811	Q	88.3	Confident	92.1	Very high	79 Å²	79	91.9 Å²	91.9	37%	0.369	43%	0.43	S	S	.	.	H	α-helix	trans	-65.6	-47.6	177.6	178.7	61.8	17.3	0	0	111.5	E807 E809 R813 K814 E815	E807-Q811 VanDerWaalsContact O-CB 3.28Å; E807-Q811 WeakPolarHBondContact O-CB 3.41Å; E807-Q811 PolarHBondContact O-N 2.88Å; E809-Q811 VanDerWaalsContact C-N 3.32Å; E809-Q811 PolarHBondContact O-N 3.05Å; Q811-R813 VanDerWaalsContact C-N 3.28Å; Q811-R813 PolarHBondContact O-N 3.02Å; Q811-K814 PolarHBondContact O-N 2.92Å; Q811-E815 PolarHBondContact NE2-OE1 3.21Å; Q811-E815 WeakPolarHBondContact O-CB 3.4Å; Q811-E815 WeakPolarHBondContact O-CG 3.36Å; Q811-E815 PolarHBondContact O-N 3.26Å
812	K	90.4	Very high	92	Very high	135 Å²	135	94.5 Å²	94.5	59%	0.587	44%	0.44	S	S	*	.	H	α-helix	trans	-58.4	-39.9	175.1	-74.9	166.4	-174.2	171.4	0	111.8	Q808 E809 E815 K816	Q808-K812 WeakPolarHBondContact O-CB 3.22Å; Q808-K812 WeakPolarHBondContact O-CD 3.25Å; Q808-K812 WeakPolarHBondContact O-CG 3.47Å; Q808-K812 PolarHBondContact O-N 3.01Å; E809-K812 PolarHBondContact O-N 2.81Å; K812-E815 PolarHBondContact O-N 3.01Å; K812-K816 WeakPolarHBondContact O-CB 3.41Å; K812-K816 PolarHBondContact O-N 3.04Å
813	R	92.8	Very high	91.8	Very high	151 Å²	151	93.7 Å²	93.7	57%	0.57	43%	0.433	S	S	*	.	H	α-helix	trans	-65.5	-48.7	176.2	-156.4	-174.3	73.5	-152.1	0.8	111.3	E809 I810 Q811 E815 K816 E817	E809-R813 WeakPolarHBondContact O-CB 3.47Å; E809-R813 PolarHBondContact O-N 3.05Å; I810-R813 PolarHBondContact O-N 3.29Å; Q811-R813 VanDerWaalsContact C-N 3.28Å; Q811-R813 PolarHBondContact O-N 3.02Å; R813-E815 VanDerWaalsContact C-N 3.27Å; R813-E815 PolarHBondContact O-N 2.75Å; R813-K816 WeakPolarHBondContact O-CB 3.2Å; R813-K816 PolarHBondContact O-N 2.94Å; R813-K816 VanDerWaalsContact O-N 3.1Å; R813-E817 WeakPolarHBondContact CG-OE1 3.3Å; R813-E817 IonicContact CZ-OE1 2.9Å; R813-E817 IonicContact NE-OE1 3.42Å; R813-E817 PolarHBondContact NE-OE1 3.02Å; R813-E817 IonicContact NH2-OE1 3.48Å; R813-E817 WeakPolarHBondContact O-CB 3.39Å; R813-E817 VanDerWaalsContact O-CG 3.26Å; R813-E817 WeakPolarHBondContact O-CG 3.47Å; R813-E817 PolarHBondContact O-N 2.75Å
