A0A096N592_PAPAN Loading...

Zinc finger and BTB domain-containing protein 20

May be a transcription factor that may be involved in hematopoiesis, oncogenesis, and immune responses. Plays a role in postnatal myogenesis, may be involved in the regulation of satellite cells self-renewal.

AlphaFold DB (A0A2K6D1B4), UniProt , Accession A0A096N592, Species PAPAN (Papio anubis, Olive baboon), Gene ZBTB20, Length 741 aa.

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	32.7	Very low	34	Very low	222 Å²	222	158.7 Å²	158.7	100%	1.094	78%	0.777	S	S	*	*				0	125.9	0	-62.3	-177.5	84.8	0	0	106
2	L	34.8	Very low	33.7	Very low	150 Å²	150	156.2 Å²	156.2	79%	0.785	77%	0.769	S	S	*	*				52.7	122.7	90	-59	163.3	0	0	0	111.1
3	E	32.3	Very low	33.6	Very low	129 Å²	129	158.5 Å²	158.5	60%	0.603	78%	0.777	S	S	*	*			cis	-155	177.3	12	-136.1	-157.4	138.5	0	0	115.4
4	R	35.7	Very low	33.5	Very low	200 Å²	200	161.4 Å²	161.4	76%	0.755	78%	0.783	S	S	*	*			trans	-51.7	153.4	174.5	-49.7	154.7	176.5	136.4	-15.1	113.9
5	K	34.1	Very low	33.1	Very low	194 Å²	194	156 Å²	156	84%	0.843	78%	0.776	S	S	*	*				179.6	141.7	113	-96.3	154.6	-174	167.6	0	115.9
6	K	32.3	Very low	32.9	Very low	196 Å²	196	152.9 Å²	152.9	85%	0.852	77%	0.773	S	S	*	*			trans	-119.2	179.6	154.4	-121.6	-177.6	-179.1	174.5	0	105.4
7	P	48.8	Very low	32.6	Very low	97 Å²	97	155.8 Å²	155.8	63%	0.63	78%	0.784	S	S	*	*			cis	-135.4	-160	-18.6	30.6	-6.3	0	0	0	112.6
8	K	32.2	Very low	32.4	Very low	187 Å²	187	157.1 Å²	157.1	81%	0.813	79%	0.786	S	S	*	*			trans	76.2	158.4	167.1	-50.8	-177.2	178.3	-178	0	115
9	T	28.8	Very low	32.1	Very low	132 Å²	132	155.6 Å²	155.6	81%	0.81	78%	0.781	S	S	*	*			cis	-151.8	-178.9	13.6	-21.3	0	0	0	0	107.8
10	A	31	Very low	31.8	Very low	68 Å²	68	155.1 Å²	155.1	56%	0.562	78%	0.776	S	S	*	*			cis	-164.1	171.3	4.6	0	0	0	0	0	112.4
11	E	31.6	Very low	31.7	Very low	171 Å²	171	154.3 Å²	154.3	80%	0.799	77%	0.773	S	S	*	*			trans	65.7	151.9	136.6	-85.6	-170.9	97	0	0	123.5
12	N	29.8	Very low	31.4	Very low	128 Å²	128	150.1 Å²	150.1	68%	0.684	76%	0.761	S	S	*	*			cis	-160.9	178.4	-14.7	-152	-23.4	0	0	0	111.5
13	Q	32.5	Very low	31.1	Very low	187 Å²	187	151.3 Å²	151.3	87%	0.874	76%	0.762	S	S	*	*			trans	113.1	158.3	161.6	-57.7	-166	7.5	0	0	117.8
14	K	32.6	Very low	31.8	Very low	198 Å²	198	150.9 Å²	150.9	86%	0.861	77%	0.77	S	S	*	*			trans	-156	158.7	-136.3	175.5	-174.6	171.1	-168.6	0	113.9
15	A	27.9	Very low	31.3	Very low	81 Å²	81	145.3 Å²	145.3	67%	0.669	78%	0.776	S	S	*	*			trans	85.3	135.7	167.2	0	0	0	0	0	116.5
16	S	28.9	Very low	30.9	Very low	106 Å²	106	139.4 Å²	139.4	74%	0.741	77%	0.769	S	S	*	*			cis	92.3	108.2	8.9	87.9	0	0	0	0	118.6
17	E	27.5	Very low	30.8	Very low	202 Å²	202	136.1 Å²	136.1	94%	0.944	77%	0.771	S	S	*	*			trans	-158.9	161.8	152.2	-115.9	169.5	138.2	0	0	110.7
18	E	29.3	Very low	29.8	Very low	179 Å²	179	136.8 Å²	136.8	84%	0.836	78%	0.778	S	S	*	*			trans	-136.2	176.1	-169.3	-64.9	178.6	89.7	0	0	112
19	N	27.5	Very low	29.5	Very low	129 Å²	129	132.6 Å²	132.6	69%	0.69	78%	0.778	S	S	*	*			trans	69.4	159.5	161.4	-72.3	12.6	0	0	0	118.3
20	E	26.6	Very low	29.4	Very low	146 Å²	146	135.8 Å²	135.8	68%	0.682	78%	0.781	S	S	*	*			cis	-153.5	154.8	-7.1	-124.8	170.1	111.5	0	0	114
21	I	28.2	Very low	29.9	Very low	138 Å²	138	138.7 Å²	138.7	71%	0.708	79%	0.794	S	S	*	*			trans	19.4	133.4	145.7	-63.1	166.8	0	0	0	121.4
22	T	26.6	Very low	29.6	Very low	135 Å²	135	134.1 Å²	134.1	83%	0.828	79%	0.793	S	S	*	*				-178.6	155.2	116.5	-66.1	0	0	0	0	112.6
23	Q	29.1	Very low	29.6	Very low	174 Å²	174	135.7 Å²	135.7	81%	0.813	80%	0.801	S	S	*	*			trans	-106.9	-162.1	-178.4	-64.5	-165.3	7.3	0	0	111.5
24	P	46.1	Very low	29.9	Very low	120 Å²	120	132.7 Å²	132.7	78%	0.779	80%	0.797	S	S	*	*			cis	-146.5	173.2	2.1	44.2	-23.9	0	0	0	120.4
25	G	25.1	Very low	29.5	Very low	84 Å²	84	128 Å²	128	87%	0.866	79%	0.788	S	S	*	*			trans	101.7	136.3	150.6	0	0	0	0	0	117.9
26	G	26.4	Very low	29.4	Very low	69 Å²	69	131.3 Å²	131.3	71%	0.711	79%	0.794	S	S	*	*			cis	173	139.9	-11.4	0	0	0	0	0	115.5
27	S	29.8	Very low	29.1	Very low	128 Å²	128	132.3 Å²	132.3	90%	0.895	79%	0.791	S	S	*	*			trans	69.9	151.4	171	86	0	0	0	0	117.3
28	S	27.4	Very low	29	Very low	111 Å²	111	132 Å²	132	78%	0.776	79%	0.787	S	S	*	*			cis	-150.2	164.4	2.7	69.8	0	0	0	0	113.7
29	A	27.1	Very low	28.7	Very low	99 Å²	99	131.6 Å²	131.6	82%	0.818	79%	0.785	S	S	*	*			trans	74	138.7	162.1	0	0	0	0	0	122.1
30	K	25.9	Very low	28.6	Very low	199 Å²	199	130.3 Å²	130.3	87%	0.865	79%	0.792	S	S	*	*			trans	-158.5	-175	175	-82	-172.8	177.6	-179.4	0	105.9
31	P	42	Very low	28.5	Very low	128 Å²	128	129.5 Å²	129.5	83%	0.831	80%	0.797	S	S	*	*			cis	-119.3	-172.2	-16.8	12.3	14.6	0	0	0	111.3
32	G	25.4	Very low	28.3	Very low	75 Å²	75	131 Å²	131	77%	0.773	81%	0.805	S	S	*	*			cis	179.3	169.3	-3.8	0	0	0	0	0	115.3
33	L	29	Very low	28.4	Very low	162 Å²	162	129.8 Å²	129.8	85%	0.848	80%	0.802	S	S	*	*			trans	-95.7	-179.1	169.7	-87.3	167.4	0	0	0	108.7
34	P	40.4	Very low	28.6	Very low	123 Å²	123	127.6 Å²	127.6	80%	0.799	80%	0.803	S	S	*	*			cis	-149.8	-155.1	33.8	45.2	-21.9	0	0	0	116.9
35	C	22.5	Very low	27.6	Very low	100 Å²	100	129.2 Å²	129.2	68%	0.676	81%	0.805	S	S	*	*			trans	-129.2	170.7	-169	-48.8	0	0	0	0	112.8
36	L	26	Very low	28.4	Very low	150 Å²	150	130.5 Å²	130.5	79%	0.785	80%	0.799	S	S	*	*			trans	83	135.3	155.3	-63.5	167.2	0	0	0	121.3
37	N	23.6	Very low	28.4	Very low	128 Å²	128	131 Å²	131	68%	0.684	80%	0.796	S	S	*	*			trans	54.1	132.6	148	-54	0.7	0	0	0	119.6
38	F	24.8	Very low	28.2	Very low	195 Å²	195	132.1 Å²	132.1	86%	0.855	79%	0.791	S	S	*	*				-161	-178.8	64.4	-120.6	-87.6	0	0	0	113.9
39	E	23.9	Very low	28.1	Very low	171 Å²	171	132.7 Å²	132.7	80%	0.799	78%	0.784	S	S	*	*			trans	-74.6	154.3	175.5	-61	176.6	92.6	0	0	114.9
40	A	24.3	Very low	28	Very low	102 Å²	102	136.2 Å²	136.2	84%	0.843	78%	0.783	S	S	*	*			trans	-157.7	146.9	149.5	0	0	0	0	0	110.8
41	V	25.7	Very low	27.9	Very low	128 Å²	128	130.3 Å²	130.3	78%	0.776	77%	0.767	S	S	*	*			trans	-112.6	135.5	176.5	176.8	0	0	0	0	109.5
42	L	23.7	Very low	27.1	Very low	170 Å²	170	129.3 Å²	129.3	89%	0.89	76%	0.759	S	S	*	*			trans	163.3	140	140.3	-89.3	161.4	0	0	0	111.8
43	S	28	Very low	27.2	Very low	109 Å²	109	133.7 Å²	133.7	76%	0.762	76%	0.759	S	S	*	*			trans	-87.8	159.2	166.3	-40	0	0	0	0	110.1
44	P	34.3	Very low	26.9	Very low	128 Å²	128	131 Å²	131	83%	0.831	75%	0.753	S	S	*	*				-148.9	168.7	76.2	39.9	-21.4	0	0	0	117.3
45	D	24.2	Very low	26.3	Very low	154 Å²	154	133 Å²	133	82%	0.824	76%	0.757	S	S	*	*			trans	-71.6	175.8	160.4	-100.4	-55.4	0	0	0	111.9
46	P	42.2	Very low	26.3	Very low	112 Å²	112	135.1 Å²	135.1	73%	0.727	77%	0.767	S	S	*	*			cis	-138.8	-165.8	12.2	41.7	-22.3	0	0	0	116.3
47	A	26	Very low	26.5	Very low	80 Å²	80	135.7 Å²	135.7	66%	0.661	77%	0.77	S	S	*	*			trans	78.8	147.8	147.7	0	0	0	0	0	120.2
48	L	25.7	Very low	26.6	Very low	150 Å²	150	133.8 Å²	133.8	79%	0.785	77%	0.767	S	S	*	*			cis	-161.5	146.5	-10.8	-103.1	166.8	0	0	0	111.2
49	I	25.8	Very low	26.7	Very low	123 Å²	123	133.3 Å²	133.3	63%	0.631	77%	0.767	S	S	*	*			trans	47.5	122.3	146.8	-65.8	173.3	0	0	0	122.2
50	H	24.4	Very low	26.8	Very low	173 Å²	173	128.6 Å²	128.6	80%	0.801	76%	0.758	S	S	*	*				-158.5	132.6	112.3	-117.6	-100.8	0	0	0	107.7
51	S	24	Very low	26.9	Very low	76 Å²	76	132.4 Å²	132.4	53%	0.531	76%	0.758	S	S	.	*			cis	65.9	129.6	46.4	-63.8	0	0	0	0	113.5
52	T	25.2	Very low	27	Very low	106 Å²	106	132.5 Å²	132.5	65%	0.65	76%	0.759	S	S	*	*			cis	-155.7	-171.8	-6.3	20.8	0	0	0	0	106.6
53	H	26.9	Very low	27	Very low	167 Å²	167	128 Å²	128	77%	0.773	75%	0.753	S	S	*	*			cis	-155.7	-174.6	20.5	-89.5	-68.5	0	0	0	107
54	S	23.4	Very low	26.9	Very low	105 Å²	105	128.1 Å²	128.1	73%	0.734	75%	0.754	S	S	*	*			cis	179.4	159.8	-33.9	-176.5	0	0	0	0	107.5
55	L	27.3	Very low	26.5	Very low	166 Å²	166	126.2 Å²	126.2	87%	0.869	74%	0.744	S	S	*	*			trans	-71.1	155.1	176.4	-67.9	138.2	0	0	0	113.2
56	T	23.6	Very low	26.5	Very low	145 Å²	145	125.9 Å²	125.9	89%	0.89	74%	0.742	S	S	*	*			trans	-93.4	145.5	162.4	47.6	0	0	0	0	111.4
57	N	29	Very low	25.6	Very low	161 Å²	161	126.5 Å²	126.5	86%	0.861	75%	0.748	S	S	*	*			trans	-150.7	154.1	-178.9	-174.3	20.5	0	0	0	110
58	S	26.8	Very low	25.5	Very low	88 Å²	88	130.1 Å²	130.1	62%	0.615	76%	0.756	S	S	*	*			trans	-167.1	138.5	178.8	54.9	0	0	0	0	108.9
59	H	26.1	Very low	26	Very low	185 Å²	185	131.2 Å²	131.2	86%	0.856	76%	0.761	S	S	*	*			cis	-148.9	170.4	8.6	-86.1	-69.5	0	0	0	108
60	A	26.1	Very low	25.8	Very low	73 Å²	73	130.4 Å²	130.4	60%	0.603	77%	0.766	S	S	*	*			cis	-169.7	161	-25.3	0	0	0	0	0	110.9
61	H	26.2	Very low	26	Very low	181 Å²	181	128.2 Å²	128.2	84%	0.838	77%	0.769	S	S	*	*			trans	-14.4	162.3	161.9	-49.8	-82.4	0	0	0	121
62	T	27.6	Very low	26.1	Very low	130 Å²	130	134.5 Å²	134.5	80%	0.798	79%	0.787	S	S	*	*			cis	-146.3	163.7	20.2	49.2	0	0	0	0	111.8
63	G	24.7	Very low	26	Very low	75 Å²	75	132.8 Å²	132.8	77%	0.773	79%	0.79	S	S	*	*			cis	123.7	90.2	-5.1	0	0	0	0	0	116.2
64	S	25.2	Very low	25.9	Very low	112 Å²	112	129.8 Å²	129.8	78%	0.783	78%	0.778	S	S	*	*			trans	-165.9	108	156.6	-136.1	0	0	0	0	107.4
65	S	26.4	Very low	26.2	Very low	89 Å²	89	130.4 Å²	130.4	62%	0.622	78%	0.777	S	S	*	*				61.4	119	96.5	72.3	0	0	0	0	113.1
66	D	23.6	Very low	26.2	Very low	146 Å²	146	130.3 Å²	130.3	78%	0.781	77%	0.772	S	S	*	*			cis	-143.1	159.4	28	-85.3	-53.5	0	0	0	116.4
67	C	24.4	Very low	26.6	Very low	126 Å²	126	133.6 Å²	133.6	85%	0.851	77%	0.768	S	S	*	*			trans	47.5	96.3	153	-63.7	0	0	0	0	119.8
68	D	24	Very low	26.8	Very low	156 Å²	156	130.9 Å²	130.9	83%	0.834	75%	0.753	S	S	*	*			trans	-136.6	138.3	162.7	-146.5	-20.3	0	0	0	111.4
69	I	34.7	Very low	27.6	Very low	172 Å²	172	132.9 Å²	132.9	88%	0.882	75%	0.752	S	S	*	*			trans	-118.2	94.1	-180	-60	176.9	0	0	0	107.9
70	S	23.1	Very low	28.1	Very low	106 Å²	106	127.4 Å²	127.4	74%	0.741	73%	0.734	S	S	*	*			trans	-154	163	174.1	-161.6	0	0	0	0	113.5
71	C	28.3	Very low	28.8	Very low	128 Å²	128	125.5 Å²	125.5	87%	0.865	71%	0.714	S	S	*	*			trans	-67.1	137.3	-167.3	-60.7	0	0	0	0	113.9
72	K	25.9	Very low	29.6	Very low	208 Å²	208	120.3 Å²	120.3	90%	0.904	69%	0.692	S	S	*	*			trans	-99	115	168	-72.5	-178.8	177.3	176	0	111.4
73	G	22.7	Very low	30.4	Very low	69 Å²	69	115.6 Å²	115.6	71%	0.711	66%	0.662	S	S	*	*			trans	-79	-175.5	145.7	0	0	0	0	0	109.9
74	M	25	Very low	31.2	Very low	105 Å²	105	118.7 Å²	118.7	52%	0.517	66%	0.656	S	S	.	*			cis	-161.3	145.1	-7.6	-152.5	-171.5	-79.9	0	0	103.2	H102	M74-H102 HydrophobicContact CE-CB 3.74Å
75	T	29.8	Very low	32.1	Very low	117 Å²	117	119.5 Å²	119.5	72%	0.718	65%	0.652	S	S	*	*				-166.3	-169.7	60.4	45.5	0	0	0	0	110.4
76	E	26.2	Very low	33	Very low	164 Å²	164	117 Å²	117	77%	0.766	63%	0.629	S	S	*	*			trans	64.8	90.8	169.6	-62.6	-161.6	169.6	0	0	119.5
77	R	32.5	Very low	34.2	Very low	215 Å²	215	112.9 Å²	112.9	81%	0.811	61%	0.612	S	S	*	*				-164.1	148.2	94.4	-108.4	159.3	-72.7	-177.1	-3.9	115.5	H79	R77-H79 PolarHBondContact O-N 2.9Å; R77-H79 PolarHBondContact O-ND1 2.99Å
78	I	34.5	Very low	35.2	Very low	104 Å²	104	111.5 Å²	111.5	53%	0.533	60%	0.596	S	S	.	*			trans	-45	118.4	177.3	-59.8	160	0	0	0	111.2
79	H	43.1	Very low	36.3	Very low	129 Å²	129	107.5 Å²	107.5	60%	0.597	58%	0.581	S	S	*	*			trans	-90.6	105.6	171.2	-75.8	45.5	0	0	0	109.7	R77 I81	R77-H79 PolarHBondContact O-N 2.9Å; R77-H79 PolarHBondContact O-ND1 2.99Å; H79-I81 HydrophobicContact CB-CD1 4.4Å; H79-I81 HydrophobicContact CB-CG1 3.93Å; H79-I81 PolarHBondContact O-N 3.11Å
80	S	36	Very low	37.2	Very low	70 Å²	70	101.4 Å²	101.4	49%	0.49	55%	0.551	S	S	.	*			trans	-75.8	72.2	172.1	58	0	0	0	0	110.8	N82	S80-N82 PolarHBondContact O-N 3.05Å
81	I	41.8	Very low	38.6	Very low	34 Å²	34	97 Å²	97	17%	0.174	52%	0.519	C	S	.	.			trans	-71.2	111.4	-177.9	-49.4	176.7	0	0	0	109.3	H79 L83 F86 V90 V106	H79-I81 HydrophobicContact CB-CD1 4.4Å; H79-I81 HydrophobicContact CB-CG1 3.93Å; H79-I81 PolarHBondContact O-N 3.11Å; I81-L83 PolarHBondContact O-N 3.49Å; I81-F86 HydrophobicContact CB-CD2 4.12Å; I81-F86 HydrophobicContact CB-CE2 3.98Å; I81-F86 HydrophobicContact CD1-CE2 3.91Å; I81-F86 HydrophobicContact CD1-CZ 4.44Å; I81-F86 HydrophobicContact CG2-CD2 3.5Å; I81-F86 VanDerWaalsContact CG2-CD2 3.5Å; I81-F86 HydrophobicContact CG2-CE2 3.8Å; I81-V90 HydrophobicContact CD1-CG1 4.37Å; I81-V106 HydrophobicContact CD1-CG1 4.18Å
82	N	41.8	Very low	39.8	Very low	71 Å²	71	97 Å²	97	38%	0.38	51%	0.507	S	S	.	.			trans	-65	122.6	168.9	-89.9	-77.8	0	0	0	109.4	S80 H84 N85 H111	S80-N82 PolarHBondContact O-N 3.05Å; N82-H84 PolarHBondContact O-N 2.96Å; N82-N85 PolarHBondContact O-N 2.92Å; N82-H111 PolarHBondContact OD1-CD2 2.84Å; N82-H111 VanDerWaalsContact OD1-CD2 3.31Å; N82-H111 VanDerWaalsContact OD1-CG 3.25Å
83	L	45.1	Very low	41.2	Very low	31 Å²	31	90.7 Å²	90.7	16%	0.162	49%	0.486	C	S	.	.	G	3₁₀ helix	trans	-62.6	-18.4	-171.1	-138.7	83.6	0	0	0	114.1	I81 N85 F86 V108 M114	I81-L83 PolarHBondContact O-N 3.49Å; L83-N85 PolarHBondContact O-N 3.21Å; L83-F86 HydrophobicContact CD1-CB 4.19Å; L83-F86 HydrophobicContact CD1-CD2 3.5Å; L83-F86 VanDerWaalsContact CD1-CD2 3.5Å; L83-F86 HydrophobicContact CD1-CE2 4.03Å; L83-F86 HydrophobicContact CD1-CG 3.93Å; L83-F86 HydrophobicContact CG-CB 3.97Å; L83-F86 HydrophobicContact CG-CD2 4.21Å; L83-F86 HydrophobicContact CG-CG 4.27Å; L83-F86 WeakPolarHBondContact O-CB 3.4Å; L83-F86 PolarHBondContact O-N 3.14Å; L83-V108 HydrophobicContact CD1-CG1 4.03Å; L83-M114 HydrophobicContact CB-CE 4.42Å; L83-M114 HydrophobicContact CB-SD 3.87Å; L83-M114 HydrophobicContact CD2-CE 3.63Å; L83-M114 HydrophobicContact CD2-SD 3.7Å; L83-M114 HydrophobicContact CG-SD 4.42Å
84	H	40.7	Very low	42.6	Very low	141 Å²	141	88.4 Å²	88.4	65%	0.653	46%	0.457	S	S	*	.	G	3₁₀ helix	trans	-61.5	-19.9	172.7	-154.5	-40.8	0	0	0	113.5	N82	N82-H84 PolarHBondContact O-N 2.96Å
85	N	44	Very low	43.8	Very low	129 Å²	129	86 Å²	86	69%	0.69	45%	0.446	S	S	*	.	G	3₁₀ helix	trans	-112.1	19.1	173.9	-80.9	-8.9	0	0	0	113	N82 L83 S87	N82-N85 PolarHBondContact O-N 2.92Å; L83-N85 PolarHBondContact O-N 3.21Å; N85-S87 PolarHBondContact O-N 3.27Å
86	F	46	Very low	45	Very low	35 Å²	35	84.1 Å²	84.1	15%	0.154	43%	0.429	C	S	.	.			trans	-79.2	66.3	177.3	-134.2	-82.6	0	0	0	111.1	I81 L83 L91 L94 V108 L154	I81-F86 HydrophobicContact CB-CD2 4.12Å; I81-F86 HydrophobicContact CB-CE2 3.98Å; I81-F86 HydrophobicContact CD1-CE2 3.91Å; I81-F86 HydrophobicContact CD1-CZ 4.44Å; I81-F86 HydrophobicContact CG2-CD2 3.5Å; I81-F86 VanDerWaalsContact CG2-CD2 3.5Å; I81-F86 HydrophobicContact CG2-CE2 3.8Å; L83-F86 HydrophobicContact CD1-CB 4.19Å; L83-F86 HydrophobicContact CD1-CD2 3.5Å; L83-F86 VanDerWaalsContact CD1-CD2 3.5Å; L83-F86 HydrophobicContact CD1-CE2 4.03Å; L83-F86 HydrophobicContact CD1-CG 3.93Å; L83-F86 HydrophobicContact CG-CB 3.97Å; L83-F86 HydrophobicContact CG-CD2 4.21Å; L83-F86 HydrophobicContact CG-CG 4.27Å; L83-F86 WeakPolarHBondContact O-CB 3.4Å; L83-F86 PolarHBondContact O-N 3.14Å; F86-L91 HydrophobicContact CD1-CD1 4.49Å; F86-L91 HydrophobicContact CE1-CD1 3.96Å; F86-L94 HydrophobicContact CZ-CD1 4.41Å; F86-V108 HydrophobicContact CE2-CG1 3.99Å; F86-V108 HydrophobicContact CE2-CG2 3.91Å; F86-V108 HydrophobicContact CZ-CG2 4.18Å; F86-L154 HydrophobicContact CE1-CD1 3.79Å; F86-L154 HydrophobicContact CZ-CD1 3.97Å
87	S	48.8	Very low	46.1	Very low	60 Å²	60	79.2 Å²	79.2	42%	0.42	41%	0.406	S	S	.	.			trans	-73.3	160.8	-176.8	75.5	0	0	0	0	112.5	N85 S89 V90 L91	N85-S87 PolarHBondContact O-N 3.27Å; S87-S89 PolarHBondContact O-N 3.45Å; S87-S89 VanDerWaalsContact O-N 3.15Å; S87-S89 PolarHBondContact OG-N 3.38Å; S87-V90 WeakPolarHBondContact O-CB 3.43Å; S87-V90 PolarHBondContact O-N 2.91Å; S87-L91 PolarHBondContact O-N 3.42Å
88	N	45	Very low	46.8	Very low	97 Å²	97	73.7 Å²	73.7	52%	0.519	39%	0.386	S	S	.	.	H	α-helix	trans	-57	-29.3	174.8	-72.8	-36.4	0	0	0	112.5	L91 E92	N88-L91 CarbonylContact O-C 3.55Å; N88-L91 WeakPolarHBondContact O-CB 3.39Å; N88-L91 PolarHBondContact O-N 2.98Å; N88-E92 WeakPolarHBondContact O-CB 3.5Å; N88-E92 PolarHBondContact O-N 2.77Å
89	S	48.2	Very low	47.6	Very low	73 Å²	73	73.4 Å²	73.4	51%	0.51	39%	0.385	S	S	.	.	H	α-helix	trans	-68.4	-34.7	176	176.1	0	0	0	0	113	S87 L91 T93	S87-S89 PolarHBondContact O-N 3.45Å; S87-S89 VanDerWaalsContact O-N 3.15Å; S87-S89 PolarHBondContact OG-N 3.38Å; S89-L91 VanDerWaalsContact C-N 3.33Å; S89-T93 WeakPolarHBondContact O-CB 3.31Å; S89-T93 PolarHBondContact O-N 3.09Å; S89-T93 PolarHBondContact O-OG1 2.8Å
90	V	52.1	Low	47.9	Very low	43 Å²	43	74.2 Å²	74.2	26%	0.261	38%	0.383	S	S	.	.	H	α-helix	trans	-66.4	-41.1	170.7	178.7	0	0	0	0	109.9	I81 S87 T93 L94	I81-V90 HydrophobicContact CD1-CG1 4.37Å; S87-V90 WeakPolarHBondContact O-CB 3.43Å; S87-V90 PolarHBondContact O-N 2.91Å; V90-T93 PolarHBondContact O-N 3.01Å; V90-L94 HydrophobicContact CG1-CD1 4.39Å; V90-L94 WeakPolarHBondContact O-CG 3.29Å; V90-L94 PolarHBondContact O-N 3.26Å
91	L	54.3	Low	48.2	Very low	13 Å²	13	73.4 Å²	73.4	7%	0.068	39%	0.386	C	S	.	.	H	α-helix	trans	-67.7	-38.7	178.7	-153.8	72.8	0	0	0	112.3	F86 S87 N88 S89 L94 N95 K153 F157	F86-L91 HydrophobicContact CD1-CD1 4.49Å; F86-L91 HydrophobicContact CE1-CD1 3.96Å; S87-L91 PolarHBondContact O-N 3.42Å; N88-L91 CarbonylContact O-C 3.55Å; N88-L91 WeakPolarHBondContact O-CB 3.39Å; N88-L91 PolarHBondContact O-N 2.98Å; S89-L91 VanDerWaalsContact C-N 3.33Å; L91-L94 PolarHBondContact O-N 2.91Å; L91-N95 VanDerWaalsContact O-CB 3.25Å; L91-N95 WeakPolarHBondContact O-CB 3.32Å; L91-N95 PolarHBondContact O-N 2.97Å; L91-K153 HydrophobicContact CD2-CB 3.81Å; L91-K153 HydrophobicContact CD2-CD 3.8Å; L91-K153 HydrophobicContact CD2-CG 4.47Å; L91-F157 HydrophobicContact CD1-CD2 4.05Å; L91-F157 HydrophobicContact CD1-CE2 4.09Å; L91-F157 HydrophobicContact CG-CD2 4.48Å; L91-F157 HydrophobicContact CG-CE2 4.05Å
92	E	53.3	Low	48.3	Very low	130 Å²	130	76 Å²	76	61%	0.607	40%	0.397	S	S	*	.	H	α-helix	trans	-64	-42.2	169.6	-82.1	178	138.5	0	0	111.4	N88 L94 N95 E96	N88-E92 WeakPolarHBondContact O-CB 3.5Å; N88-E92 PolarHBondContact O-N 2.77Å; E92-L94 VanDerWaalsContact C-N 3.31Å; E92-L94 PolarHBondContact O-N 3.39Å; E92-N95 CarbonylContact O-C 3.51Å; E92-N95 WeakPolarHBondContact O-CB 3.32Å; E92-N95 PolarHBondContact O-N 3.16Å; E92-E96 WeakPolarHBondContact O-CB 3.34Å; E92-E96 PolarHBondContact O-N 3.29Å
93	T	54.7	Low	48.2	Very low	74 Å²	74	80.4 Å²	80.4	45%	0.454	41%	0.413	S	S	.	.	H	α-helix	trans	-61.1	-40.7	176.1	-56.8	0	0	0	0	111.3	S89 V90 E96 Q97	S89-T93 WeakPolarHBondContact O-CB 3.31Å; S89-T93 PolarHBondContact O-N 3.09Å; S89-T93 PolarHBondContact O-OG1 2.8Å; V90-T93 PolarHBondContact O-N 3.01Å; T93-E96 PolarHBondContact O-N 3.16Å; T93-Q97 WeakPolarHBondContact O-CG 3.49Å; T93-Q97 PolarHBondContact O-N 3.48Å
94	L	52.3	Low	48.1	Very low	21 Å²	21	81.1 Å²	81.1	11%	0.11	42%	0.42	C	S	.	.	H	α-helix	trans	-69.1	-39.8	174.3	-67.5	170.5	0	0	0	112.6	F86 V90 L91 E92 E96 Q97 R98 V106	F86-L94 HydrophobicContact CZ-CD1 4.41Å; V90-L94 HydrophobicContact CG1-CD1 4.39Å; V90-L94 WeakPolarHBondContact O-CG 3.29Å; V90-L94 PolarHBondContact O-N 3.26Å; L91-L94 PolarHBondContact O-N 2.91Å; E92-L94 VanDerWaalsContact C-N 3.31Å; E92-L94 PolarHBondContact O-N 3.39Å; L94-E96 VanDerWaalsContact C-N 3.27Å; L94-E96 PolarHBondContact O-N 2.63Å; L94-Q97 PolarHBondContact O-N 3.39Å; L94-R98 WeakPolarHBondContact O-CB 3.19Å; L94-R98 PolarHBondContact O-N 2.78Å; L94-V106 HydrophobicContact CD2-CG2 4.12Å
95	N	50.1	Low	47.8	Very low	55 Å²	55	78.6 Å²	78.6	29%	0.294	41%	0.411	S	S	.	.	H	α-helix	trans	-59.8	-38.7	172.7	-173.8	86.4	0	0	0	111.8	L91 E92 R98 N99 F157	L91-N95 VanDerWaalsContact O-CB 3.25Å; L91-N95 WeakPolarHBondContact O-CB 3.32Å; L91-N95 PolarHBondContact O-N 2.97Å; E92-N95 CarbonylContact O-C 3.51Å; E92-N95 WeakPolarHBondContact O-CB 3.32Å; E92-N95 PolarHBondContact O-N 3.16Å; N95-R98 VanDerWaalsContact CG-NH2 3.3Å; N95-R98 WeakPolarHBondContact O-CB 3.01Å; N95-R98 VanDerWaalsContact OD1-CZ 3.22Å; N95-R98 PolarHBondContact OD1-NH1 3.26Å; N95-R98 PolarHBondContact OD1-NH2 3.35Å; N95-N99 PolarHBondContact O-N 3.18Å; N95-N99 PolarHBondContact O-ND2 3.42Å; N95-N99 PolarHBondContact O-OD1 3.15Å; N95-F157 HydrophobicContact CB-CZ 3.86Å
96	E	53.7	Low	47.7	Very low	77 Å²	77	73.2 Å²	73.2	36%	0.36	38%	0.383	S	S	.	.	H	α-helix	trans	-73.3	-41.4	179.4	-176.2	77.6	167.4	0	0	111.9	E92 T93 L94 N99 R100	E92-E96 WeakPolarHBondContact O-CB 3.34Å; E92-E96 PolarHBondContact O-N 3.29Å; T93-E96 PolarHBondContact O-N 3.16Å; L94-E96 VanDerWaalsContact C-N 3.27Å; L94-E96 PolarHBondContact O-N 2.63Å; E96-N99 PolarHBondContact O-N 3.2Å; E96-R100 PolarHBondContact O-N 2.8Å; E96-R100 IonicContact OE1-CZ 3.93Å; E96-R100 IonicContact OE1-NH1 3.3Å; E96-R100 PolarHBondContact OE1-NH1 2.88Å; E96-R100 IonicContact OE1-NH2 3.6Å; E96-R100 PolarHBondContact OE1-NH2 3.38Å
97	Q	49.8	Very low	47.4	Very low	61 Å²	61	73.7 Å²	73.7	29%	0.285	39%	0.389	S	S	.	.	H	α-helix	trans	-66.6	-36.1	172	-64.9	-57.4	-24.1	0	0	112.2	T93 L94 R100 G101 H102	T93-Q97 WeakPolarHBondContact O-CG 3.49Å; T93-Q97 PolarHBondContact O-N 3.48Å; L94-Q97 PolarHBondContact O-N 3.39Å; Q97-R100 CarbonylContact O-C 3.54Å; Q97-R100 PolarHBondContact O-N 3.37Å; Q97-G101 PolarHBondContact O-N 3.31Å; Q97-H102 PolarHBondContact O-N 2.83Å; Q97-H102 PolarHBondContact OE1-CD2 3.12Å
98	R	47.3	Very low	47.1	Very low	100 Å²	100	71.2 Å²	71.2	38%	0.377	37%	0.372	S	S	.	.	H	α-helix	trans	-59.3	-46.7	169.1	-175.8	-157.1	66.7	-137.8	-9.1	110.9	L94 N95 R100 G101 V162	L94-R98 WeakPolarHBondContact O-CB 3.19Å; L94-R98 PolarHBondContact O-N 2.78Å; N95-R98 VanDerWaalsContact CG-NH2 3.3Å; N95-R98 WeakPolarHBondContact O-CB 3.01Å; N95-R98 VanDerWaalsContact OD1-CZ 3.22Å; N95-R98 PolarHBondContact OD1-NH1 3.26Å; N95-R98 PolarHBondContact OD1-NH2 3.35Å; R98-R100 PolarHBondContact O-N 3.41Å; R98-G101 PolarHBondContact O-N 3.46Å; R98-V162 HydrophobicContact CG-CG2 4.17Å
99	N	50.9	Low	46.9	Very low	97 Å²	97	74 Å²	74	52%	0.519	38%	0.375	S	S	.	.	H	α-helix	trans	-64.2	-23.4	177.5	-67.3	-10.2	0	0	0	113	N95 E96	N95-N99 PolarHBondContact O-N 3.18Å; N95-N99 PolarHBondContact O-ND2 3.42Å; N95-N99 PolarHBondContact O-OD1 3.15Å; E96-N99 PolarHBondContact O-N 3.2Å
100	R	50.7	Low	46.7	Very low	146 Å²	146	71.5 Å²	71.5	55%	0.551	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.5	6.1	171.8	-69.1	-174.5	173.7	102.1	23.2	114.2	E96 Q97 R98 H102	E96-R100 PolarHBondContact O-N 2.8Å; E96-R100 IonicContact OE1-CZ 3.93Å; E96-R100 IonicContact OE1-NH1 3.3Å; E96-R100 PolarHBondContact OE1-NH1 2.88Å; E96-R100 IonicContact OE1-NH2 3.6Å; E96-R100 PolarHBondContact OE1-NH2 3.38Å; Q97-R100 CarbonylContact O-C 3.54Å; Q97-R100 PolarHBondContact O-N 3.37Å; R98-R100 PolarHBondContact O-N 3.41Å; R100-H102 VanDerWaalsContact C-N 3.29Å; R100-H102 PolarHBondContact O-N 3.04Å
101	G	40.8	Very low	46.1	Very low	54 Å²	54	73.9 Å²	73.9	56%	0.557	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.4	19.5	177.2	0	0	0	0	0	114.7	Q97 R98	Q97-G101 PolarHBondContact O-N 3.31Å; R98-G101 PolarHBondContact O-N 3.46Å
102	H	45.9	Very low	45	Very low	88 Å²	88	75.2 Å²	75.2	41%	0.407	38%	0.381	S	S	.	.			trans	-96.7	105.4	-177.6	-71.1	-17.1	0	0	0	111.5	M74 Q97 R100 C104	M74-H102 HydrophobicContact CE-CB 3.74Å; Q97-H102 PolarHBondContact O-N 2.83Å; Q97-H102 PolarHBondContact OE1-CD2 3.12Å; R100-H102 VanDerWaalsContact C-N 3.29Å; R100-H102 PolarHBondContact O-N 3.04Å; H102-C104 VanDerWaalsContact C-N 3.32Å; H102-C104 PolarHBondContact O-N 3.31Å
103	F	38.5	Very low	44.3	Very low	163 Å²	163	72.8 Å²	72.8	72%	0.715	38%	0.378	S	S	*	.			trans	-73.3	81.5	172.9	-73.2	-82	0	0	0	111.3	D105	F103-D105 PolarHBondContact O-N 3.02Å
104	C	42.7	Very low	43.8	Very low	47 Å²	47	71.7 Å²	71.7	32%	0.318	37%	0.369	S	S	.	.			trans	-76.4	114.2	169.5	-60.6	0	0	0	0	110.1	H102 V106	H102-C104 VanDerWaalsContact C-N 3.32Å; H102-C104 PolarHBondContact O-N 3.31Å; C104-V106 VanDerWaalsContact C-N 3.35Å; C104-V106 HydrophobicContact CB-CG2 3.99Å; C104-V106 PolarHBondContact O-N 2.87Å
105	D	34	Very low	43.3	Very low	87 Å²	87	73.7 Å²	73.7	47%	0.465	38%	0.379	S	S	.	.			trans	-77.1	81.6	180	-154.9	-26.9	0	0	0	111.3	F103 T107 R164	F103-D105 PolarHBondContact O-N 3.02Å; D105-T107 PolarHBondContact O-N 2.85Å; D105-R164 WeakPolarHBondContact OD1-CB 3.37Å; D105-R164 WeakPolarHBondContact OD1-CD 3.38Å; D105-R164 IonicContact OD2-CZ 3.64Å; D105-R164 IonicContact OD2-NE 2.7Å; D105-R164 IonicContact OD2-NH1 2.7Å; D105-R164 PolarHBondContact OD2-NH1 2.98Å