814	K	92.9	Very high	91.7	Very high	93 Å²	93	97.1 Å²	97.1	40%	0.404	45%	0.446	S	S	.	.	H	α-helix	trans	-59.4	-35	174.5	-73.9	171.9	179.7	174.2	0	112.8	I810 Q811 K818	I810-K814 HydrophobicContact CG2-CD 4.03Å; I810-K814 WeakPolarHBondContact O-CB 3.37Å; I810-K814 WeakPolarHBondContact O-CG 3.24Å; I810-K814 PolarHBondContact O-N 3.37Å; Q811-K814 PolarHBondContact O-N 2.92Å; K814-K818 VanDerWaalsContact O-CB 3.32Å; K814-K818 WeakPolarHBondContact O-CB 3.48Å; K814-K818 VanDerWaalsContact O-CG 3.27Å; K814-K818 WeakPolarHBondContact O-CG 3.43Å; K814-K818 PolarHBondContact O-N 3.2Å
815	E	91.9	Very high	91.4	Very high	76 Å²	76	97.7 Å²	97.7	36%	0.355	46%	0.462	S	S	.	.	H	α-helix	trans	-72.1	-37.1	174.1	-78.1	-177.3	-151.5	0	0	113	Q811 K812 R813 K818 K819	Q811-E815 PolarHBondContact NE2-OE1 3.21Å; Q811-E815 WeakPolarHBondContact O-CB 3.4Å; Q811-E815 WeakPolarHBondContact O-CG 3.36Å; Q811-E815 PolarHBondContact O-N 3.26Å; K812-E815 PolarHBondContact O-N 3.01Å; R813-E815 VanDerWaalsContact C-N 3.27Å; R813-E815 PolarHBondContact O-N 2.75Å; E815-K818 PolarHBondContact O-N 2.85Å; E815-K819 WeakPolarHBondContact O-CB 3.47Å; E815-K819 VanDerWaalsContact O-CG 3.25Å; E815-K819 WeakPolarHBondContact O-CG 3.29Å; E815-K819 PolarHBondContact O-N 3.09Å
816	K	92.3	Very high	91	Very high	125 Å²	125	98 Å²	98	54%	0.543	47%	0.467	S	S	.	.	H	α-helix	trans	-63.3	-50.4	171.6	-172.5	174.5	-177.6	-73.1	0	110.3	K812 R813 K818 K819 E820	K812-K816 WeakPolarHBondContact O-CB 3.41Å; K812-K816 PolarHBondContact O-N 3.04Å; R813-K816 WeakPolarHBondContact O-CB 3.2Å; R813-K816 PolarHBondContact O-N 2.94Å; R813-K816 VanDerWaalsContact O-N 3.1Å; K816-K818 VanDerWaalsContact C-N 3.32Å; K816-K818 PolarHBondContact O-N 2.94Å; K816-K819 PolarHBondContact O-N 2.84Å; K816-K819 VanDerWaalsContact O-N 3.09Å; K816-E820 WeakPolarHBondContact CE-OE1 3.38Å; K816-E820 IonicContact NZ-OE1 2.72Å; K816-E820 PolarHBondContact NZ-OE1 3.41Å; K816-E820 IonicContact NZ-OE2 3.82Å; K816-E820 WeakPolarHBondContact O-CB 3.14Å; K816-E820 WeakPolarHBondContact O-CG 3.4Å; K816-E820 PolarHBondContact O-N 3.34Å
817	E	93.6	Very high	90.7	Very high	72 Å²	72	102.1 Å²	102.1	34%	0.336	47%	0.474	S	S	.	.	H	α-helix	trans	-55.2	-43.3	173.8	-68.2	163.6	-153.7	0	0	111.8	R813 K821	R813-E817 WeakPolarHBondContact CG-OE1 3.3Å; R813-E817 IonicContact CZ-OE1 2.9Å; R813-E817 IonicContact NE-OE1 3.42Å; R813-E817 PolarHBondContact NE-OE1 3.02Å; R813-E817 IonicContact NH2-OE1 3.48Å; R813-E817 WeakPolarHBondContact O-CB 3.39Å; R813-E817 VanDerWaalsContact O-CG 3.26Å; R813-E817 WeakPolarHBondContact O-CG 3.47Å; R813-E817 PolarHBondContact O-N 2.75Å; E817-K821 WeakPolarHBondContact O-CB 3.48Å; E817-K821 VanDerWaalsContact O-CG 3.3Å; E817-K821 WeakPolarHBondContact O-CG 3.49Å; E817-K821 PolarHBondContact O-N 3.34Å