106	V	43	Very low	42.8	Very low	16 Å²	16	79.7 Å²	79.7	10%	0.097	40%	0.397	C	S	.	.			trans	-93.3	97.5	-173.5	-178.2	0	0	0	0	111	I81 L94 C104 V108 L163	I81-V106 HydrophobicContact CD1-CG1 4.18Å; L94-V106 HydrophobicContact CD2-CG2 4.12Å; C104-V106 VanDerWaalsContact C-N 3.35Å; C104-V106 HydrophobicContact CB-CG2 3.99Å; C104-V106 PolarHBondContact O-N 2.87Å; V106-V108 HydrophobicContact CG1-CG2 3.98Å; V106-V108 PolarHBondContact O-N 3.23Å; V106-L163 HydrophobicContact CB-CD2 4.11Å; V106-L163 HydrophobicContact CG1-CD2 4.27Å
107	T	38.8	Very low	42.1	Very low	45 Å²	45	77.5 Å²	77.5	28%	0.276	39%	0.393	S	S	.	.			trans	-85.4	93	176	14.8	0	0	0	0	111.6	D105 R109 R164	D105-T107 PolarHBondContact O-N 2.85Å; T107-R109 PolarHBondContact O-N 3.17Å; T107-R164 VanDerWaalsContact CG2-O 3.29Å; T107-R164 WeakPolarHBondContact CG2-O 2.93Å
108	V	43.4	Very low	41.7	Very low	9 Å²	9	76.2 Å²	76.2	6%	0.055	39%	0.387	C	S	.	.			trans	-77.6	103.7	-179.8	-176.5	0	0	0	0	111.1	L83 F86 V106 L163	L83-V108 HydrophobicContact CD1-CG1 4.03Å; F86-V108 HydrophobicContact CE2-CG1 3.99Å; F86-V108 HydrophobicContact CE2-CG2 3.91Å; F86-V108 HydrophobicContact CZ-CG2 4.18Å; V106-V108 HydrophobicContact CG1-CG2 3.98Å; V106-V108 PolarHBondContact O-N 3.23Å; V108-L163 HydrophobicContact CG2-CD2 4.23Å
109	R	40.1	Very low	41.3	Very low	155 Å²	155	81.1 Å²	81.1	59%	0.585	41%	0.405	S	S	*	.			trans	-81.5	119.1	172.6	-71.8	-170.5	178	-167.4	0.1	112.1	T107 H111 E169	T107-R109 PolarHBondContact O-N 3.17Å; R109-H111 PolarHBondContact O-N 2.87Å; R109-E169 WeakPolarHBondContact CA-OE1 3.33Å
110	I	44.2	Very low	40.5	Very low	21 Å²	21	78.5 Å²	78.5	11%	0.108	39%	0.394	C	S	.	.			trans	-80.2	113.9	177.4	-65.6	174.1	0	0	0	110.1	M114 L115 I173	I110-M114 HydrophobicContact CD1-CE 4.41Å; I110-M114 HydrophobicContact CG2-CB 4.34Å; I110-M114 HydrophobicContact CG2-CE 3.85Å; I110-L115 HydrophobicContact CG2-CG 4.33Å; I110-I173 HydrophobicContact CD1-CD1 3.94Å; I110-I173 HydrophobicContact CD1-CG1 3.47Å; I110-I173 VanDerWaalsContact CD1-CG1 3.47Å
111	H	38.7	Very low	40.1	Very low	92 Å²	92	74 Å²	74	43%	0.426	38%	0.382	S	S	.	.			trans	-66.4	136.8	176	-88.9	-112.2	0	0	0	112	N82 R109 S113 M114	N82-H111 PolarHBondContact OD1-CD2 2.84Å; N82-H111 VanDerWaalsContact OD1-CD2 3.31Å; N82-H111 VanDerWaalsContact OD1-CG 3.25Å; R109-H111 PolarHBondContact O-N 2.87Å; H111-S113 PolarHBondContact O-N 3.23Å; H111-M114 PolarHBondContact O-N 3.06Å
112	G	32.9	Very low	39.9	Very low	42 Å²	42	76.7 Å²	76.7	43%	0.433	38%	0.384	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.3	12.5	-176.7	0	0	0	0	0	116.6
113	S	38.8	Very low	39.4	Very low	79 Å²	79	74.3 Å²	74.3	55%	0.552	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.6	-42.4	161.3	44.9	0	0	0	0	111	H111 R116 A117	H111-S113 PolarHBondContact O-N 3.23Å; S113-R116 WeakPolarHBondContact O-CA 3.49Å; S113-R116 WeakPolarHBondContact O-CB 3.46Å; S113-R116 PolarHBondContact O-N 3.44Å; S113-A117 PolarHBondContact O-N 2.93Å; S113-A117 VanDerWaalsContact O-N 3.14Å
114	M	43	Very low	39.4	Very low	51 Å²	51	68.4 Å²	68.4	25%	0.251	36%	0.36	S	S	.	.	H	α-helix	trans	-72.2	-34.7	-179.4	-156	176.2	77.1	0	0	112	L83 I110 H111 R116 A117 H118	L83-M114 HydrophobicContact CB-CE 4.42Å; L83-M114 HydrophobicContact CB-SD 3.87Å; L83-M114 HydrophobicContact CD2-CE 3.63Å; L83-M114 HydrophobicContact CD2-SD 3.7Å; L83-M114 HydrophobicContact CG-SD 4.42Å; I110-M114 HydrophobicContact CD1-CE 4.41Å; I110-M114 HydrophobicContact CG2-CB 4.34Å; I110-M114 HydrophobicContact CG2-CE 3.85Å; H111-M114 PolarHBondContact O-N 3.06Å; M114-R116 PolarHBondContact O-N 2.9Å; M114-A117 PolarHBondContact O-N 2.94Å; M114-H118 PolarHBondContact O-N 3.43Å
115	L	42.8	Very low	39.3	Very low	63 Å²	63	68.9 Å²	68.9	33%	0.33	37%	0.374	S	S	.	.	H	α-helix	trans	-65.8	-17	168.2	-61.7	174.3	0	0	0	113.1	I110 R119 Q172	I110-L115 HydrophobicContact CG2-CG 4.33Å; L115-R119 WeakPolarHBondContact O-CB 3.4Å; L115-R119 PolarHBondContact O-N 2.98Å; L115-Q172 HydrophobicContact CD2-CB 4.29Å; L115-Q172 HydrophobicContact CD2-CG 4.27Å
116	R	38.4	Very low	39.2	Very low	180 Å²	180	67.4 Å²	67.4	68%	0.679	37%	0.37	S	S	*	.	H	α-helix	trans	-80.1	-45.4	173.2	-153.9	173.3	-60	-129.8	-1.2	110.4	S113 M114 R119 C120	S113-R116 WeakPolarHBondContact O-CA 3.49Å; S113-R116 WeakPolarHBondContact O-CB 3.46Å; S113-R116 PolarHBondContact O-N 3.44Å; M114-R116 PolarHBondContact O-N 2.9Å; R116-R119 WeakPolarHBondContact O-CA 3.42Å; R116-R119 WeakPolarHBondContact O-CB 3.25Å; R116-R119 PolarHBondContact O-N 2.75Å; R116-R119 VanDerWaalsContact O-N 3.1Å; R116-C120 PolarHBondContact O-N 3.4Å
117	A	40	Very low	39	Very low	32 Å²	32	72.5 Å²	72.5	26%	0.264	40%	0.403	S	S	.	.	H	α-helix	trans	-60	-42.6	170.9	0	0	0	0	0	112.1	S113 M114 R119 C120 V121	S113-A117 PolarHBondContact O-N 2.93Å; S113-A117 VanDerWaalsContact O-N 3.14Å; M114-A117 PolarHBondContact O-N 2.94Å; A117-R119 VanDerWaalsContact C-N 3.3Å; A117-R119 PolarHBondContact O-N 3.18Å; A117-C120 VanDerWaalsContact O-CB 3.3Å; A117-C120 WeakPolarHBondContact O-CB 3.38Å; A117-C120 PolarHBondContact O-N 2.96Å; A117-C120 VanDerWaalsContact O-N 3.12Å; A117-V121 PolarHBondContact O-N 3.44Å
118	H	39.8	Very low	39.1	Very low	34 Å²	34	75 Å²	75	16%	0.157	41%	0.411	C	S	.	.	H	α-helix	trans	-65	-30	173	-94.8	-82.2	0	0	0	113.6	M114 L122 A176	M114-H118 PolarHBondContact O-N 3.43Å; H118-L122 WeakPolarHBondContact O-CB 3.13Å; H118-L122 WeakPolarHBondContact O-CG 3.37Å; H118-L122 PolarHBondContact O-N 2.49Å; H118-A176 VanDerWaalsContact CE1-CB 3.45Å; H118-A176 WeakPolarHBondContact CE1-CB 3.5Å
119	R	39	Very low	38.8	Very low	202 Å²	202	80.9 Å²	80.9	76%	0.762	44%	0.436	S	S	*	.	H	α-helix	trans	-70.8	-31.8	170.7	-91.5	-178.8	159.4	160.6	-3.5	113.2	L115 R116 A117 A123	L115-R119 WeakPolarHBondContact O-CB 3.4Å; L115-R119 PolarHBondContact O-N 2.98Å; R116-R119 WeakPolarHBondContact O-CA 3.42Å; R116-R119 WeakPolarHBondContact O-CB 3.25Å; R116-R119 PolarHBondContact O-N 2.75Å; R116-R119 VanDerWaalsContact O-N 3.1Å; A117-R119 VanDerWaalsContact C-N 3.3Å; A117-R119 PolarHBondContact O-N 3.18Å; R119-A123 PolarHBondContact O-N 2.82Å; R119-A123 VanDerWaalsContact O-N 3.14Å
120	C	34.3	Very low	38.9	Very low	42 Å²	42	79.8 Å²	79.8	28%	0.284	44%	0.437	S	S	.	.	H	α-helix	trans	-64.9	-50.1	168.8	-75.5	0	0	0	0	111.1	R116 A117 L122 A123 A124 D139	R116-C120 PolarHBondContact O-N 3.4Å; A117-C120 VanDerWaalsContact O-CB 3.3Å; A117-C120 WeakPolarHBondContact O-CB 3.38Å; A117-C120 PolarHBondContact O-N 2.96Å; A117-C120 VanDerWaalsContact O-N 3.12Å; C120-L122 VanDerWaalsContact C-N 3.3Å; C120-L122 PolarHBondContact O-N 3.48Å; C120-A123 WeakPolarHBondContact O-CA 3.48Å; C120-A123 WeakPolarHBondContact O-CB 3.48Å; C120-A123 PolarHBondContact O-N 3.33Å; C120-A124 PolarHBondContact O-N 3.25Å; C120-A124 VanDerWaalsContact O-N 3.1Å; C120-D139 VanDerWaalsContact CB-OD2 3.29Å; C120-D139 WeakPolarHBondContact CB-OD2 3.26Å
121	V	42.1	Very low	38.5	Very low	51 Å²	51	82.1 Å²	82.1	31%	0.309	45%	0.45	S	S	.	.	H	α-helix	trans	-59.2	-39	175.7	178.1	0	0	0	0	112.2	A117 A123 A124 I142 I179	A117-V121 PolarHBondContact O-N 3.44Å; V121-A123 VanDerWaalsContact C-N 3.25Å; V121-A123 PolarHBondContact O-N 3.34Å; V121-A124 WeakPolarHBondContact O-CB 3.46Å; V121-A124 PolarHBondContact O-N 2.91Å; V121-I142 HydrophobicContact CG2-CD1 3.62Å; V121-I179 HydrophobicContact CG1-CG2 3.81Å
122	L	37.9	Very low	38.4	Very low	112 Å²	112	78.9 Å²	78.9	59%	0.586	44%	0.435	S	S	*	.	H	α-helix	trans	-68.7	-18.6	173.4	-78.6	166.8	0	0	0	114.1	H118 C120 I179	H118-L122 WeakPolarHBondContact O-CB 3.13Å; H118-L122 WeakPolarHBondContact O-CG 3.37Å; H118-L122 PolarHBondContact O-N 2.49Å; C120-L122 VanDerWaalsContact C-N 3.3Å; C120-L122 PolarHBondContact O-N 3.48Å; L122-I179 HydrophobicContact CD1-CD1 4.04Å; L122-I179 HydrophobicContact CD2-CD1 3.78Å; L122-I179 HydrophobicContact CD2-CG1 4.41Å; L122-I179 HydrophobicContact CG-CD1 3.87Å
123	A	35.8	Very low	39.2	Very low	37 Å²	37	78 Å²	78	31%	0.306	42%	0.42	S	S	.	.	H	α-helix	trans	-82.2	-22.1	168.4	0	0	0	0	0	112.3	R119 C120 V121 K132 L133	R119-A123 PolarHBondContact O-N 2.82Å; R119-A123 VanDerWaalsContact O-N 3.14Å; C120-A123 WeakPolarHBondContact O-CA 3.48Å; C120-A123 WeakPolarHBondContact O-CB 3.48Å; C120-A123 PolarHBondContact O-N 3.33Å; V121-A123 VanDerWaalsContact C-N 3.25Å; V121-A123 PolarHBondContact O-N 3.34Å; A123-K132 WeakPolarHBondContact O-CE 3.45Å; A123-K132 PolarHBondContact O-NZ 2.96Å; A123-L133 VanDerWaalsContact O-CD1 3.24Å; A123-L133 WeakPolarHBondContact O-CD1 3.5Å
124	A	38.4	Very low	39.5	Very low	39 Å²	39	79.6 Å²	79.6	32%	0.322	42%	0.422	S	S	.	.	S	Bend	trans	-88.9	1.5	-168.9	0	0	0	0	0	116.1	C120 V121 L133 S138	C120-A124 PolarHBondContact O-N 3.25Å; C120-A124 VanDerWaalsContact O-N 3.1Å; V121-A124 WeakPolarHBondContact O-CB 3.46Å; V121-A124 PolarHBondContact O-N 2.91Å; A124-L133 VanDerWaalsContact CA-CD1 3.45Å; A124-L133 VanDerWaalsContact O-CD1 3.25Å; A124-L133 WeakPolarHBondContact O-CD1 3.17Å; A124-S138 WeakPolarHBondContact CB-O 3.37Å
125	G	39.5	Very low	39	Very low	58 Å²	58	83.6 Å²	83.6	60%	0.598	44%	0.443	S	S	*	.			trans	-128.9	96	-176.5	0	0	0	0	0	115.1
126	S	32.3	Very low	38.5	Very low	55 Å²	55	83.2 Å²	83.2	39%	0.385	45%	0.454	S	S	.	.			trans	-149.5	146.4	160.9	-38.9	0	0	0	0	108.6	F128 L133	S126-F128 PolarHBondContact O-N 2.46Å; S126-L133 WeakPolarHBondContact O-CD2 3.43Å
127	P	39.5	Very low	38.2	Very low	123 Å²	123	82.8 Å²	82.8	80%	0.799	45%	0.454	S	S	*	.	S	Bend	trans	-53.4	-27.9	-178.5	-28.3	35.7	0	0	0	113.6	F129 Q130	P127-F129 VanDerWaalsContact C-N 3.29Å; P127-F129 PolarHBondContact O-N 2.78Å; P127-Q130 PolarHBondContact O-NE2 3.11Å; P127-Q130 PolarHBondContact O-OE1 2.85Å
128	F	41.3	Very low	37.7	Very low	98 Å²	98	83.2 Å²	83.2	43%	0.43	46%	0.455	S	S	.	.			trans	-78	37.9	-173.4	-151.2	-103.1	0	0	0	116.1	S126 Q130 D131 L133 L134	S126-F128 PolarHBondContact O-N 2.46Å; F128-Q130 HydrophobicContact CD1-CB 4.4Å; F128-Q130 HydrophobicContact CD2-CB 3.85Å; F128-Q130 HydrophobicContact CE1-CB 4.38Å; F128-Q130 WeakPolarHBondContact CE1-O 3.33Å; F128-Q130 HydrophobicContact CE2-CB 3.84Å; F128-Q130 HydrophobicContact CG-CB 4.14Å; F128-Q130 HydrophobicContact CZ-CB 4.11Å; F128-Q130 PolarHBondContact O-N 2.83Å; F128-D131 HydrophobicContact CD1-CB 3.93Å; F128-D131 HydrophobicContact CE1-CB 3.75Å; F128-L133 VanDerWaalsContact C-CA 3.42Å; F128-L133 WeakPolarHBondContact O-CA 3.46Å; F128-L133 PolarHBondContact O-N 3.38Å; F128-L134 HydrophobicContact CD1-CB 4.26Å; F128-L134 HydrophobicContact CD1-CD1 4.33Å; F128-L134 HydrophobicContact CE1-CD1 4.48Å
129	F	36	Very low	37.3	Very low	132 Å²	132	84.4 Å²	84.4	58%	0.579	46%	0.463	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.2	68.3	149	-159.8	-67.9	0	0	0	107.7	P127 D131 K132 L133	P127-F129 VanDerWaalsContact C-N 3.29Å; P127-F129 PolarHBondContact O-N 2.78Å; F129-D131 CarbonylContact C-O 3.57Å; F129-D131 VanDerWaalsContact CA-O 3.25Å; F129-D131 WeakPolarHBondContact CA-O 3.3Å; F129-D131 WeakPolarHBondContact CD1-O 3.45Å; F129-D131 WeakPolarHBondContact CG-O 3.39Å; F129-K132 WeakPolarHBondContact CD2-O 3.24Å; F129-K132 WeakPolarHBondContact CE2-O 3.38Å; F129-L133 VanDerWaalsContact CA-N 3.27Å; F129-L133 HydrophobicContact CB-CD2 3.83Å; F129-L133 HydrophobicContact CB-CG 4.21Å; F129-L133 HydrophobicContact CD2-CG 4.43Å
130	Q	43.2	Very low	37.1	Very low	132 Å²	132	81.4 Å²	81.4	62%	0.617	46%	0.46	S	S	*	.	T	Hydrogen-bonded Turn	trans	-136.5	33.7	172.5	-72.8	115.6	41.3	0	0	105.2	P127 F128	P127-Q130 PolarHBondContact O-NE2 3.11Å; P127-Q130 PolarHBondContact O-OE1 2.85Å; F128-Q130 HydrophobicContact CD1-CB 4.4Å; F128-Q130 HydrophobicContact CD2-CB 3.85Å; F128-Q130 HydrophobicContact CE1-CB 4.38Å; F128-Q130 WeakPolarHBondContact CE1-O 3.33Å; F128-Q130 HydrophobicContact CE2-CB 3.84Å; F128-Q130 HydrophobicContact CG-CB 4.14Å; F128-Q130 HydrophobicContact CZ-CB 4.11Å; F128-Q130 PolarHBondContact O-N 2.83Å
131	D	35.3	Very low	37	Very low	70 Å²	70	88.4 Å²	88.4	37%	0.374	49%	0.489	S	S	.	.	T	Hydrogen-bonded Turn	trans	153.1	-161.8	-161.1	175.6	-141.3	0	0	0	103.6	F128 F129 L133 L134 L135	F128-D131 HydrophobicContact CD1-CB 3.93Å; F128-D131 HydrophobicContact CE1-CB 3.75Å; F129-D131 CarbonylContact C-O 3.57Å; F129-D131 VanDerWaalsContact CA-O 3.25Å; F129-D131 WeakPolarHBondContact CA-O 3.3Å; F129-D131 WeakPolarHBondContact CD1-O 3.45Å; F129-D131 WeakPolarHBondContact CG-O 3.39Å; D131-L133 PolarHBondContact O-N 2.88Å; D131-L134 VanDerWaalsContact OD1-CA 3.27Å; D131-L134 WeakPolarHBondContact OD1-CA 3.38Å; D131-L135 WeakPolarHBondContact OD1-CD2 3.46Å; D131-L135 WeakPolarHBondContact OD1-CG 3.2Å
132	K	36.1	Very low	36.3	Very low	25 Å²	25	90.3 Å²	90.3	11%	0.109	50%	0.496	C	S	.	.	T	Hydrogen-bonded Turn		39.5	-108.5	118.6	168.3	77.9	166	101.3	0	117.4	A123 F129 L134 G136 Y137	A123-K132 WeakPolarHBondContact O-CE 3.45Å; A123-K132 PolarHBondContact O-NZ 2.96Å; F129-K132 WeakPolarHBondContact CD2-O 3.24Å; F129-K132 WeakPolarHBondContact CE2-O 3.38Å; K132-L134 VanDerWaalsContact CG-N 3.34Å; K132-G136 VanDerWaalsContact CB-CA 3.42Å; K132-Y137 WeakPolarHBondContact CD-O 3.4Å; K132-Y137 WeakPolarHBondContact CE-O 3.49Å
133	L	49.8	Very low	36	Very low	24 Å²	24	89.3 Å²	89.3	13%	0.126	50%	0.497	C	S	.	.	S	Bend		48.2	30.3	-74.3	7.7	125.8	0	0	0	121	A123 A124 S126 F128 F129 D131	A123-L133 VanDerWaalsContact O-CD1 3.24Å; A123-L133 WeakPolarHBondContact O-CD1 3.5Å; A124-L133 VanDerWaalsContact CA-CD1 3.45Å; A124-L133 VanDerWaalsContact O-CD1 3.25Å; A124-L133 WeakPolarHBondContact O-CD1 3.17Å; S126-L133 WeakPolarHBondContact O-CD2 3.43Å; F128-L133 VanDerWaalsContact C-CA 3.42Å; F128-L133 WeakPolarHBondContact O-CA 3.46Å; F128-L133 PolarHBondContact O-N 3.38Å; F129-L133 VanDerWaalsContact CA-N 3.27Å; F129-L133 HydrophobicContact CB-CD2 3.83Å; F129-L133 HydrophobicContact CB-CG 4.21Å; F129-L133 HydrophobicContact CD2-CG 4.43Å; D131-L133 PolarHBondContact O-N 2.88Å
134	L	45.9	Very low	36	Very low	112 Å²	112	91.4 Å²	91.4	59%	0.586	51%	0.509	S	S	*	.	S	Bend	trans	36.8	109.5	-174.3	-151.9	158.7	0	0	0	119.9	F128 D131 K132	F128-L134 HydrophobicContact CD1-CB 4.26Å; F128-L134 HydrophobicContact CD1-CD1 4.33Å; F128-L134 HydrophobicContact CE1-CD1 4.48Å; D131-L134 VanDerWaalsContact OD1-CA 3.27Å; D131-L134 WeakPolarHBondContact OD1-CA 3.38Å; K132-L134 VanDerWaalsContact CG-N 3.34Å
135	L	31.7	Very low	36.2	Very low	134 Å²	134	96.1 Å²	96.1	70%	0.702	53%	0.534	S	S	*	.	S	Bend	cis	-131.6	141	-32.8	-36.8	98.9	0	0	0	107.1	D131	D131-L135 WeakPolarHBondContact OD1-CD2 3.46Å; D131-L135 WeakPolarHBondContact OD1-CG 3.2Å
136	G	33.1	Very low	36.6	Very low	55 Å²	55	96.5 Å²	96.5	57%	0.567	52%	0.524	S	S	*	.	S	Bend	cis	-124.1	138.2	-6	0	0	0	0	0	112.8	K132	K132-G136 VanDerWaalsContact CB-CA 3.42Å
137	Y	30.7	Very low	37.5	Very low	171 Å²	171	96.2 Å²	96.2	67%	0.671	52%	0.522	S	S	*	.			trans	63.1	176.5	172.5	-71.6	-101.7	0	0	0	115.8	K132	K132-Y137 WeakPolarHBondContact CD-O 3.4Å; K132-Y137 WeakPolarHBondContact CE-O 3.49Å
138	S	29.5	Very low	38.1	Very low	41 Å²	41	94 Å²	94	29%	0.287	51%	0.506	S	S	.	.			cis	-168.8	-179.3	45.5	48.3	0	0	0	0	109.6	A124	A124-S138 WeakPolarHBondContact CB-O 3.37Å
139	D	32.5	Very low	38.4	Very low	59 Å²	59	96.1 Å²	96.1	32%	0.316	52%	0.517	S	S	.	.			cis	-144.8	155.3	31.1	-80.1	-87.5	0	0	0	109.7	C120 I142	C120-D139 VanDerWaalsContact CB-OD2 3.29Å; C120-D139 WeakPolarHBondContact CB-OD2 3.26Å; D139-I142 HydrophobicContact CB-CD1 4.46Å; D139-I142 HydrophobicContact CB-CG1 4.31Å
140	I	33.8	Very low	39.2	Very low	140 Å²	140	91 Å²	91	72%	0.718	50%	0.498	S	S	*	.	S	Bend		58.7	130.1	58.4	-61.4	158.2	0	0	0	110	I142	I140-I142 PolarHBondContact O-N 2.93Å; I140-I142 VanDerWaalsContact O-N 3.08Å
141	E	32.9	Very low	39.8	Very low	189 Å²	189	85.6 Å²	85.6	88%	0.883	47%	0.474	S	S	*	.			trans	-70.3	110.3	-168.9	-63.8	177.6	154.8	0	0	111.1	P143	E141-P143 WeakPolarHBondContact O-CD 3.39Å
142	I	27.9	Very low	40.7	Very low	90 Å²	90	86 Å²	86	46%	0.462	47%	0.473	S	S	.	.			trans	-80.5	119.3	176.5	-59	-178.4	0	0	0	108.6	V121 D139 I140 S144	V121-I142 HydrophobicContact CG2-CD1 3.62Å; D139-I142 HydrophobicContact CB-CD1 4.46Å; D139-I142 HydrophobicContact CB-CG1 4.31Å; I140-I142 PolarHBondContact O-N 2.93Å; I140-I142 VanDerWaalsContact O-N 3.08Å; I142-S144 PolarHBondContact O-N 3.31Å
143	P	30.9	Very low	41.6	Very low	92 Å²	92	89.6 Å²	89.6	60%	0.597	49%	0.489	S	S	*	.			trans	-63.5	130.9	-173.8	-25.7	35.8	0	0	0	114.3	E141	E141-P143 WeakPolarHBondContact O-CD 3.39Å
144	S	36.2	Very low	41.8	Very low	81 Å²	81	89.3 Å²	89.3	57%	0.566	49%	0.488	S	S	*	.	S	Bend	trans	35.5	95.7	160.7	61.8	0	0	0	0	117.6	I142 V146	I142-S144 PolarHBondContact O-N 3.31Å; S144-V146 PolarHBondContact O-N 2.95Å
145	V	42.9	Very low	42.3	Very low	138 Å²	138	84.7 Å²	84.7	84%	0.836	46%	0.463	S	S	*	.			trans	-21.7	110.4	162	-173.7	0	0	0	0	114.7
146	V	47.2	Very low	43.4	Very low	66 Å²	66	82 Å²	82	40%	0.4	45%	0.45	S	S	.	.			trans	-75.4	121.3	157.1	-175.7	0	0	0	0	107.2	S144 V151	S144-V146 PolarHBondContact O-N 2.95Å; V146-V151 HydrophobicContact CG1-CG2 3.75Å
147	S	50.5	Low	44.4	Very low	48 Å²	48	80 Å²	80	34%	0.336	43%	0.425	S	S	.	.			trans	-68.3	145.4	-173.2	95.8	0	0	0	0	112.2	Q149 S150 V151	S147-Q149 PolarHBondContact O-N 3.11Å; S147-S150 WeakPolarHBondContact O-CA 3.4Å; S147-S150 VanDerWaalsContact O-CB 3.32Å; S147-S150 WeakPolarHBondContact O-CB 3.49Å; S147-S150 PolarHBondContact O-N 3.34Å; S147-S150 WeakPolarHBondContact OG-CB 3.14Å; S147-S150 PolarHBondContact OG-N 3.2Å; S147-S150 PolarHBondContact OG-OG 3.05Å; S147-V151 PolarHBondContact O-N 2.8Å
148	V	52	Low	45.5	Very low	77 Å²	77	73.6 Å²	73.6	47%	0.467	40%	0.402	S	S	.	.	H	α-helix	trans	-56.7	-39.7	178.6	-166.5	0	0	0	0	111.2	S150 V151 Q152 T184	V148-S150 VanDerWaalsContact C-N 3.35Å; V148-V151 PolarHBondContact O-N 3.37Å; V148-Q152 PolarHBondContact O-N 3.43Å; V148-T184 HydrophobicContact CG1-CG2 4.32Å; V148-T184 HydrophobicContact CG2-CG2 3.44Å; V148-T184 VanDerWaalsContact CG2-CG2 3.44Å
149	Q	48	Very low	46.4	Very low	143 Å²	143	80.1 Å²	80.1	67%	0.668	42%	0.422	S	S	*	.	H	α-helix	trans	-68.7	-31.2	175.7	-69.7	-176.9	-9.6	0	0	112.8	S147 K153	S147-Q149 PolarHBondContact O-N 3.11Å; Q149-K153 VanDerWaalsContact O-CB 3.31Å; Q149-K153 WeakPolarHBondContact O-CB 3.28Å; Q149-K153 WeakPolarHBondContact O-CG 3.43Å; Q149-K153 PolarHBondContact O-N 3.1Å
150	S	53.4	Low	47.3	Very low	23 Å²	23	80.6 Å²	80.6	16%	0.161	43%	0.43	C	S	.	.	H	α-helix	trans	-68.2	-40.2	173.2	-54	0	0	0	0	110.9	S147 V148 L154	S147-S150 WeakPolarHBondContact O-CA 3.4Å; S147-S150 VanDerWaalsContact O-CB 3.32Å; S147-S150 WeakPolarHBondContact O-CB 3.49Å; S147-S150 PolarHBondContact O-N 3.34Å; S147-S150 WeakPolarHBondContact OG-CB 3.14Å; S147-S150 PolarHBondContact OG-N 3.2Å; S147-S150 PolarHBondContact OG-OG 3.05Å; V148-S150 VanDerWaalsContact C-N 3.35Å; S150-L154 WeakPolarHBondContact O-CB 3.28Å; S150-L154 PolarHBondContact O-N 3.11Å
151	V	56.5	Low	48	Very low	20 Å²	20	76 Å²	76	12%	0.121	42%	0.417	C	S	.	.	H	α-helix	trans	-69.1	-44.7	175.7	-179.1	0	0	0	0	111.5	V146 S147 V148 L154 I155 A177 L180	V146-V151 HydrophobicContact CG1-CG2 3.75Å; S147-V151 PolarHBondContact O-N 2.8Å; V148-V151 PolarHBondContact O-N 3.37Å; V151-L154 WeakPolarHBondContact O-CB 3.44Å; V151-L154 PolarHBondContact O-N 3.48Å; V151-I155 HydrophobicContact CG1-CD1 3.98Å; V151-I155 WeakPolarHBondContact O-CG1 3.35Å; V151-I155 PolarHBondContact O-N 3.04Å; V151-A177 HydrophobicContact CG1-CB 3.88Å; V151-L180 HydrophobicContact CG2-CD1 3.96Å
152	Q	53.1	Low	48.6	Very low	78 Å²	78	68.1 Å²	68.1	36%	0.364	38%	0.381	S	S	.	.	H	α-helix	trans	-61.4	-46.8	176.7	-173.5	59.5	53.8	0	0	111.1	V148 L154 I155 D156	V148-Q152 PolarHBondContact O-N 3.43Å; Q152-L154 VanDerWaalsContact C-N 3.29Å; Q152-L154 PolarHBondContact O-N 3.35Å; Q152-I155 CarbonylContact O-C 3.56Å; Q152-I155 WeakPolarHBondContact O-CA 3.44Å; Q152-I155 WeakPolarHBondContact O-CB 3.37Å; Q152-I155 PolarHBondContact O-N 3.07Å; Q152-I155 VanDerWaalsContact O-N 3.09Å; Q152-D156 PolarHBondContact NE2-OD1 3.08Å; Q152-D156 PolarHBondContact O-N 3.43Å
153	K	54.3	Low	49.4	Very low	101 Å²	101	64.2 Å²	64.2	44%	0.439	36%	0.361	S	S	.	.	H	α-helix	trans	-59.8	-37.9	174.5	-73.6	173.3	-178.9	179	0	112.4	L91 Q149 I155 D156 F157	L91-K153 HydrophobicContact CD2-CB 3.81Å; L91-K153 HydrophobicContact CD2-CD 3.8Å; L91-K153 HydrophobicContact CD2-CG 4.47Å; Q149-K153 VanDerWaalsContact O-CB 3.31Å; Q149-K153 WeakPolarHBondContact O-CB 3.28Å; Q149-K153 WeakPolarHBondContact O-CG 3.43Å; Q149-K153 PolarHBondContact O-N 3.1Å; K153-I155 VanDerWaalsContact C-N 3.33Å; K153-D156 PolarHBondContact O-N 3.36Å; K153-F157 WeakPolarHBondContact O-CB 3.4Å; K153-F157 WeakPolarHBondContact O-CD2 3.47Å; K153-F157 PolarHBondContact O-N 3.31Å
154	L	55.4	Low	50.1	Low	18 Å²	18	67.6 Å²	67.6	9%	0.094	36%	0.362	C	S	.	.	H	α-helix	trans	-62	-41.8	175.2	-167.9	77.2	0	0	0	111.4	F86 S150 V151 Q152 F157 M158 L163 I173	F86-L154 HydrophobicContact CE1-CD1 3.79Å; F86-L154 HydrophobicContact CZ-CD1 3.97Å; S150-L154 WeakPolarHBondContact O-CB 3.28Å; S150-L154 PolarHBondContact O-N 3.11Å; V151-L154 WeakPolarHBondContact O-CB 3.44Å; V151-L154 PolarHBondContact O-N 3.48Å; Q152-L154 VanDerWaalsContact C-N 3.29Å; Q152-L154 PolarHBondContact O-N 3.35Å; L154-F157 PolarHBondContact O-N 3.17Å; L154-M158 WeakPolarHBondContact O-CG 3.43Å; L154-M158 PolarHBondContact O-N 3.1Å; L154-L163 HydrophobicContact CD1-CD1 3.5Å; L154-L163 VanDerWaalsContact CD1-CD1 3.5Å; L154-L163 HydrophobicContact CG-CD1 4.2Å; L154-I173 HydrophobicContact CD2-CG2 4.49Å
155	I	56.8	Low	50.8	Low	14 Å²	14	65.1 Å²	65.1	7%	0.072	34%	0.343	C	S	.	.	H	α-helix	trans	-65.2	-42.5	175	-70.1	166.9	0	0	0	110.9	V151 Q152 K153 F157 M158 Y159 I173 A177	V151-I155 HydrophobicContact CG1-CD1 3.98Å; V151-I155 WeakPolarHBondContact O-CG1 3.35Å; V151-I155 PolarHBondContact O-N 3.04Å; Q152-I155 CarbonylContact O-C 3.56Å; Q152-I155 WeakPolarHBondContact O-CA 3.44Å; Q152-I155 WeakPolarHBondContact O-CB 3.37Å; Q152-I155 PolarHBondContact O-N 3.07Å; Q152-I155 VanDerWaalsContact O-N 3.09Å; K153-I155 VanDerWaalsContact C-N 3.33Å; I155-F157 VanDerWaalsContact C-N 3.32Å; I155-F157 PolarHBondContact O-N 2.99Å; I155-M158 WeakPolarHBondContact O-CB 3.5Å; I155-M158 PolarHBondContact O-N 3.35Å; I155-M158 VanDerWaalsContact O-N 3.11Å; I155-Y159 HydrophobicContact CG2-CD2 3.55Å; I155-Y159 HydrophobicContact CG2-CE2 3.48Å; I155-Y159 VanDerWaalsContact CG2-CE2 3.48Å; I155-Y159 WeakPolarHBondContact O-CD2 3.32Å; I155-Y159 PolarHBondContact O-N 3.32Å; I155-I173 HydrophobicContact CG1-CG2 4.43Å; I155-A177 HydrophobicContact CD1-CB 3.61Å
156	D	53.5	Low	51	Low	79 Å²	79	60.9 Å²	60.9	42%	0.422	32%	0.32	S	S	.	.	H	α-helix	trans	-64.6	-35.9	175.7	-55.9	-23	0	0	0	111.4	Q152 K153 S160	Q152-D156 PolarHBondContact NE2-OD1 3.08Å; Q152-D156 PolarHBondContact O-N 3.43Å; K153-D156 PolarHBondContact O-N 3.36Å; D156-S160 VanDerWaalsContact O-CB 3.31Å; D156-S160 WeakPolarHBondContact O-CB 3.5Å; D156-S160 PolarHBondContact O-N 3.39Å; D156-S160 PolarHBondContact O-OG 3.21Å
157	F	53.9	Low	50.6	Low	12 Å²	12	66.2 Å²	66.2	5%	0.053	34%	0.341	C	S	.	.	H	α-helix	trans	-70.4	-26.3	172.1	-83.9	-64.7	0	0	0	113.7	L91 N95 K153 L154 I155 S160 V162 L163	L91-F157 HydrophobicContact CD1-CD2 4.05Å; L91-F157 HydrophobicContact CD1-CE2 4.09Å; L91-F157 HydrophobicContact CG-CD2 4.48Å; L91-F157 HydrophobicContact CG-CE2 4.05Å; N95-F157 HydrophobicContact CB-CZ 3.86Å; K153-F157 WeakPolarHBondContact O-CB 3.4Å; K153-F157 WeakPolarHBondContact O-CD2 3.47Å; K153-F157 PolarHBondContact O-N 3.31Å; L154-F157 PolarHBondContact O-N 3.17Å; I155-F157 VanDerWaalsContact C-N 3.32Å; I155-F157 PolarHBondContact O-N 2.99Å; F157-S160 WeakPolarHBondContact CA-OG 3.25Å; F157-V162 HydrophobicContact CD1-CB 4.03Å; F157-V162 HydrophobicContact CD1-CG1 4.18Å; F157-V162 HydrophobicContact CD1-CG2 4.25Å; F157-V162 PolarHBondContact O-N 3.18Å; F157-V162 VanDerWaalsContact O-N 3.14Å; F157-L163 HydrophobicContact CB-CD1 3.69Å; F157-L163 HydrophobicContact CB-CG 4.07Å; F157-L163 PolarHBondContact O-N 3.42Å
158	M	54.1	Low	50.4	Low	37 Å²	37	67.4 Å²	67.4	18%	0.182	35%	0.349	C	S	.	.	H	α-helix	trans	-74.6	-48.1	170	-72.3	170.2	58.4	0	0	111.3	L154 I155 S160 G161 L163 V165 A170 I173	L154-M158 WeakPolarHBondContact O-CG 3.43Å; L154-M158 PolarHBondContact O-N 3.1Å; I155-M158 WeakPolarHBondContact O-CB 3.5Å; I155-M158 PolarHBondContact O-N 3.35Å; I155-M158 VanDerWaalsContact O-N 3.11Å; M158-S160 VanDerWaalsContact C-N 3.34Å; M158-S160 PolarHBondContact O-N 3.22Å; M158-G161 PolarHBondContact O-N 3.4Å; M158-L163 HydrophobicContact CG-CB 3.98Å; M158-L163 HydrophobicContact CG-CD1 4.45Å; M158-V165 HydrophobicContact CE-CB 4.23Å; M158-V165 HydrophobicContact CE-CG2 4.19Å; M158-V165 HydrophobicContact CG-CG2 4.04Å; M158-V165 HydrophobicContact SD-CG2 4.06Å; M158-A170 HydrophobicContact CE-CB 3.71Å; M158-I173 HydrophobicContact CE-CD1 4.3Å; M158-I173 HydrophobicContact SD-CD1 3.79Å; M158-I173 HydrophobicContact SD-CG2 4.09Å