818	K	93.9	Very high	90.3	Very high	141 Å²	141	104.1 Å²	104.1	61%	0.613	49%	0.486	S	S	*	.	H	α-helix	trans	-67.8	-37.6	175.4	-79.4	-179.3	177.3	-170.8	0	113	K814 E815 K816 R822	K814-K818 VanDerWaalsContact O-CB 3.32Å; K814-K818 WeakPolarHBondContact O-CB 3.48Å; K814-K818 VanDerWaalsContact O-CG 3.27Å; K814-K818 WeakPolarHBondContact O-CG 3.43Å; K814-K818 PolarHBondContact O-N 3.2Å; E815-K818 PolarHBondContact O-N 2.85Å; K816-K818 VanDerWaalsContact C-N 3.32Å; K816-K818 PolarHBondContact O-N 2.94Å; K818-R822 WeakPolarHBondContact O-CB 3.32Å; K818-R822 VanDerWaalsContact O-CG 3.28Å; K818-R822 WeakPolarHBondContact O-CG 3.49Å; K818-R822 PolarHBondContact O-N 3.42Å
819	K	92.5	Very high	89.7	Confident	137 Å²	137	105.1 Å²	105.1	60%	0.596	50%	0.496	S	S	*	.	H	α-helix	trans	-68.3	-41.5	175.2	-76.4	165.6	-178.7	165.8	0	111.3	E815 K816 R822 A823	E815-K819 WeakPolarHBondContact O-CB 3.47Å; E815-K819 VanDerWaalsContact O-CG 3.25Å; E815-K819 WeakPolarHBondContact O-CG 3.29Å; E815-K819 PolarHBondContact O-N 3.09Å; K816-K819 PolarHBondContact O-N 2.84Å; K816-K819 VanDerWaalsContact O-N 3.09Å; K819-R822 PolarHBondContact O-N 2.7Å; K819-A823 WeakPolarHBondContact O-CB 3.38Å; K819-A823 PolarHBondContact O-N 2.91Å
820	E	92.3	Very high	89.1	Confident	86 Å²	86	103.8 Å²	103.8	40%	0.402	49%	0.493	S	S	.	.	H	α-helix	trans	-65.3	-47	176	-72.8	166.9	166.1	0	0	111.4	K816 R822 A823 I824	K816-E820 WeakPolarHBondContact CE-OE1 3.38Å; K816-E820 IonicContact NZ-OE1 2.72Å; K816-E820 PolarHBondContact NZ-OE1 3.41Å; K816-E820 IonicContact NZ-OE2 3.82Å; K816-E820 WeakPolarHBondContact O-CB 3.14Å; K816-E820 WeakPolarHBondContact O-CG 3.4Å; K816-E820 PolarHBondContact O-N 3.34Å; E820-R822 VanDerWaalsContact C-N 3.34Å; E820-R822 PolarHBondContact O-N 3.17Å; E820-A823 PolarHBondContact O-N 3.32Å; E820-I824 VanDerWaalsContact O-CG1 3.3Å; E820-I824 WeakPolarHBondContact O-CG1 3.36Å; E820-I824 PolarHBondContact O-N 2.91Å
821	K	93.4	Very high	88.6	Confident	150 Å²	150	104.8 Å²	104.8	65%	0.652	50%	0.501	S	S	*	.	H	α-helix	trans	-59.9	-40.9	173.7	-75.4	178.3	178.2	-174.8	0	112.6	E817 A825	E817-K821 WeakPolarHBondContact O-CB 3.48Å; E817-K821 VanDerWaalsContact O-CG 3.3Å; E817-K821 WeakPolarHBondContact O-CG 3.49Å; E817-K821 PolarHBondContact O-N 3.34Å; K821-A825 VanDerWaalsContact O-CB 3.28Å; K821-A825 WeakPolarHBondContact O-CB 3.24Å; K821-A825 PolarHBondContact O-N 3Å