159	Y	49	Very low	50.5	Low	178 Å²	178	65.6 Å²	65.6	70%	0.698	34%	0.335	S	S	*	.	H	α-helix	trans	-69.9	-27.2	179.9	-77.1	-62.4	0	0	0	113.7	I155 G161	I155-Y159 HydrophobicContact CG2-CD2 3.55Å; I155-Y159 HydrophobicContact CG2-CE2 3.48Å; I155-Y159 VanDerWaalsContact CG2-CE2 3.48Å; I155-Y159 WeakPolarHBondContact O-CD2 3.32Å; I155-Y159 PolarHBondContact O-N 3.32Å; Y159-G161 PolarHBondContact O-N 2.78Å
160	S	51.5	Low	50.8	Low	69 Å²	69	59.6 Å²	59.6	48%	0.483	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.2	3.2	168.5	56.7	0	0	0	0	114.1	D156 F157 M158 V162	D156-S160 VanDerWaalsContact O-CB 3.31Å; D156-S160 WeakPolarHBondContact O-CB 3.5Å; D156-S160 PolarHBondContact O-N 3.39Å; D156-S160 PolarHBondContact O-OG 3.21Å; F157-S160 WeakPolarHBondContact CA-OG 3.25Å; M158-S160 VanDerWaalsContact C-N 3.34Å; M158-S160 PolarHBondContact O-N 3.22Å; S160-V162 VanDerWaalsContact C-N 3.26Å; S160-V162 PolarHBondContact O-N 2.97Å
161	G	48.3	Very low	50.7	Low	43 Å²	43	64 Å²	64	44%	0.443	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	74	6.8	172.2	0	0	0	0	0	115.8	M158 Y159	M158-G161 PolarHBondContact O-N 3.4Å; Y159-G161 PolarHBondContact O-N 2.78Å
162	V	44.5	Very low	50.6	Low	23 Å²	23	66.4 Å²	66.4	14%	0.139	34%	0.342	C	S	.	.	S	Bend	trans	-75.4	-34.7	178.1	-177.8	0	0	0	0	111.1	R98 F157 S160	R98-V162 HydrophobicContact CG-CG2 4.17Å; F157-V162 HydrophobicContact CD1-CB 4.03Å; F157-V162 HydrophobicContact CD1-CG1 4.18Å; F157-V162 HydrophobicContact CD1-CG2 4.25Å; F157-V162 PolarHBondContact O-N 3.18Å; F157-V162 VanDerWaalsContact O-N 3.14Å; S160-V162 VanDerWaalsContact C-N 3.26Å; S160-V162 PolarHBondContact O-N 2.97Å
163	L	46.5	Very low	50.7	Low	9 Å²	9	63.5 Å²	63.5	5%	0.047	33%	0.328	C	S	.	.	S	Bend	trans	-102.6	112.7	173.9	-71.3	173.9	0	0	0	111.1	V106 V108 L154 F157 M158 V165	V106-L163 HydrophobicContact CB-CD2 4.11Å; V106-L163 HydrophobicContact CG1-CD2 4.27Å; V108-L163 HydrophobicContact CG2-CD2 4.23Å; L154-L163 HydrophobicContact CD1-CD1 3.5Å; L154-L163 VanDerWaalsContact CD1-CD1 3.5Å; L154-L163 HydrophobicContact CG-CD1 4.2Å; F157-L163 HydrophobicContact CB-CD1 3.69Å; F157-L163 HydrophobicContact CB-CG 4.07Å; F157-L163 PolarHBondContact O-N 3.42Å; M158-L163 HydrophobicContact CG-CB 3.98Å; M158-L163 HydrophobicContact CG-CD1 4.45Å; L163-V165 HydrophobicContact CB-CG2 4.45Å
164	R	44.3	Very low	50.7	Low	162 Å²	162	62 Å²	62	61%	0.611	33%	0.325	S	S	*	.			trans	-88.5	112.6	168.6	-68.7	-169.9	176.9	156.3	-6.4	110.1	D105 T107	D105-R164 WeakPolarHBondContact OD1-CB 3.37Å; D105-R164 WeakPolarHBondContact OD1-CD 3.38Å; D105-R164 IonicContact OD2-CZ 3.64Å; D105-R164 IonicContact OD2-NE 2.7Å; D105-R164 IonicContact OD2-NH1 2.7Å; D105-R164 PolarHBondContact OD2-NH1 2.98Å; T107-R164 VanDerWaalsContact CG2-O 3.29Å; T107-R164 WeakPolarHBondContact CG2-O 2.93Å
165	V	51.4	Low	50.7	Low	29 Å²	29	64.3 Å²	64.3	18%	0.176	34%	0.34	C	S	.	.			trans	-117.3	141.3	179	-175.4	0	0	0	0	108.4	M158 L163 E169 A170 I173	M158-V165 HydrophobicContact CE-CB 4.23Å; M158-V165 HydrophobicContact CE-CG2 4.19Å; M158-V165 HydrophobicContact CG-CG2 4.04Å; M158-V165 HydrophobicContact SD-CG2 4.06Å; L163-V165 HydrophobicContact CB-CG2 4.45Å; V165-E169 HydrophobicContact CG1-CB 3.46Å; V165-E169 VanDerWaalsContact CG1-CB 3.46Å; V165-A170 HydrophobicContact CB-CB 4.33Å; V165-A170 HydrophobicContact CG1-CB 4.1Å; V165-I173 HydrophobicContact CG1-CD1 3.98Å; V165-I173 HydrophobicContact CG2-CD1 4.36Å
166	S	46	Very low	50.7	Low	49 Å²	49	64.4 Å²	64.4	34%	0.343	34%	0.343	S	S	.	.			trans	-66.2	152.4	177.4	74.6	0	0	0	0	111.1	S168 E169 A170	S166-S168 PolarHBondContact O-N 3.07Å; S166-S168 VanDerWaalsContact O-N 3.13Å; S166-S168 PolarHBondContact OG-OG 3.47Å; S166-E169 VanDerWaalsContact CB-OE2 3.32Å; S166-E169 WeakPolarHBondContact CB-OE2 3.4Å; S166-E169 PolarHBondContact O-N 3.14Å; S166-E169 VanDerWaalsContact OG-CD 3.3Å; S166-E169 WeakPolarHBondContact OG-CG 3.31Å; S166-E169 PolarHBondContact OG-OE2 3.18Å; S166-A170 WeakPolarHBondContact O-CB 3.49Å; S166-A170 PolarHBondContact O-N 3.37Å
167	Q	40.7	Very low	50.9	Low	178 Å²	178	61 Å²	61	83%	0.832	33%	0.325	S	S	*	.	H	α-helix	trans	-58.2	-34	-172.9	-166.5	179.3	22	0	0	113.3	L171	Q167-L171 WeakPolarHBondContact O-CB 3.28Å; Q167-L171 PolarHBondContact O-N 3.36Å
168	S	45.2	Very low	50.8	Low	74 Å²	74	62.9 Å²	62.9	52%	0.517	34%	0.34	S	S	.	.	H	α-helix	trans	-74.3	-36.2	176.4	48	0	0	0	0	113.2	S166 Q172	S166-S168 PolarHBondContact O-N 3.07Å; S166-S168 VanDerWaalsContact O-N 3.13Å; S166-S168 PolarHBondContact OG-OG 3.47Å; S168-Q172 WeakPolarHBondContact O-CG 3.48Å; S168-Q172 PolarHBondContact O-N 3.09Å; S168-Q172 PolarHBondContact O-NE2 2.82Å
169	E	53.4	Low	50.9	Low	38 Å²	38	62.3 Å²	62.3	18%	0.178	34%	0.338	C	S	.	.	H	α-helix	trans	-73.2	-38.9	173.7	-70.9	166.9	133.6	0	0	111.1	R109 V165 S166 Q172 I173	R109-E169 WeakPolarHBondContact CA-OE1 3.33Å; V165-E169 HydrophobicContact CG1-CB 3.46Å; V165-E169 VanDerWaalsContact CG1-CB 3.46Å; S166-E169 VanDerWaalsContact CB-OE2 3.32Å; S166-E169 WeakPolarHBondContact CB-OE2 3.4Å; S166-E169 PolarHBondContact O-N 3.14Å; S166-E169 VanDerWaalsContact OG-CD 3.3Å; S166-E169 WeakPolarHBondContact OG-CG 3.31Å; S166-E169 PolarHBondContact OG-OE2 3.18Å; E169-Q172 CarbonylContact O-C 3.58Å; E169-Q172 WeakPolarHBondContact O-CB 3.4Å; E169-Q172 PolarHBondContact O-N 3.34Å; E169-Q172 VanDerWaalsContact O-N 3.14Å; E169-I173 WeakPolarHBondContact O-CG1 3.44Å; E169-I173 PolarHBondContact O-N 2.93Å
170	A	54.3	Low	51.4	Low	18 Å²	18	56.3 Å²	56.3	15%	0.149	32%	0.317	C	S	.	.	H	α-helix	trans	-63.3	-42.6	175.4	0	0	0	0	0	111.4	M158 V165 S166 Q172 I173 L174	M158-A170 HydrophobicContact CE-CB 3.71Å; V165-A170 HydrophobicContact CB-CB 4.33Å; V165-A170 HydrophobicContact CG1-CB 4.1Å; S166-A170 WeakPolarHBondContact O-CB 3.49Å; S166-A170 PolarHBondContact O-N 3.37Å; A170-Q172 VanDerWaalsContact C-N 3.29Å; A170-Q172 PolarHBondContact O-N 3.05Å; A170-I173 PolarHBondContact O-N 3.39Å; A170-L174 WeakPolarHBondContact O-CB 3.3Å; A170-L174 PolarHBondContact O-N 3.22Å
171	L	51.3	Low	51.3	Low	114 Å²	114	57.8 Å²	57.8	60%	0.597	32%	0.316	S	S	*	.	H	α-helix	trans	-63	-35.7	173.4	-170.7	67.9	0	0	0	111.8	Q167 T175	Q167-L171 WeakPolarHBondContact O-CB 3.28Å; Q167-L171 PolarHBondContact O-N 3.36Å; L171-T175 VanDerWaalsContact O-CB 3.31Å; L171-T175 WeakPolarHBondContact O-CB 3.41Å; L171-T175 PolarHBondContact O-N 3.3Å; L171-T175 PolarHBondContact O-OG1 3.44Å
172	Q	54.3	Low	51.1	Low	72 Å²	72	60.6 Å²	60.6	34%	0.336	32%	0.32	S	S	.	.	H	α-helix	trans	-68.6	-39	173.5	-72.3	163.9	28.9	0	0	112.4	L115 S168 E169 A170 T175 A176	L115-Q172 HydrophobicContact CD2-CB 4.29Å; L115-Q172 HydrophobicContact CD2-CG 4.27Å; S168-Q172 WeakPolarHBondContact O-CG 3.48Å; S168-Q172 PolarHBondContact O-N 3.09Å; S168-Q172 PolarHBondContact O-NE2 2.82Å; E169-Q172 CarbonylContact O-C 3.58Å; E169-Q172 WeakPolarHBondContact O-CB 3.4Å; E169-Q172 PolarHBondContact O-N 3.34Å; E169-Q172 VanDerWaalsContact O-N 3.14Å; A170-Q172 VanDerWaalsContact C-N 3.29Å; A170-Q172 PolarHBondContact O-N 3.05Å; Q172-T175 PolarHBondContact O-N 3Å; Q172-A176 VanDerWaalsContact O-CB 3.27Å; Q172-A176 WeakPolarHBondContact O-CB 3.31Å; Q172-A176 PolarHBondContact O-N 2.93Å
173	I	55.4	Low	51.4	Low	16 Å²	16	64.5 Å²	64.5	8%	0.082	34%	0.335	C	S	.	.	H	α-helix	trans	-63.9	-47	173.5	-67.2	169.2	0	0	0	110.6	I110 L154 I155 M158 V165 E169 A170 T175 A176 A177	I110-I173 HydrophobicContact CD1-CD1 3.94Å; I110-I173 HydrophobicContact CD1-CG1 3.47Å; I110-I173 VanDerWaalsContact CD1-CG1 3.47Å; L154-I173 HydrophobicContact CD2-CG2 4.49Å; I155-I173 HydrophobicContact CG1-CG2 4.43Å; M158-I173 HydrophobicContact CE-CD1 4.3Å; M158-I173 HydrophobicContact SD-CD1 3.79Å; M158-I173 HydrophobicContact SD-CG2 4.09Å; V165-I173 HydrophobicContact CG1-CD1 3.98Å; V165-I173 HydrophobicContact CG2-CD1 4.36Å; E169-I173 WeakPolarHBondContact O-CG1 3.44Å; E169-I173 PolarHBondContact O-N 2.93Å; A170-I173 PolarHBondContact O-N 3.39Å; I173-T175 VanDerWaalsContact C-N 3.33Å; I173-T175 PolarHBondContact O-N 2.92Å; I173-A176 PolarHBondContact O-N 3.13Å; I173-A177 VanDerWaalsContact O-CB 3.28Å; I173-A177 WeakPolarHBondContact O-CB 3.45Å; I173-A177 PolarHBondContact O-N 2.77Å
174	L	55	Low	51.8	Low	71 Å²	71	66.2 Å²	66.2	37%	0.372	35%	0.346	S	S	.	.	H	α-helix	trans	-63.4	-37.7	177.5	-79.5	155.4	0	0	0	112.1	A170 A177 S178	A170-L174 WeakPolarHBondContact O-CB 3.3Å; A170-L174 PolarHBondContact O-N 3.22Å; L174-A177 PolarHBondContact O-N 2.93Å; L174-S178 PolarHBondContact O-N 3.38Å; L174-S178 PolarHBondContact O-OG 3.04Å
175	T	55.4	Low	51.4	Low	66 Å²	66	62.7 Å²	62.7	41%	0.405	34%	0.342	S	S	.	.	H	α-helix	trans	-69.1	-39.2	173.6	-54.7	0	0	0	0	111.8	L171 Q172 I173 S178 I179	L171-T175 VanDerWaalsContact O-CB 3.31Å; L171-T175 WeakPolarHBondContact O-CB 3.41Å; L171-T175 PolarHBondContact O-N 3.3Å; L171-T175 PolarHBondContact O-OG1 3.44Å; Q172-T175 PolarHBondContact O-N 3Å; I173-T175 VanDerWaalsContact C-N 3.33Å; I173-T175 PolarHBondContact O-N 2.92Å; T175-S178 PolarHBondContact O-OG 3.46Å; T175-S178 VanDerWaalsContact O-OG 3.09Å; T175-I179 HydrophobicContact CG2-CD1 4.08Å; T175-I179 VanDerWaalsContact O-CD1 3.31Å; T175-I179 WeakPolarHBondContact O-CD1 3.3Å; T175-I179 WeakPolarHBondContact O-CG1 3.42Å; T175-I179 PolarHBondContact O-N 3.38Å; T175-I179 VanDerWaalsContact O-N 3.12Å
176	A	57.5	Low	51	Low	16 Å²	16	66 Å²	66	13%	0.132	36%	0.358	C	S	.	.	H	α-helix	trans	-65.1	-40.7	174	0	0	0	0	0	111.6	H118 Q172 I173 I179 L180	H118-A176 VanDerWaalsContact CE1-CB 3.45Å; H118-A176 WeakPolarHBondContact CE1-CB 3.5Å; Q172-A176 VanDerWaalsContact O-CB 3.27Å; Q172-A176 WeakPolarHBondContact O-CB 3.31Å; Q172-A176 PolarHBondContact O-N 2.93Å; I173-A176 PolarHBondContact O-N 3.13Å; A176-I179 PolarHBondContact O-N 2.78Å; A176-L180 WeakPolarHBondContact O-CB 3.43Å; A176-L180 WeakPolarHBondContact O-CG 3.4Å; A176-L180 PolarHBondContact O-N 3.35Å
177	A	56.2	Low	50.9	Low	7 Å²	7	67.4 Å²	67.4	6%	0.058	36%	0.362	C	S	.	.	H	α-helix	trans	-67.9	-40.7	178.6	0	0	0	0	0	112.6	V151 I155 I173 L174 L180 Q181	V151-A177 HydrophobicContact CG1-CB 3.88Å; I155-A177 HydrophobicContact CD1-CB 3.61Å; I173-A177 VanDerWaalsContact O-CB 3.28Å; I173-A177 WeakPolarHBondContact O-CB 3.45Å; I173-A177 PolarHBondContact O-N 2.77Å; L174-A177 PolarHBondContact O-N 2.93Å; A177-L180 PolarHBondContact O-N 2.84Å; A177-Q181 WeakPolarHBondContact O-CB 3.47Å; A177-Q181 WeakPolarHBondContact O-CG 3.39Å; A177-Q181 PolarHBondContact O-N 2.73Å
178	S	52.8	Low	51	Low	51 Å²	51	62.9 Å²	62.9	36%	0.357	34%	0.341	S	S	.	.	H	α-helix	trans	-67.4	-38.3	174.6	63.6	0	0	0	0	112.1	L174 T175 L180 Q181 I182	L174-S178 PolarHBondContact O-N 3.38Å; L174-S178 PolarHBondContact O-OG 3.04Å; T175-S178 PolarHBondContact O-OG 3.46Å; T175-S178 VanDerWaalsContact O-OG 3.09Å; S178-L180 VanDerWaalsContact C-N 3.35Å; S178-L180 PolarHBondContact O-N 2.85Å; S178-Q181 PolarHBondContact O-N 3.01Å; S178-I182 WeakPolarHBondContact O-CB 3.43Å; S178-I182 WeakPolarHBondContact O-CD1 2.89Å; S178-I182 VanDerWaalsContact O-CG1 3.25Å; S178-I182 WeakPolarHBondContact O-CG1 3.46Å; S178-I182 PolarHBondContact O-N 3.05Å
179	I	56.1	Low	50.4	Low	26 Å²	26	62.7 Å²	62.7	13%	0.133	34%	0.338	C	S	.	.	H	α-helix	trans	-61.7	-42.2	171.3	-68.1	163.6	0	0	0	111.1	V121 L122 T175 A176 I182 K183	V121-I179 HydrophobicContact CG1-CG2 3.81Å; L122-I179 HydrophobicContact CD1-CD1 4.04Å; L122-I179 HydrophobicContact CD2-CD1 3.78Å; L122-I179 HydrophobicContact CD2-CG1 4.41Å; L122-I179 HydrophobicContact CG-CD1 3.87Å; T175-I179 HydrophobicContact CG2-CD1 4.08Å; T175-I179 VanDerWaalsContact O-CD1 3.31Å; T175-I179 WeakPolarHBondContact O-CD1 3.3Å; T175-I179 WeakPolarHBondContact O-CG1 3.42Å; T175-I179 PolarHBondContact O-N 3.38Å; T175-I179 VanDerWaalsContact O-N 3.12Å; A176-I179 PolarHBondContact O-N 2.78Å; I179-I182 PolarHBondContact O-N 3.5Å; I179-K183 PolarHBondContact O-N 3.46Å