822	R	91.1	Very high	88	Confident	183 Å²	183	105.8 Å²	105.8	69%	0.691	51%	0.509	S	S	*	.	H	α-helix	trans	-64	-45.4	173.7	-78.2	174.1	177	-178.9	-2.2	112.1	K818 K819 E820 A825 S826	K818-R822 WeakPolarHBondContact O-CB 3.32Å; K818-R822 VanDerWaalsContact O-CG 3.28Å; K818-R822 WeakPolarHBondContact O-CG 3.49Å; K818-R822 PolarHBondContact O-N 3.42Å; K819-R822 PolarHBondContact O-N 2.7Å; E820-R822 VanDerWaalsContact C-N 3.34Å; E820-R822 PolarHBondContact O-N 3.17Å; R822-A825 PolarHBondContact O-N 2.75Å; R822-S826 PolarHBondContact O-N 3.45Å; R822-S826 PolarHBondContact O-OG 2.79Å
823	A	89.3	Confident	87.1	Confident	45 Å²	45	104.8 Å²	104.8	37%	0.372	51%	0.51	S	S	.	.	H	α-helix	trans	-58.9	-50.8	176.6	0	0	0	0	0	110.9	K819 E820 A825 S826 W827	K819-A823 WeakPolarHBondContact O-CB 3.38Å; K819-A823 PolarHBondContact O-N 2.91Å; E820-A823 PolarHBondContact O-N 3.32Å; A823-A825 VanDerWaalsContact C-N 3.33Å; A823-A825 PolarHBondContact O-N 3.08Å; A823-S826 CarbonylContact O-C 3.47Å; A823-S826 PolarHBondContact O-N 2.73Å; A823-S826 VanDerWaalsContact O-N 3.08Å; A823-W827 PolarHBondContact O-N 3.1Å
824	I	89	Confident	86.1	Confident	100 Å²	100	102.5 Å²	102.5	51%	0.513	51%	0.509	S	S	.	.	H	α-helix	trans	-57.6	-45.9	176.9	-66.6	163	0	0	0	110.7	E820 S826 W827 N828	E820-I824 VanDerWaalsContact O-CG1 3.3Å; E820-I824 WeakPolarHBondContact O-CG1 3.36Å; E820-I824 PolarHBondContact O-N 2.91Å; I824-S826 VanDerWaalsContact C-N 3.27Å; I824-S826 PolarHBondContact O-N 3.03Å; I824-W827 PolarHBondContact O-N 2.7Å; I824-W827 VanDerWaalsContact O-N 3.13Å; I824-N828 PolarHBondContact O-N 3.3Å; I824-N828 PolarHBondContact O-OD1 3.2Å
825	A	88.2	Confident	84.5	Confident	61 Å²	61	101.2 Å²	101.2	50%	0.504	51%	0.511	S	S	.	.	H	α-helix	trans	-61.9	-31.1	176.8	0	0	0	0	0	113.5	K821 R822 A823 P829	K821-A825 VanDerWaalsContact O-CB 3.28Å; K821-A825 WeakPolarHBondContact O-CB 3.24Å; K821-A825 PolarHBondContact O-N 3Å; R822-A825 PolarHBondContact O-N 2.75Å; A823-A825 VanDerWaalsContact C-N 3.33Å; A823-A825 PolarHBondContact O-N 3.08Å; A825-P829 WeakPolarHBondContact O-CD 3.47Å
826	S	84.7	Confident	83	Confident	78 Å²	78	101.5 Å²	101.5	55%	0.545	52%	0.518	S	S	.	.	H	α-helix	trans	-80.2	-29.4	172.4	-60.4	0	0	0	0	113.7	R822 A823 I824 P829	R822-S826 PolarHBondContact O-N 3.45Å; R822-S826 PolarHBondContact O-OG 2.79Å; A823-S826 CarbonylContact O-C 3.47Å; A823-S826 PolarHBondContact O-N 2.73Å; A823-S826 VanDerWaalsContact O-N 3.08Å; I824-S826 VanDerWaalsContact C-N 3.27Å; I824-S826 PolarHBondContact O-N 3.03Å; S826-P829 WeakPolarHBondContact O-CD 3.35Å; S826-P829 WeakPolarHBondContact O-CG 3.26Å
827	W	85.8	Confident	81.2	Confident	166 Å²	166	101.9 Å²	101.9	63%	0.629	52%	0.522	S	S	*	.	H	α-helix	trans	-75.4	-34.7	175.2	-83.3	105.3	0	0	0	112.6	A823 I824 L830 V831	A823-W827 PolarHBondContact O-N 3.1Å; I824-W827 PolarHBondContact O-N 2.7Å; I824-W827 VanDerWaalsContact O-N 3.13Å; W827-L830 WeakPolarHBondContact O-CB 3.43Å; W827-L830 PolarHBondContact O-N 2.98Å; W827-L830 VanDerWaalsContact O-N 3.14Å; W827-V831 WeakPolarHBondContact O-CG2 3.45Å; W827-V831 PolarHBondContact O-N 2.85Å
828	N	81.3	Confident	79.3	Confident	88 Å²	88	106.4 Å²	106.4	47%	0.471	54%	0.54	S	S	.	.	H	α-helix	trans	-51.1	-52.8	179.2	-73.8	-6.7	0	0	0	114	I824 L830 V831 N832	I824-N828 PolarHBondContact O-N 3.3Å; I824-N828 PolarHBondContact O-OD1 3.2Å; N828-L830 VanDerWaalsContact C-N 3.35Å; N828-L830 PolarHBondContact O-N 3.08Å; N828-V831 PolarHBondContact O-N 2.9Å; N828-N832 WeakPolarHBondContact O-CB 3.4Å; N828-N832 PolarHBondContact O-N 2.81Å; N828-N832 PolarHBondContact O-OD1 3.05Å
829	P	79.3	Confident	77.3	Confident	65 Å²	65	104.7 Å²	104.7	42%	0.422	54%	0.542	S	S	.	.	H	α-helix	trans	-66	-33.8	177.8	25.4	-34.3	0	0	0	113.1	A825 S826 N833	A825-P829 WeakPolarHBondContact O-CD 3.47Å; S826-P829 WeakPolarHBondContact O-CD 3.35Å; S826-P829 WeakPolarHBondContact O-CG 3.26Å; P829-N833 WeakPolarHBondContact O-CB 3.4Å; P829-N833 PolarHBondContact O-N 3.14Å; P829-N833 PolarHBondContact O-ND2 3.33Å; P829-N833 PolarHBondContact O-OD1 3.2Å
830	L	78.1	Confident	75.4	Confident	96 Å²	96	104.1 Å²	104.1	50%	0.503	55%	0.545	S	S	.	.	H	α-helix	trans	-62.8	-46.6	174.1	-81.7	163	0	0	0	111.6	W827 N828 N833 L834	W827-L830 WeakPolarHBondContact O-CB 3.43Å; W827-L830 PolarHBondContact O-N 2.98Å; W827-L830 VanDerWaalsContact O-N 3.14Å; N828-L830 VanDerWaalsContact C-N 3.35Å; N828-L830 PolarHBondContact O-N 3.08Å; L830-N833 PolarHBondContact O-N 3.03Å; L830-L834 WeakPolarHBondContact O-CB 3.34Å; L830-L834 WeakPolarHBondContact O-CG 3.46Å; L830-L834 PolarHBondContact O-N 3.08Å