180	L	58.3	Low	49.8	Very low	51 Å²	51	64.8 Å²	64.8	27%	0.267	35%	0.354	S	S	.	.	H	α-helix	trans	-68.4	-38.9	176.3	-74.2	170.8	0	0	0	112.1	V151 A176 A177 S178 K183 T184	V151-L180 HydrophobicContact CG2-CD1 3.96Å; A176-L180 WeakPolarHBondContact O-CB 3.43Å; A176-L180 WeakPolarHBondContact O-CG 3.4Å; A176-L180 PolarHBondContact O-N 3.35Å; A177-L180 PolarHBondContact O-N 2.84Å; S178-L180 VanDerWaalsContact C-N 3.35Å; S178-L180 PolarHBondContact O-N 2.85Å; L180-K183 PolarHBondContact O-N 2.94Å; L180-T184 WeakPolarHBondContact O-CG2 3.27Å; L180-T184 PolarHBondContact O-N 3.24Å; L180-T184 PolarHBondContact O-OG1 3.04Å
181	Q	50.5	Low	49.4	Very low	101 Å²	101	68.8 Å²	68.8	47%	0.472	37%	0.365	S	S	.	.	H	α-helix	trans	-60.9	-44.5	172.7	-77.9	174.6	-11.9	0	0	111	A177 S178 K183 T184 V185	A177-Q181 WeakPolarHBondContact O-CB 3.47Å; A177-Q181 WeakPolarHBondContact O-CG 3.39Å; A177-Q181 PolarHBondContact O-N 2.73Å; S178-Q181 PolarHBondContact O-N 3.01Å; Q181-K183 PolarHBondContact O-N 3.23Å; Q181-T184 VanDerWaalsContact CA-OG1 3.3Å; Q181-T184 WeakPolarHBondContact CA-OG1 3.29Å; Q181-T184 PolarHBondContact O-N 3.41Å; Q181-T184 PolarHBondContact O-OG1 2.78Å; Q181-V185 WeakPolarHBondContact O-CG2 3.48Å; Q181-V185 PolarHBondContact O-N 3.41Å
182	I	43.9	Very low	48.7	Very low	102 Å²	102	66.4 Å²	66.4	52%	0.523	35%	0.353	S	S	.	.	H	α-helix	trans	-60.8	-44.5	173.4	-69.2	162.5	0	0	0	110.8	S178 I179 T184 V185 I186	S178-I182 WeakPolarHBondContact O-CB 3.43Å; S178-I182 WeakPolarHBondContact O-CD1 2.89Å; S178-I182 VanDerWaalsContact O-CG1 3.25Å; S178-I182 WeakPolarHBondContact O-CG1 3.46Å; S178-I182 PolarHBondContact O-N 3.05Å; I179-I182 PolarHBondContact O-N 3.5Å; I182-T184 VanDerWaalsContact C-N 3.34Å; I182-T184 PolarHBondContact O-N 3.07Å; I182-V185 PolarHBondContact O-N 3.47Å; I182-I186 HydrophobicContact CG2-CD1 3.85Å; I182-I186 VanDerWaalsContact O-CG1 3.32Å; I182-I186 WeakPolarHBondContact O-CG1 3.47Å; I182-I186 PolarHBondContact O-N 2.89Å
183	K	50.8	Low	47.9	Very low	104 Å²	104	67.7 Å²	67.7	45%	0.452	37%	0.365	S	S	.	.	H	α-helix	trans	-63.5	-38.5	175.6	-162.2	-131.5	-177.3	-75	0	112.1	I179 L180 Q181 I186 D187	I179-K183 PolarHBondContact O-N 3.46Å; L180-K183 PolarHBondContact O-N 2.94Å; Q181-K183 PolarHBondContact O-N 3.23Å; K183-I186 PolarHBondContact O-N 3.18Å; K183-D187 IonicContact NZ-OD1 3.14Å; K183-D187 PolarHBondContact NZ-OD1 3.07Å; K183-D187 IonicContact NZ-OD2 3.41Å; K183-D187 PolarHBondContact NZ-OD2 2.88Å; K183-D187 PolarHBondContact O-N 3.43Å
184	T	54.5	Low	47.3	Very low	46 Å²	46	71 Å²	71	28%	0.282	39%	0.39	S	S	.	.	H	α-helix	trans	-68.4	-35.7	175.1	54	0	0	0	0	112.1	V148 L180 Q181 I182 I186 D187 E188	V148-T184 HydrophobicContact CG1-CG2 4.32Å; V148-T184 HydrophobicContact CG2-CG2 3.44Å; V148-T184 VanDerWaalsContact CG2-CG2 3.44Å; L180-T184 WeakPolarHBondContact O-CG2 3.27Å; L180-T184 PolarHBondContact O-N 3.24Å; L180-T184 PolarHBondContact O-OG1 3.04Å; Q181-T184 VanDerWaalsContact CA-OG1 3.3Å; Q181-T184 WeakPolarHBondContact CA-OG1 3.29Å; Q181-T184 PolarHBondContact O-N 3.41Å; Q181-T184 PolarHBondContact O-OG1 2.78Å; I182-T184 VanDerWaalsContact C-N 3.34Å; I182-T184 PolarHBondContact O-N 3.07Å; T184-I186 VanDerWaalsContact C-N 3.34Å; T184-D187 PolarHBondContact O-N 3.44Å; T184-E188 WeakPolarHBondContact O-CA 3.13Å; T184-E188 WeakPolarHBondContact O-CB 3.06Å; T184-E188 PolarHBondContact O-N 3.26Å
185	V	37.2	Very low	46.6	Very low	87 Å²	87	73.1 Å²	73.1	53%	0.527	40%	0.398	S	S	.	.	H	α-helix	trans	-67.5	-35.6	173	169.9	0	0	0	0	110.8	Q181 I182 C189	Q181-V185 WeakPolarHBondContact O-CG2 3.48Å; Q181-V185 PolarHBondContact O-N 3.41Å; I182-V185 PolarHBondContact O-N 3.47Å; V185-C189 WeakPolarHBondContact O-CB 3.44Å; V185-C189 PolarHBondContact O-N 3.06Å; V185-C189 PolarHBondContact O-SG 3.43Å
186	I	41.8	Very low	45.7	Very low	98 Å²	98	74.9 Å²	74.9	50%	0.503	41%	0.405	S	S	.	.	H	α-helix	trans	-69	-44.7	174.3	-68.8	164.8	0	0	0	111.4	I182 K183 T184 E188 T190	I182-I186 HydrophobicContact CG2-CD1 3.85Å; I182-I186 VanDerWaalsContact O-CG1 3.32Å; I182-I186 WeakPolarHBondContact O-CG1 3.47Å; I182-I186 PolarHBondContact O-N 2.89Å; K183-I186 PolarHBondContact O-N 3.18Å; T184-I186 VanDerWaalsContact C-N 3.34Å; I186-E188 VanDerWaalsContact C-N 3.35Å; I186-T190 VanDerWaalsContact O-CB 3.29Å; I186-T190 WeakPolarHBondContact O-CB 3.25Å; I186-T190 PolarHBondContact O-N 3.28Å; I186-T190 PolarHBondContact O-OG1 3.28Å
187	D	44.3	Very low	44.7	Very low	79 Å²	79	80.3 Å²	80.3	42%	0.422	44%	0.436	S	S	.	.	H	α-helix	trans	-63.5	-42	174.6	-74.5	0.8	0	0	0	111	K183 T184 T190 R191	K183-D187 IonicContact NZ-OD1 3.14Å; K183-D187 PolarHBondContact NZ-OD1 3.07Å; K183-D187 IonicContact NZ-OD2 3.41Å; K183-D187 PolarHBondContact NZ-OD2 2.88Å; K183-D187 PolarHBondContact O-N 3.43Å; T184-D187 PolarHBondContact O-N 3.44Å; D187-T190 CarbonylContact O-C 3.3Å; D187-T190 WeakPolarHBondContact O-CB 3.43Å; D187-T190 PolarHBondContact O-N 3.01Å; D187-R191 VanDerWaalsContact O-CB 3.28Å; D187-R191 WeakPolarHBondContact O-CB 3.27Å; D187-R191 PolarHBondContact O-N 3.41Å
188	E	42.2	Very low	43.8	Very low	83 Å²	83	81.8 Å²	81.8	39%	0.388	45%	0.452	S	S	.	.	H	α-helix	trans	-68.8	-43.3	179.6	-176.1	68.4	177.1	0	0	111.6	T184 I186 T190 R191 I192	T184-E188 WeakPolarHBondContact O-CA 3.13Å; T184-E188 WeakPolarHBondContact O-CB 3.06Å; T184-E188 PolarHBondContact O-N 3.26Å; I186-E188 VanDerWaalsContact C-N 3.35Å; E188-T190 VanDerWaalsContact C-N 3.29Å; E188-T190 PolarHBondContact O-N 2.88Å; E188-R191 VanDerWaalsContact CD-NH2 3.28Å; E188-R191 CarbonylContact O-C 3.24Å; E188-R191 WeakPolarHBondContact O-CB 3.46Å; E188-R191 PolarHBondContact O-N 3.19Å; E188-R191 IonicContact OE1-CZ 3.88Å; E188-R191 IonicContact OE1-NE 2.65Å; E188-R191 IonicContact OE1-NH2 2.62Å; E188-R191 PolarHBondContact OE1-NH2 3.2Å; E188-R191 IonicContact OE2-CZ 3.76Å; E188-R191 IonicContact OE2-NE 2.66Å; E188-R191 PolarHBondContact OE2-NE 3.42Å; E188-R191 IonicContact OE2-NH2 2.94Å; E188-R191 PolarHBondContact OE2-NH2 3.39Å; E188-I192 HydrophobicContact CG-CD1 3.94Å; E188-I192 WeakPolarHBondContact O-CB 3.48Å; E188-I192 WeakPolarHBondContact O-CG1 3.37Å; E188-I192 PolarHBondContact O-N 3.07Å
189	C	32.9	Very low	42.8	Very low	70 Å²	70	87.7 Å²	87.7	47%	0.473	48%	0.479	S	S	.	.	H	α-helix	trans	-63.1	-36.9	170.9	-75.5	0	0	0	0	111.4	V185 I192 V193	V185-C189 WeakPolarHBondContact O-CB 3.44Å; V185-C189 PolarHBondContact O-N 3.06Å; V185-C189 PolarHBondContact O-SG 3.43Å; C189-I192 PolarHBondContact O-N 2.75Å; C189-V193 WeakPolarHBondContact O-CB 3.4Å; C189-V193 VanDerWaalsContact O-CG2 3.25Å; C189-V193 WeakPolarHBondContact O-CG2 3.29Å; C189-V193 PolarHBondContact O-N 2.96Å
190	T	42	Very low	41.4	Very low	83 Å²	83	91.2 Å²	91.2	51%	0.509	50%	0.502	S	S	.	.	H	α-helix	trans	-66.1	-41.3	174.2	-57.9	0	0	0	0	111	I186 D187 E188 V193 S194	I186-T190 VanDerWaalsContact O-CB 3.29Å; I186-T190 WeakPolarHBondContact O-CB 3.25Å; I186-T190 PolarHBondContact O-N 3.28Å; I186-T190 PolarHBondContact O-OG1 3.28Å; D187-T190 CarbonylContact O-C 3.3Å; D187-T190 WeakPolarHBondContact O-CB 3.43Å; D187-T190 PolarHBondContact O-N 3.01Å; E188-T190 VanDerWaalsContact C-N 3.29Å; E188-T190 PolarHBondContact O-N 2.88Å; T190-V193 PolarHBondContact O-N 3.45Å; T190-S194 WeakPolarHBondContact O-CB 3.48Å; T190-S194 PolarHBondContact O-N 2.91Å; T190-S194 PolarHBondContact O-OG 3.19Å; T190-S194 VanDerWaalsContact O-OG 3.05Å
191	R	45.3	Very low	39.8	Very low	101 Å²	101	97.8 Å²	97.8	38%	0.381	53%	0.529	S	S	.	.	H	α-helix	trans	-65.8	-40.1	175.9	-167.4	-170.2	69.2	67	5.5	111.9	D187 E188 S194 Q195	D187-R191 VanDerWaalsContact O-CB 3.28Å; D187-R191 WeakPolarHBondContact O-CB 3.27Å; D187-R191 PolarHBondContact O-N 3.41Å; E188-R191 VanDerWaalsContact CD-NH2 3.28Å; E188-R191 CarbonylContact O-C 3.24Å; E188-R191 WeakPolarHBondContact O-CB 3.46Å; E188-R191 PolarHBondContact O-N 3.19Å; E188-R191 IonicContact OE1-CZ 3.88Å; E188-R191 IonicContact OE1-NE 2.65Å; E188-R191 IonicContact OE1-NH2 2.62Å; E188-R191 PolarHBondContact OE1-NH2 3.2Å; E188-R191 IonicContact OE2-CZ 3.76Å; E188-R191 IonicContact OE2-NE 2.66Å; E188-R191 PolarHBondContact OE2-NE 3.42Å; E188-R191 IonicContact OE2-NH2 2.94Å; E188-R191 PolarHBondContact OE2-NH2 3.39Å; R191-S194 CarbonylContact O-C 3.58Å; R191-S194 PolarHBondContact O-N 2.94Å; R191-Q195 WeakPolarHBondContact O-CB 3.37Å; R191-Q195 WeakPolarHBondContact O-CG 3.45Å; R191-Q195 PolarHBondContact O-N 3.5Å
192	I	36.7	Very low	39.6	Very low	64 Å²	64	98.2 Å²	98.2	33%	0.328	54%	0.54	S	S	.	.	H	α-helix	trans	-68.6	-41.6	174.4	-70.5	165.3	0	0	0	110.3	E188 C189 S194 Q195 N196	E188-I192 HydrophobicContact CG-CD1 3.94Å; E188-I192 WeakPolarHBondContact O-CB 3.48Å; E188-I192 WeakPolarHBondContact O-CG1 3.37Å; E188-I192 PolarHBondContact O-N 3.07Å; C189-I192 PolarHBondContact O-N 2.75Å; I192-S194 VanDerWaalsContact C-N 3.31Å; I192-S194 PolarHBondContact O-N 2.79Å; I192-Q195 PolarHBondContact O-N 2.62Å; I192-Q195 VanDerWaalsContact O-N 3.16Å; I192-N196 WeakPolarHBondContact O-CB 3.35Å; I192-N196 PolarHBondContact O-N 3.32Å; I192-N196 PolarHBondContact O-OD1 3.41Å
193	V	37.6	Very low	38.7	Very low	100 Å²	100	96.7 Å²	96.7	61%	0.606	55%	0.55	S	S	*	.	H	α-helix	trans	-62.7	-37.6	171.7	167.2	0	0	0	0	111.2	C189 T190 V197	C189-V193 WeakPolarHBondContact O-CB 3.4Å; C189-V193 VanDerWaalsContact O-CG2 3.25Å; C189-V193 WeakPolarHBondContact O-CG2 3.29Å; C189-V193 PolarHBondContact O-N 2.96Å; T190-V193 PolarHBondContact O-N 3.45Å; V193-V197 WeakPolarHBondContact O-CG2 3.43Å
194	S	42.8	Very low	37.6	Very low	85 Å²	85	98.5 Å²	98.5	59%	0.594	56%	0.563	S	S	*	*	H	α-helix	trans	-70.3	-28.9	172.6	-62.2	0	0	0	0	113.8	T190 R191 I192	T190-S194 WeakPolarHBondContact O-CB 3.48Å; T190-S194 PolarHBondContact O-N 2.91Å; T190-S194 PolarHBondContact O-OG 3.19Å; T190-S194 VanDerWaalsContact O-OG 3.05Å; R191-S194 CarbonylContact O-C 3.58Å; R191-S194 PolarHBondContact O-N 2.94Å; I192-S194 VanDerWaalsContact C-N 3.31Å; I192-S194 PolarHBondContact O-N 2.79Å
195	Q	39.3	Very low	36.2	Very low	115 Å²	115	105 Å²	105	54%	0.537	59%	0.59	S	S	.	*	H	α-helix	trans	-81.3	-38.8	176.3	-79.9	-170.7	-29.2	0	0	112.7	R191 I192 V197 G198	R191-Q195 WeakPolarHBondContact O-CB 3.37Å; R191-Q195 WeakPolarHBondContact O-CG 3.45Å; R191-Q195 PolarHBondContact O-N 3.5Å; I192-Q195 PolarHBondContact O-N 2.62Å; I192-Q195 VanDerWaalsContact O-N 3.16Å; Q195-V197 PolarHBondContact O-N 3.32Å; Q195-G198 WeakPolarHBondContact O-CA 3.49Å; Q195-G198 PolarHBondContact O-N 3.18Å
196	N	36.2	Very low	35.6	Very low	103 Å²	103	107.5 Å²	107.5	55%	0.551	60%	0.601	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.3	2.2	178.3	-66.7	3.8	0	0	0	113.7	I192 G198	I192-N196 WeakPolarHBondContact O-CB 3.35Å; I192-N196 PolarHBondContact O-N 3.32Å; I192-N196 PolarHBondContact O-OD1 3.41Å; N196-G198 VanDerWaalsContact C-N 3.32Å
197	V	38.4	Very low	35	Very low	130 Å²	130	108.1 Å²	108.1	79%	0.788	61%	0.613	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81	-15.2	164.5	171.3	0	0	0	0	111.3	V193 Q195	V193-V197 WeakPolarHBondContact O-CG2 3.43Å; Q195-V197 PolarHBondContact O-N 3.32Å
198	G	36.2	Very low	34.2	Very low	38 Å²	38	108.1 Å²	108.1	39%	0.392	63%	0.633	S	S	.	*	S	Bend	trans	-107.8	139.5	162.6	0	0	0	0	0	111.6	Q195 N196	Q195-G198 WeakPolarHBondContact O-CA 3.49Å; Q195-G198 PolarHBondContact O-N 3.18Å; N196-G198 VanDerWaalsContact C-N 3.32Å
199	D	31.1	Very low	33.7	Very low	175 Å²	175	112.8 Å²	112.8	94%	0.936	65%	0.654	S	S	*	*			trans	54.6	67.2	162.9	-58	-57.3	0	0	0	117.8
200	V	26.9	Very low	33.4	Very low	101 Å²	101	115.7 Å²	115.7	61%	0.612	67%	0.665	S	S	*	*			trans	-99.5	121.7	153.1	158.6	0	0	0	0	104.8
201	F	25.6	Very low	32.8	Very low	188 Å²	188	117.7 Å²	117.7	83%	0.825	68%	0.677	S	S	*	*			cis	-175	-165.7	37.4	-125.9	-159.1	0	0	0	107.8
202	P	45.9	Very low	32.7	Very low	110 Å²	110	118.3 Å²	118.3	71%	0.714	70%	0.695	S	S	*	*			cis	-137.2	-176.2	-26.9	37.9	-19.8	0	0	0	114.9
203	G	26.2	Very low	32.2	Very low	70 Å²	70	127.1 Å²	127.1	72%	0.722	72%	0.724	S	S	*	*			trans	124.3	108.2	157.2	0	0	0	0	0	114
204	I	25.9	Very low	31.9	Very low	142 Å²	142	126 Å²	126	73%	0.728	73%	0.732	S	S	*	*			cis	104.9	114.9	29.9	-66.8	176.5	0	0	0	112.5
205	Q	26.7	Very low	31.4	Very low	182 Å²	182	128.4 Å²	128.4	85%	0.85	74%	0.743	S	S	*	*			trans	66.2	155.2	162.5	-76.9	164.4	-5	0	0	117.9
206	D	23	Very low	31.8	Very low	141 Å²	141	128.4 Å²	128.4	75%	0.754	75%	0.754	S	S	*	*			cis	-139.8	176.3	-7	-165.6	-156.9	0	0	0	111.8