831	V	79.8	Confident	73.5	Confident	73 Å²	73	105.2 Å²	105.2	44%	0.442	56%	0.558	S	S	.	*	H	α-helix	trans	-68.2	-38.3	178.8	174.2	0	0	0	0	111.6	W827 N828 L834 S835	W827-V831 WeakPolarHBondContact O-CG2 3.45Å; W827-V831 PolarHBondContact O-N 2.85Å; N828-V831 PolarHBondContact O-N 2.9Å; V831-L834 PolarHBondContact O-N 3.27Å; V831-S835 WeakPolarHBondContact O-CB 3.45Å; V831-S835 PolarHBondContact O-N 3.44Å; V831-S835 PolarHBondContact O-OG 2.94Å
832	N	75	Confident	71	Confident	100 Å²	100	107.6 Å²	107.6	54%	0.535	59%	0.585	S	S	.	*	H	α-helix	trans	-63.1	-47.2	175.7	-71.7	-5.2	0	0	0	111.2	N828 L834 S835 V836	N828-N832 WeakPolarHBondContact O-CB 3.4Å; N828-N832 PolarHBondContact O-N 2.81Å; N828-N832 PolarHBondContact O-OD1 3.05Å; N832-L834 PolarHBondContact O-N 3.04Å; N832-S835 WeakPolarHBondContact O-CB 3.23Å; N832-S835 PolarHBondContact O-N 3.2Å; N832-V836 WeakPolarHBondContact O-CG2 3.49Å; N832-V836 PolarHBondContact O-N 3.23Å
833	N	73.1	Confident	70	Confident	114 Å²	114	103.9 Å²	103.9	61%	0.61	58%	0.58	S	S	*	*	H	α-helix	trans	-60.9	-45.6	177.6	-68.7	-7.9	0	0	0	111.8	P829 L830 S835 V836 E837	P829-N833 WeakPolarHBondContact O-CB 3.4Å; P829-N833 PolarHBondContact O-N 3.14Å; P829-N833 PolarHBondContact O-ND2 3.33Å; P829-N833 PolarHBondContact O-OD1 3.2Å; L830-N833 PolarHBondContact O-N 3.03Å; N833-S835 PolarHBondContact O-N 3.14Å; N833-V836 PolarHBondContact O-N 3.17Å; N833-E837 PolarHBondContact O-N 3.39Å
834	L	70.1	Confident	69	Low	104 Å²	104	106.9 Å²	106.9	55%	0.545	59%	0.59	S	S	.	*	H	α-helix	trans	-63.5	-19.7	174.8	-75.3	167.1	0	0	0	114	L830 V831 N832	L830-L834 WeakPolarHBondContact O-CB 3.34Å; L830-L834 WeakPolarHBondContact O-CG 3.46Å; L830-L834 PolarHBondContact O-N 3.08Å; V831-L834 PolarHBondContact O-N 3.27Å; N832-L834 PolarHBondContact O-N 3.04Å
835	S	59.8	Low	67.8	Low	66 Å²	66	107.3 Å²	107.3	46%	0.462	60%	0.595	S	S	.	*	H	α-helix	trans	-86.4	-39.7	177	-58.3	0	0	0	0	111.7	V831 N832 N833 E837 K838 T839	V831-S835 WeakPolarHBondContact O-CB 3.45Å; V831-S835 PolarHBondContact O-N 3.44Å; V831-S835 PolarHBondContact O-OG 2.94Å; N832-S835 WeakPolarHBondContact O-CB 3.23Å; N832-S835 PolarHBondContact O-N 3.2Å; N833-S835 PolarHBondContact O-N 3.14Å; S835-E837 VanDerWaalsContact C-N 3.3Å; S835-E837 PolarHBondContact O-N 2.66Å; S835-K838 PolarHBondContact O-N 3.25Å; S835-T839 PolarHBondContact O-N 3.45Å