207	S	29.1	Very low	31.6	Very low	110 Å²	110	132.2 Å²	132.2	77%	0.769	77%	0.768	S	S	*	*			trans	-52.9	140.9	170.3	-44.5	0	0	0	0	114.2
208	G	28.8	Very low	31.1	Very low	80 Å²	80	132.2 Å²	132.2	83%	0.825	77%	0.774	S	S	*	*			trans	-167.2	142.7	172	0	0	0	0	0	111.6
209	Q	30.6	Very low	30.9	Very low	180 Å²	180	133.5 Å²	133.5	84%	0.841	79%	0.787	S	S	*	*			trans	-105.7	163.3	-174.4	-143.4	-178.5	-82.3	0	0	112.1
210	D	28.2	Very low	30.8	Very low	131 Å²	131	131.3 Å²	131.3	70%	0.701	78%	0.78	S	S	*	*			trans	75.4	160	165.2	-77	-83.7	0	0	0	119.7
211	T	29.7	Very low	30.9	Very low	126 Å²	126	132.4 Å²	132.4	77%	0.773	79%	0.792	S	S	*	*			trans	-121.5	171.8	-164.5	58.8	0	0	0	0	110.5
212	P	41.6	Very low	31.1	Very low	114 Å²	114	127.1 Å²	127.1	74%	0.74	79%	0.791	S	S	*	*			cis	-131.1	-173.4	-25.5	32.1	-12.9	0	0	0	113.2
213	R	27.6	Very low	30.4	Very low	249 Å²	249	131 Å²	131	94%	0.94	80%	0.799	S	S	*	*			trans	71.4	97.8	147.2	-171.5	-173.7	-173.7	168.1	2.4	118.3
214	G	29.9	Very low	30.4	Very low	76 Å²	76	133.4 Å²	133.4	78%	0.784	81%	0.806	S	S	*	*			trans	-173.5	144.1	163	0	0	0	0	0	113.8
215	T	33.3	Very low	30.7	Very low	135 Å²	135	131.7 Å²	131.7	83%	0.828	81%	0.806	S	S	*	*			trans	-150.8	159.8	178.1	52	0	0	0	0	109.7
216	P	47.1	Very low	30.7	Very low	116 Å²	116	129.7 Å²	129.7	75%	0.753	80%	0.801	S	S	*	*			cis	-89.8	-132.3	-43.2	20	-2.7	0	0	0	110.5
217	E	31.1	Very low	31.2	Very low	183 Å²	183	129.6 Å²	129.6	86%	0.855	81%	0.806	S	S	*	*			cis	-156	-179.9	40.3	-66.3	-160.8	132	0	0	113.4
218	S	29.3	Very low	31.2	Very low	129 Å²	129	133.1 Å²	133.1	90%	0.902	81%	0.81	S	S	*	*			trans	-73.1	156.7	-168.5	-48.4	0	0	0	0	117.9
219	G	30.5	Very low	31.2	Very low	65 Å²	65	135 Å²	135	67%	0.67	81%	0.81	S	S	*	*			trans	160.3	80.2	162.8	0	0	0	0	0	115.4
220	T	29.4	Very low	31.2	Very low	130 Å²	130	129.9 Å²	129.9	80%	0.798	81%	0.807	S	S	*	*				69.2	120.5	93.8	60.6	0	0	0	0	118.6
221	S	29.5	Very low	31.3	Very low	123 Å²	123	134.7 Å²	134.7	86%	0.86	82%	0.816	S	S	*	*			trans	65.6	126.1	145.8	59.9	0	0	0	0	122.2
222	G	29.6	Very low	31.3	Very low	78 Å²	78	135.7 Å²	135.7	80%	0.804	82%	0.816	S	S	*	*			trans	-177.9	141.2	161.5	0	0	0	0	0	110.9
223	Q	30.5	Very low	30.8	Very low	190 Å²	190	139.7 Å²	139.7	89%	0.888	83%	0.825	S	S	*	*			trans	-134.9	162.3	-179	-75.1	-173.3	-8.3	0	0	111.6
224	S	27.5	Very low	30.9	Very low	122 Å²	122	133.1 Å²	133.1	85%	0.853	82%	0.818	S	S	*	*			trans	69.5	158.9	169.5	80.1	0	0	0	0	115.7
225	S	31.1	Very low	30.9	Very low	105 Å²	105	136.9 Å²	136.9	73%	0.734	81%	0.814	S	S	*	*			cis	-143.9	178.2	3.2	62.4	0	0	0	0	112.1
226	D	27.9	Very low	31	Very low	141 Å²	141	135.3 Å²	135.3	75%	0.754	81%	0.807	S	S	*	*			trans	-61.5	150.1	179.9	-45.7	-104.2	0	0	0	114.7
227	T	32.5	Very low	30.5	Very low	138 Å²	138	137 Å²	137	85%	0.847	80%	0.804	S	S	*	*				-178.4	134.8	109.3	24.1	0	0	0	0	115.2
228	E	29.4	Very low	30.7	Very low	184 Å²	184	135.2 Å²	135.2	86%	0.86	80%	0.796	S	S	*	*			trans	21.7	112.4	138.9	-168	170.7	107.5	0	0	121.7
229	S	28.9	Very low	31.3	Very low	119 Å²	119	132.2 Å²	132.2	83%	0.832	78%	0.775	S	S	*	*				-169.4	147.1	121.2	-85.6	0	0	0	0	111.7
230	G	30.8	Very low	31.9	Very low	74 Å²	74	133.2 Å²	133.2	76%	0.763	77%	0.768	S	S	*	*			trans	-81.9	160	-167.8	0	0	0	0	0	116
231	Y	29.8	Very low	32.3	Very low	231 Å²	231	132.1 Å²	132.1	91%	0.906	76%	0.757	S	S	*	*			trans	-137.6	157	170.3	-122.8	-94	0	0	0	112.2
232	L	30.6	Very low	32.8	Very low	148 Å²	148	135.1 Å²	135.1	78%	0.775	75%	0.749	S	S	*	*			trans	-69.4	137	-169.5	-79.5	69.7	0	0	0	113.5	S234	L232-S234 PolarHBondContact O-N 3.34Å
233	Q	31	Very low	33.6	Very low	197 Å²	197	136.4 Å²	136.4	92%	0.921	74%	0.737	S	S	*	*			trans	-58.7	116.8	155.4	-160.7	91.8	1	0	0	108.5
234	S	28.8	Very low	33.8	Very low	112 Å²	112	135.6 Å²	135.6	78%	0.783	73%	0.727	S	S	*	*			trans	-125.3	139.7	175	55.7	0	0	0	0	111.2	L232	L232-S234 PolarHBondContact O-N 3.34Å
235	H	30.6	Very low	34.5	Very low	154 Å²	154	133 Å²	133	71%	0.713	71%	0.709	S	S	*	*			trans	-94.4	148.9	-169.7	-141.1	36.6	0	0	0	110.7	Q237	H235-Q237 PolarHBondContact O-N 3.06Å
236	P	35.5	Very low	34.9	Very low	103 Å²	103	130.8 Å²	130.8	67%	0.669	70%	0.697	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.4	31.6	-162.9	33.5	-37.5	0	0	0	115.3	S239	P236-S239 PolarHBondContact O-OG 2.9Å
237	Q	37.1	Very low	35.5	Very low	151 Å²	151	129.7 Å²	129.7	71%	0.706	69%	0.69	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80	-26.3	178.2	-71.6	177.9	-38.2	0	0	113.2	H235 S239 V240	H235-Q237 PolarHBondContact O-N 3.06Å; Q237-S239 PolarHBondContact O-N 3.24Å; Q237-S239 VanDerWaalsContact O-N 3.1Å; Q237-V240 PolarHBondContact O-N 2.76Å
238	H	35.3	Very low	35.7	Very low	146 Å²	146	131.6 Å²	131.6	68%	0.676	68%	0.683	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.6	4	-168.8	-142.1	-44.6	0	0	0	115.6
239	S	41.4	Very low	36.2	Very low	65 Å²	65	125.4 Å²	125.4	46%	0.455	66%	0.664	S	S	.	*	T	Hydrogen-bonded Turn	trans	-88.4	-41	173.9	53.2	0	0	0	0	112.4	P236 Q237 D241 R242 I243	P236-S239 PolarHBondContact O-OG 2.9Å; Q237-S239 PolarHBondContact O-N 3.24Å; Q237-S239 VanDerWaalsContact O-N 3.1Å; S239-D241 PolarHBondContact O-N 2.7Å; S239-R242 PolarHBondContact O-N 3.03Å; S239-I243 PolarHBondContact O-N 3.05Å
240	V	41.9	Very low	36.5	Very low	87 Å²	87	124 Å²	124	53%	0.527	65%	0.653	S	S	.	*	H	α-helix	trans	-66.8	-41.6	-172.8	-167.6	0	0	0	0	111.4	Q237 R242 I243 Y244	Q237-V240 PolarHBondContact O-N 2.76Å; V240-R242 VanDerWaalsContact C-N 3.33Å; V240-R242 PolarHBondContact O-N 2.93Å; V240-I243 WeakPolarHBondContact O-CB 3.42Å; V240-I243 PolarHBondContact O-N 3.38Å; V240-I243 VanDerWaalsContact O-N 3.11Å; V240-Y244 PolarHBondContact O-N 3.16Å
241	D	38.2	Very low	36.8	Very low	107 Å²	107	125.1 Å²	125.1	57%	0.572	65%	0.649	S	S	*	*	H	α-helix	trans	-65.4	-35	-177.2	-155.9	-90.7	0	0	0	112.9	S239 I243 Y244 S245	S239-D241 PolarHBondContact O-N 2.7Å; D241-I243 VanDerWaalsContact C-N 3.34Å; D241-I243 PolarHBondContact O-N 3.48Å; D241-Y244 PolarHBondContact O-N 3.35Å; D241-S245 WeakPolarHBondContact O-CB 3.28Å; D241-S245 PolarHBondContact O-N 3.01Å; D241-S245 PolarHBondContact O-OG 3.32Å
242	R	40.2	Very low	37.2	Very low	185 Å²	185	121 Å²	121	70%	0.698	64%	0.64	S	S	*	*	H	α-helix	trans	-65.6	-35.5	173.1	-108.9	-170	-72.2	-171.7	-4.7	112.6	S239 V240 A246	S239-R242 PolarHBondContact O-N 3.03Å; V240-R242 VanDerWaalsContact C-N 3.33Å; V240-R242 PolarHBondContact O-N 2.93Å; R242-A246 WeakPolarHBondContact O-CB 3.27Å; R242-A246 PolarHBondContact O-N 2.84Å; R242-A246 VanDerWaalsContact O-N 3.13Å
243	I	46	Very low	37.6	Very low	106 Å²	106	121.7 Å²	121.7	54%	0.544	64%	0.639	S	S	.	*	H	α-helix	trans	-70	-43.7	176.5	-63	167	0	0	0	109.8	S239 V240 D241 A246 L247	S239-I243 PolarHBondContact O-N 3.05Å; V240-I243 WeakPolarHBondContact O-CB 3.42Å; V240-I243 PolarHBondContact O-N 3.38Å; V240-I243 VanDerWaalsContact O-N 3.11Å; D241-I243 VanDerWaalsContact C-N 3.34Å; D241-I243 PolarHBondContact O-N 3.48Å; I243-A246 PolarHBondContact O-N 2.84Å; I243-L247 HydrophobicContact CG2-CD1 4.1Å; I243-L247 WeakPolarHBondContact O-CG 3.37Å; I243-L247 PolarHBondContact O-N 2.85Å; I243-L247 VanDerWaalsContact O-N 3.1Å
244	Y	36.1	Very low	37.8	Very low	172 Å²	172	120 Å²	120	68%	0.675	64%	0.636	S	S	*	*	H	α-helix	trans	-61.2	-44.9	175.8	-116.4	-91.4	0	0	0	112.4	V240 D241 A246 L247 Y248	V240-Y244 PolarHBondContact O-N 3.16Å; D241-Y244 PolarHBondContact O-N 3.35Å; Y244-A246 PolarHBondContact O-N 3.45Å; Y244-L247 PolarHBondContact O-N 2.8Å; Y244-Y248 PolarHBondContact O-N 3.27Å
245	S	41.3	Very low	37.9	Very low	69 Å²	69	117.5 Å²	117.5	48%	0.483	63%	0.628	S	S	.	*	H	α-helix	trans	-61.3	-40.3	177.3	-66.3	0	0	0	0	112.9	D241 Y248 A249	D241-S245 WeakPolarHBondContact O-CB 3.28Å; D241-S245 PolarHBondContact O-N 3.01Å; D241-S245 PolarHBondContact O-OG 3.32Å; S245-Y248 PolarHBondContact O-N 3.05Å; S245-A249 PolarHBondContact O-N 3.11Å; S245-A249 VanDerWaalsContact O-N 3.14Å
246	A	39	Very low	38	Very low	58 Å²	58	116.2 Å²	116.2	48%	0.479	64%	0.636	S	S	.	*	H	α-helix	trans	-66.2	-42.2	176.7	0	0	0	0	0	112.4	R242 I243 Y244 Y248 A249 C250	R242-A246 WeakPolarHBondContact O-CB 3.27Å; R242-A246 PolarHBondContact O-N 2.84Å; R242-A246 VanDerWaalsContact O-N 3.13Å; I243-A246 PolarHBondContact O-N 2.84Å; Y244-A246 PolarHBondContact O-N 3.45Å; A246-Y248 VanDerWaalsContact C-N 3.34Å; A246-Y248 PolarHBondContact O-N 3.37Å; A246-A249 PolarHBondContact O-N 3.47Å; A246-C250 PolarHBondContact O-N 3.45Å
247	L	40.1	Very low	37.7	Very low	118 Å²	118	115 Å²	115	62%	0.618	64%	0.642	S	S	*	*	H	α-helix	trans	-65.9	-36.5	177.3	-69.1	169.8	0	0	0	112.2	I243 Y244	I243-L247 HydrophobicContact CG2-CD1 4.1Å; I243-L247 WeakPolarHBondContact O-CG 3.37Å; I243-L247 PolarHBondContact O-N 2.85Å; I243-L247 VanDerWaalsContact O-N 3.1Å; Y244-L247 PolarHBondContact O-N 2.8Å
248	Y	38.5	Very low	37.4	Very low	178 Å²	178	117.4 Å²	117.4	70%	0.698	65%	0.654	S	S	*	*	H	α-helix	trans	-65.6	-40.7	175.5	-162.8	-102.8	0	0	0	112.1	Y244 S245 A246 C250 S251	Y244-Y248 PolarHBondContact O-N 3.27Å; S245-Y248 PolarHBondContact O-N 3.05Å; A246-Y248 VanDerWaalsContact C-N 3.34Å; A246-Y248 PolarHBondContact O-N 3.37Å; Y248-C250 PolarHBondContact O-N 3.1Å; Y248-S251 WeakPolarHBondContact O-CB 3.03Å; Y248-S251 PolarHBondContact O-N 3.36Å
249	A	38.5	Very low	37.3	Very low	54 Å²	54	120 Å²	120	45%	0.446	66%	0.657	S	S	.	*	H	α-helix	trans	-61.7	-40.4	178.1	0	0	0	0	0	113.1	S245 A246 S251 M252	S245-A249 PolarHBondContact O-N 3.11Å; S245-A249 VanDerWaalsContact O-N 3.14Å; A246-A249 PolarHBondContact O-N 3.47Å; A249-S251 VanDerWaalsContact C-N 3.27Å; A249-S251 PolarHBondContact O-N 3.4Å; A249-M252 PolarHBondContact O-N 3.01Å
250	C	35.8	Very low	36.5	Very low	90 Å²	90	122.7 Å²	122.7	61%	0.608	68%	0.676	S	S	*	*	H	α-helix	trans	-64.6	-27.8	176.9	-70.8	0	0	0	0	113.6	A246 Y248 M252	A246-C250 PolarHBondContact O-N 3.45Å; Y248-C250 PolarHBondContact O-N 3.1Å; C250-M252 VanDerWaalsContact C-N 3.27Å; C250-M252 PolarHBondContact O-N 2.92Å
251	S	37.6	Very low	35.9	Very low	96 Å²	96	125.5 Å²	125.5	67%	0.671	68%	0.681	S	S	*	*	H	α-helix	trans	-70.4	-21	-176.8	-160.4	0	0	0	0	113.7	Y248 A249	Y248-S251 WeakPolarHBondContact O-CB 3.03Å; Y248-S251 PolarHBondContact O-N 3.36Å; A249-S251 VanDerWaalsContact C-N 3.27Å; A249-S251 PolarHBondContact O-N 3.4Å
252	M	37.1	Very low	35.4	Very low	146 Å²	146	131.5 Å²	131.5	72%	0.719	70%	0.698	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.4	-4	-174.7	-68.1	-65.3	-71.2	0	0	114.7	A249 C250	A249-M252 PolarHBondContact O-N 3.01Å; C250-M252 VanDerWaalsContact C-N 3.27Å; C250-M252 PolarHBondContact O-N 2.92Å
253	Q	39.6	Very low	34.7	Very low	162 Å²	162	128.4 Å²	128.4	76%	0.757	70%	0.704	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.7	-3.9	-172.3	-68.6	-171.6	-6	0	0	115.6
254	N	34.6	Very low	33.7	Very low	162 Å²	162	126.9 Å²	126.9	87%	0.866	71%	0.714	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.5	20	176	-77.3	-26.2	0	0	0	114	S256	N254-S256 PolarHBondContact O-N 3.13Å
255	G	30.6	Very low	33.3	Very low	59 Å²	59	123.1 Å²	123.1	61%	0.608	72%	0.719	S	S	*	*	S	Bend	trans	-89.6	94.9	172.2	0	0	0	0	0	112.7
256	S	32.9	Very low	32.6	Very low	126 Å²	126	126.2 Å²	126.2	88%	0.881	74%	0.735	S	S	*	*			trans	44.2	110.1	162.7	59.5	0	0	0	0	118.7	N254	N254-S256 PolarHBondContact O-N 3.13Å
257	G	28.9	Very low	32.1	Very low	77 Å²	77	130.1 Å²	130.1	79%	0.794	75%	0.752	S	S	*	*			trans	-135.3	55.9	178.9	0	0	0	0	0	115.6	R259	G257-R259 PolarHBondContact O-N 2.92Å
258	E	32	Very low	31.5	Very low	203 Å²	203	128.5 Å²	128.5	95%	0.949	75%	0.751	S	S	*	*			trans	-76.5	108.4	162	-74.7	-155.9	140.7	0	0	109.9	S260	E258-S260 PolarHBondContact O-N 3.38Å
259	R	32.6	Very low	31.1	Very low	201 Å²	201	127.2 Å²	127.2	76%	0.758	75%	0.751	S	S	*	*			trans	-94.3	91.8	-170	-171.2	-176	-167.3	176.4	7.2	111.7	G257 F261	G257-R259 PolarHBondContact O-N 2.92Å; R259-F261 HydrophobicContact CG-CD2 4.27Å; R259-F261 HydrophobicContact CG-CE2 4.16Å; R259-F261 PolarHBondContact O-N 3.47Å
260	S	25.5	Very low	30.5	Very low	120 Å²	120	131.7 Å²	131.7	84%	0.839	76%	0.762	S	S	*	*			trans	-76	121	164.6	-168	0	0	0	0	110.3	E258	E258-S260 PolarHBondContact O-N 3.38Å