836	V	59.8	Low	66.6	Low	82 Å²	82	110.1 Å²	110.1	50%	0.497	60%	0.6	S	S	.	*	H	α-helix	trans	-63.1	-36.4	176.1	172.5	0	0	0	0	111.8	N832 N833 K838 T839 N840	N832-V836 WeakPolarHBondContact O-CG2 3.49Å; N832-V836 PolarHBondContact O-N 3.23Å; N833-V836 PolarHBondContact O-N 3.17Å; V836-K838 VanDerWaalsContact C-N 3.27Å; V836-K838 PolarHBondContact O-N 3.02Å; V836-T839 WeakPolarHBondContact CA-OG1 3.47Å; V836-T839 PolarHBondContact O-N 3.21Å; V836-T839 VanDerWaalsContact O-N 3.16Å; V836-T839 PolarHBondContact O-OG1 2.62Å; V836-N840 PolarHBondContact O-N 2.9Å
837	E	54.7	Low	65.5	Low	132 Å²	132	112.1 Å²	112.1	62%	0.617	60%	0.604	S	S	*	*	H	α-helix	trans	-64.4	-31.9	178.5	-159.9	166.1	-133.8	0	0	112.6	N833 S835 N840 T841	N833-E837 PolarHBondContact O-N 3.39Å; S835-E837 VanDerWaalsContact C-N 3.3Å; S835-E837 PolarHBondContact O-N 2.66Å; E837-N840 PolarHBondContact O-N 2.99Å; E837-T841 PolarHBondContact O-OG1 2.68Å
838	K	53.6	Low	64.2	Low	167 Å²	167	108.5 Å²	108.5	73%	0.726	60%	0.602	S	S	*	*	H	α-helix	trans	-76.8	-22.5	174.4	-70.8	-176.9	177.9	179.3	0	114.3	S835 V836 T841	S835-K838 PolarHBondContact O-N 3.25Å; V836-K838 VanDerWaalsContact C-N 3.27Å; V836-K838 PolarHBondContact O-N 3.02Å; K838-T841 PolarHBondContact O-OG1 3.33Å
839	T	53.4	Low	62.9	Low	105 Å²	105	109.9 Å²	109.9	64%	0.644	61%	0.611	S	S	*	*	H	α-helix	trans	-82.5	-14	172.8	44.7	0	0	0	0	113.4	S835 V836	S835-T839 PolarHBondContact O-N 3.45Å; V836-T839 WeakPolarHBondContact CA-OG1 3.47Å; V836-T839 PolarHBondContact O-N 3.21Å; V836-T839 VanDerWaalsContact O-N 3.16Å; V836-T839 PolarHBondContact O-OG1 2.62Å
840	N	52.1	Low	61.7	Low	125 Å²	125	113.4 Å²	113.4	67%	0.668	63%	0.626	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.3	15.4	177.5	-69.9	-17	0	0	0	113.4	V836 E837	V836-N840 PolarHBondContact O-N 2.9Å; E837-N840 PolarHBondContact O-N 2.99Å
841	T	53.1	Low	60.3	Low	109 Å²	109	114.8 Å²	114.8	67%	0.669	64%	0.636	S	S	*	*			trans	-129.5	34.2	-174.4	35.8	0	0	0	0	113.6	E837 K838	E837-T841 PolarHBondContact O-OG1 2.68Å; K838-T841 PolarHBondContact O-OG1 3.33Å
842	V	39.5	Very low	58.6	Low	201 Å²	201	118.6 Å²	118.6	100%	1.218	65%	0.654	S	S	*	*			trans	-133.5	0	171.1	-177.1	0	0	0	0	109.7

Retrieved 842 of 842 residues in 467.5 ms (Link to these results)

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