261	F	29.4	Very low	30.1	Very low	147 Å²	147	134.4 Å²	134.4	65%	0.645	77%	0.766	S	S	*	*			trans	-88.2	128.1	168.3	-81.5	-99.7	0	0	0	109.4	R259	R259-F261 HydrophobicContact CG-CD2 4.27Å; R259-F261 HydrophobicContact CG-CE2 4.16Å; R259-F261 PolarHBondContact O-N 3.47Å
262	Y	26.1	Very low	29.7	Very low	233 Å²	233	135.4 Å²	135.4	91%	0.914	77%	0.768	S	S	*	*			trans	-154.4	154.8	135.7	-126.9	-87.6	0	0	0	110.8
263	S	26.1	Very low	29.3	Very low	120 Å²	120	132 Å²	132	84%	0.839	76%	0.763	S	S	*	*			trans	-84.5	142.6	-178	-169.2	0	0	0	0	111.7
264	G	24.7	Very low	28.8	Very low	73 Å²	73	133.1 Å²	133.1	75%	0.753	77%	0.773	S	S	*	*			trans	-160.6	129.9	-179	0	0	0	0	0	112.7
265	A	27.5	Very low	28.3	Very low	94 Å²	94	129 Å²	129	78%	0.777	77%	0.77	S	S	*	*			trans	-80.1	146.9	-167.2	0	0	0	0	0	115.7
266	V	28.1	Very low	28.4	Very low	134 Å²	134	134.3 Å²	134.3	81%	0.812	78%	0.783	S	S	*	*			trans	33.5	126.2	132.5	-165.7	0	0	0	0	119.2
267	V	27.9	Very low	28.5	Very low	139 Å²	139	134.3 Å²	134.3	84%	0.842	78%	0.78	S	S	*	*				173.8	151.8	123.4	151.6	0	0	0	0	110.9
268	S	27	Very low	28.5	Very low	85 Å²	85	141.1 Å²	141.1	59%	0.594	78%	0.782	S	S	*	*			trans	-86.7	161.2	178.5	169.7	0	0	0	0	112.9
269	H	29.4	Very low	28.2	Very low	151 Å²	151	135.7 Å²	135.7	70%	0.699	76%	0.76	S	S	*	*				153	134	124	-86.2	-76.2	0	0	0	114.6
270	H	27.6	Very low	28.1	Very low	147 Å²	147	135 Å²	135	68%	0.681	77%	0.765	S	S	*	*			trans	46.8	147	131.2	-73.8	-136	0	0	0	120.2
271	E	27.4	Very low	28.4	Very low	147 Å²	147	137.4 Å²	137.4	69%	0.687	76%	0.762	S	S	*	*			cis	-165.1	173.1	13.5	-131.5	-179.1	79.8	0	0	114.8
272	T	28.3	Very low	28.3	Very low	118 Å²	118	139.1 Å²	139.1	72%	0.724	78%	0.775	S	S	*	*			trans	40	145.7	137.9	-60.8	0	0	0	0	122.5
273	A	29	Very low	28.7	Very low	74 Å²	74	136.2 Å²	136.2	61%	0.612	77%	0.769	S	S	*	*			cis	-176.3	152	-33.7	0	0	0	0	0	109.4
274	L	29.5	Very low	29.1	Very low	185 Å²	185	137 Å²	137	97%	0.969	76%	0.764	S	S	*	*			trans	57.9	134.5	158.8	-60.8	172.6	0	0	0	120.7
275	G	24.5	Very low	30.2	Very low	77 Å²	77	136.8 Å²	136.8	79%	0.794	75%	0.749	S	S	*	*			trans	149.8	104.9	159.1	0	0	0	0	0	115.9
276	L	31.5	Very low	31	Very low	169 Å²	169	135.5 Å²	135.5	89%	0.885	74%	0.735	S	S	*	*			trans	-126.5	146.6	161.4	-81.9	174	0	0	0	108.4
277	P	35.2	Very low	31.5	Very low	127 Å²	127	136.9 Å²	136.9	83%	0.825	73%	0.726	S	S	*	*				-140.2	-177.3	104.1	39.3	-27	0	0	0	114.6
278	R	29.1	Very low	32.5	Very low	219 Å²	219	133.9 Å²	133.9	83%	0.826	70%	0.704	S	S	*	*			trans	-63.5	172.2	174.6	-58.2	162.5	54.6	159.1	-0.2	111.4
279	D	25.3	Very low	33.5	Very low	90 Å²	90	134.3 Å²	134.3	48%	0.481	70%	0.703	S	S	.	*			cis	-162.7	148.8	22.8	-154	-67.9	0	0	0	110.8
280	H	31.7	Very low	34.2	Very low	187 Å²	187	134.3 Å²	134.3	87%	0.866	70%	0.697	S	S	*	*			trans	-174.1	144.7	141.4	-101.9	10.9	0	0	0	113.5
281	H	31.3	Very low	35.2	Very low	170 Å²	170	131.8 Å²	131.8	79%	0.787	69%	0.688	S	S	*	*			trans	-70.6	146.6	175.1	-90.4	-129	0	0	0	113.1
282	M	27.5	Very low	35.9	Very low	183 Å²	183	130.9 Å²	130.9	90%	0.901	68%	0.683	S	S	*	*			trans	-126.1	143.6	137.4	-115.8	-158	76	0	0	108.5
283	E	33.6	Very low	36.9	Very low	172 Å²	172	131.1 Å²	131.1	80%	0.804	68%	0.676	S	S	*	*			trans	-77.4	132.7	-172.1	-63	178.1	101.4	0	0	112.6
284	D	35.8	Very low	37.6	Very low	135 Å²	135	136.3 Å²	136.3	72%	0.722	68%	0.68	S	S	*	*			trans	-77.7	128.8	175.7	-145.9	-15.9	0	0	0	110.1	S286	D284-S286 PolarHBondContact O-N 2.95Å
285	P	47.3	Very low	38.3	Very low	69 Å²	69	130.7 Å²	130.7	45%	0.448	66%	0.656	S	S	.	*			trans	-61.6	111.7	-170.2	-29.2	38.2	0	0	0	114.8	W287 I288	P285-W287 VanDerWaalsContact CB-CD1 3.44Å; P285-W287 PolarHBondContact O-N 3.34Å; P285-I288 PolarHBondContact O-N 3.3Å
286	S	44.8	Very low	39.4	Very low	68 Å²	68	131.3 Å²	131.3	48%	0.476	64%	0.638	S	S	.	*	T	Hydrogen-bonded Turn	trans	-59.8	6.8	-173.2	71.1	0	0	0	0	117.7	D284 R290	D284-S286 PolarHBondContact O-N 2.95Å; S286-R290 PolarHBondContact O-NE 3.36Å; S286-R290 PolarHBondContact O-NH2 3.34Å; S286-R290 PolarHBondContact OG-NH2 2.85Å
287	W	38.8	Very low	40.1	Very low	162 Å²	162	128.8 Å²	128.8	61%	0.614	62%	0.622	S	S	*	*	H	α-helix	trans	-83.6	-30.4	168.1	71.4	-79.2	0	0	0	112.1	P285 R290 I291	P285-W287 VanDerWaalsContact CB-CD1 3.44Å; P285-W287 PolarHBondContact O-N 3.34Å; W287-R290 PolarHBondContact O-N 3.41Å; W287-I291 HydrophobicContact CE3-CD1 3.52Å; W287-I291 HydrophobicContact CZ3-CD1 3.63Å; W287-I291 WeakPolarHBondContact O-CG1 2.89Å; W287-I291 PolarHBondContact O-N 3.16Å; W287-I291 VanDerWaalsContact O-N 3.11Å
288	I	48.1	Very low	40.2	Very low	77 Å²	77	128.5 Å²	128.5	40%	0.395	61%	0.611	S	S	.	*	H	α-helix	trans	-67	-47.9	178.8	-60.5	175	0	0	0	109.9	P285 R290 I291 H292	P285-I288 PolarHBondContact O-N 3.3Å; I288-R290 VanDerWaalsContact C-N 3.32Å; I288-R290 PolarHBondContact O-N 3.15Å; I288-I291 PolarHBondContact O-N 3.35Å; I288-I291 VanDerWaalsContact O-N 3.11Å; I288-H292 PolarHBondContact O-N 3.09Å
289	T	48.9	Very low	40.8	Very low	93 Å²	93	124.1 Å²	124.1	57%	0.571	60%	0.6	S	S	*	*	H	α-helix	trans	-58.4	-42.7	177	-24.5	0	0	0	0	111.8	I291 H292 E293	T289-I291 VanDerWaalsContact C-N 3.32Å; T289-I291 PolarHBondContact O-N 3.19Å; T289-H292 PolarHBondContact O-N 3.07Å; T289-E293 WeakPolarHBondContact O-CB 3.11Å; T289-E293 PolarHBondContact O-N 3.21Å
290	R	43.4	Very low	41.6	Very low	152 Å²	152	126.7 Å²	126.7	57%	0.574	60%	0.603	S	S	*	*	H	α-helix	trans	-70.3	-22.4	177.6	-82.4	-179	-79.4	173.3	-10.5	114.1	S286 W287 I288 R294	S286-R290 PolarHBondContact O-NE 3.36Å; S286-R290 PolarHBondContact O-NH2 3.34Å; S286-R290 PolarHBondContact OG-NH2 2.85Å; W287-R290 PolarHBondContact O-N 3.41Å; I288-R290 VanDerWaalsContact C-N 3.32Å; I288-R290 PolarHBondContact O-N 3.15Å; R290-R294 WeakPolarHBondContact O-CB 3.21Å; R290-R294 PolarHBondContact O-N 2.86Å
291	I	47.3	Very low	42.1	Very low	94 Å²	94	126 Å²	126	48%	0.482	59%	0.594	S	S	.	*	H	α-helix	trans	-73.9	-45.8	168	-72.1	170.1	0	0	0	109.7	W287 I288 T289 R294 S295	W287-I291 HydrophobicContact CE3-CD1 3.52Å; W287-I291 HydrophobicContact CZ3-CD1 3.63Å; W287-I291 WeakPolarHBondContact O-CG1 2.89Å; W287-I291 PolarHBondContact O-N 3.16Å; W287-I291 VanDerWaalsContact O-N 3.11Å; I288-I291 PolarHBondContact O-N 3.35Å; I288-I291 VanDerWaalsContact O-N 3.11Å; T289-I291 VanDerWaalsContact C-N 3.32Å; T289-I291 PolarHBondContact O-N 3.19Å; I291-R294 PolarHBondContact O-N 3.2Å; I291-S295 PolarHBondContact O-N 2.79Å
292	H	43.3	Very low	42.5	Very low	127 Å²	127	124 Å²	124	59%	0.588	59%	0.588	S	S	*	*	H	α-helix	trans	-61.2	-47.5	179.2	-122.3	104.7	0	0	0	112.7	I288 T289 R294 S295 Q296	I288-H292 PolarHBondContact O-N 3.09Å; T289-H292 PolarHBondContact O-N 3.07Å; H292-R294 VanDerWaalsContact C-N 3.31Å; H292-R294 PolarHBondContact O-N 2.75Å; H292-S295 PolarHBondContact O-N 3.04Å; H292-Q296 PolarHBondContact O-N 3.3Å
293	E	49	Very low	43.1	Very low	123 Å²	123	120.1 Å²	120.1	58%	0.575	58%	0.579	S	S	*	*	H	α-helix	trans	-57.3	-43.2	174.9	-179.8	178.5	-143.3	0	0	111.8	T289 Q296 Q297	T289-E293 WeakPolarHBondContact O-CB 3.11Å; T289-E293 PolarHBondContact O-N 3.21Å; E293-Q296 PolarHBondContact O-N 3.47Å; E293-Q297 WeakPolarHBondContact O-CB 3.13Å; E293-Q297 PolarHBondContact O-N 2.66Å
294	R	42.9	Very low	43.4	Very low	184 Å²	184	116.9 Å²	116.9	69%	0.694	57%	0.571	S	S	*	*	H	α-helix	trans	-72.5	-31.5	-179.6	-170.5	172.3	-178.2	166.1	1.6	113.3	R290 I291 H292 M298	R290-R294 WeakPolarHBondContact O-CB 3.21Å; R290-R294 PolarHBondContact O-N 2.86Å; I291-R294 PolarHBondContact O-N 3.2Å; H292-R294 VanDerWaalsContact C-N 3.31Å; H292-R294 PolarHBondContact O-N 2.75Å; R294-M298 PolarHBondContact O-N 3.45Å; R294-M298 VanDerWaalsContact O-N 3.12Å
295	S	45.8	Very low	43.3	Very low	67 Å²	67	115.6 Å²	115.6	47%	0.469	57%	0.568	S	S	.	*	H	α-helix	trans	-65	-48.8	168.5	-75.2	0	0	0	0	111.2	I291 H292 Q297 M298 E299	I291-S295 PolarHBondContact O-N 2.79Å; H292-S295 PolarHBondContact O-N 3.04Å; S295-Q297 VanDerWaalsContact C-N 3.27Å; S295-Q297 PolarHBondContact O-N 2.89Å; S295-M298 WeakPolarHBondContact O-CA 3.24Å; S295-M298 WeakPolarHBondContact O-CB 3.25Å; S295-M298 PolarHBondContact O-N 2.79Å; S295-E299 PolarHBondContact O-N 2.65Å
296	Q	47.2	Very low	42.7	Very low	90 Å²	90	117.9 Å²	117.9	42%	0.421	58%	0.583	S	S	.	*	H	α-helix	trans	-62.3	-34.3	176.6	-69.2	-171.4	9.4	0	0	112.6	H292 E293 M298 E299 R300	H292-Q296 PolarHBondContact O-N 3.3Å; E293-Q296 PolarHBondContact O-N 3.47Å; Q296-M298 VanDerWaalsContact C-N 3.31Å; Q296-E299 PolarHBondContact O-N 2.89Å; Q296-R300 WeakPolarHBondContact O-CB 3.46Å; Q296-R300 VanDerWaalsContact O-CG 3.29Å; Q296-R300 WeakPolarHBondContact O-CG 3.32Å; Q296-R300 PolarHBondContact O-N 3.27Å
297	Q	46.3	Very low	42.3	Very low	116 Å²	116	123.6 Å²	123.6	54%	0.542	60%	0.602	S	S	.	*	H	α-helix	trans	-66.2	-33.9	174.5	-166.2	175.8	37.3	0	0	112.1	E293 S295 Y301	E293-Q297 WeakPolarHBondContact O-CB 3.13Å; E293-Q297 PolarHBondContact O-N 2.66Å; S295-Q297 VanDerWaalsContact C-N 3.27Å; S295-Q297 PolarHBondContact O-N 2.89Å; Q297-Y301 PolarHBondContact O-N 2.76Å
298	M	36.7	Very low	41.9	Very low	120 Å²	120	122.3 Å²	122.3	59%	0.591	61%	0.612	S	S	*	*	H	α-helix	trans	-67.6	-47.1	172.4	-167.5	76.4	78	0	0	111.4	R294 S295 Q296 R300 Y301 L302	R294-M298 PolarHBondContact O-N 3.45Å; R294-M298 VanDerWaalsContact O-N 3.12Å; S295-M298 WeakPolarHBondContact O-CA 3.24Å; S295-M298 WeakPolarHBondContact O-CB 3.25Å; S295-M298 PolarHBondContact O-N 2.79Å; Q296-M298 VanDerWaalsContact C-N 3.31Å; M298-R300 PolarHBondContact O-N 2.78Å; M298-Y301 WeakPolarHBondContact O-CB 3.49Å; M298-Y301 PolarHBondContact O-N 3.47Å; M298-Y301 VanDerWaalsContact O-N 3.14Å; M298-L302 HydrophobicContact CG-CD1 4.2Å; M298-L302 WeakPolarHBondContact O-CG 3.28Å; M298-L302 PolarHBondContact O-N 2.77Å
299	E	42.7	Very low	41.3	Very low	127 Å²	127	124.3 Å²	124.3	59%	0.593	63%	0.628	S	S	*	*	H	α-helix	trans	-64.2	-39.2	-179.7	-70.5	-174	149.4	0	0	112.6	S295 Q296 Y301 L302 S303	S295-E299 PolarHBondContact O-N 2.65Å; Q296-E299 PolarHBondContact O-N 2.89Å; E299-Y301 VanDerWaalsContact C-N 3.32Å; E299-Y301 PolarHBondContact O-N 2.85Å; E299-L302 PolarHBondContact O-N 3.3Å; E299-S303 WeakPolarHBondContact O-CB 3.48Å; E299-S303 PolarHBondContact O-N 2.7Å; E299-S303 PolarHBondContact O-OG 3.24Å
300	R	42.3	Very low	40.5	Very low	145 Å²	145	128.3 Å²	128.3	55%	0.547	64%	0.64	S	S	.	*	H	α-helix	trans	-61.9	-38.4	172.5	-69.9	176.9	-142.9	147.5	4.9	112	Q296 M298 S303 T304	Q296-R300 WeakPolarHBondContact O-CB 3.46Å; Q296-R300 VanDerWaalsContact O-CG 3.29Å; Q296-R300 WeakPolarHBondContact O-CG 3.32Å; Q296-R300 PolarHBondContact O-N 3.27Å; M298-R300 PolarHBondContact O-N 2.78Å; R300-S303 PolarHBondContact O-N 2.72Å; R300-T304 WeakPolarHBondContact O-CG2 3.21Å; R300-T304 PolarHBondContact O-N 3.25Å; R300-T304 PolarHBondContact O-OG1 3.49Å; R300-T304 VanDerWaalsContact O-OG1 3.05Å
301	Y	40.4	Very low	39.6	Very low	173 Å²	173	126.5 Å²	126.5	68%	0.678	65%	0.65	S	S	*	*	H	α-helix	trans	-65.9	-38.9	175	-108.6	-85.8	0	0	0	112.7	Q297 M298 E299 S303 T304	Q297-Y301 PolarHBondContact O-N 2.76Å; M298-Y301 WeakPolarHBondContact O-CB 3.49Å; M298-Y301 PolarHBondContact O-N 3.47Å; M298-Y301 VanDerWaalsContact O-N 3.14Å; E299-Y301 VanDerWaalsContact C-N 3.32Å; E299-Y301 PolarHBondContact O-N 2.85Å; Y301-S303 VanDerWaalsContact C-N 3.34Å; Y301-T304 PolarHBondContact O-OG1 3.47Å; Y301-T304 VanDerWaalsContact O-OG1 3.11Å
302	L	41.6	Very low	38.8	Very low	127 Å²	127	133 Å²	133	67%	0.665	67%	0.668	S	S	*	*	H	α-helix	trans	-73.4	-24.9	177	-67.6	169.2	0	0	0	112.9	M298 E299 T304	M298-L302 HydrophobicContact CG-CD1 4.2Å; M298-L302 WeakPolarHBondContact O-CG 3.28Å; M298-L302 PolarHBondContact O-N 2.77Å; E299-L302 PolarHBondContact O-N 3.3Å; L302-T304 VanDerWaalsContact C-N 3.33Å
303	S	39.1	Very low	38.2	Very low	101 Å²	101	137 Å²	137	71%	0.706	68%	0.684	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.1	-6.6	178.3	-59.5	0	0	0	0	114.2	E299 R300 Y301	E299-S303 WeakPolarHBondContact O-CB 3.48Å; E299-S303 PolarHBondContact O-N 2.7Å; E299-S303 PolarHBondContact O-OG 3.24Å; R300-S303 PolarHBondContact O-N 2.72Å; Y301-S303 VanDerWaalsContact C-N 3.34Å
304	T	39	Very low	37.2	Very low	104 Å²	104	139 Å²	139	64%	0.638	69%	0.693	S	S	*	*	T	Hydrogen-bonded Turn	trans	-111.6	6.2	-171.9	48.2	0	0	0	0	115.6	R300 Y301 L302 P306	R300-T304 WeakPolarHBondContact O-CG2 3.21Å; R300-T304 PolarHBondContact O-N 3.25Å; R300-T304 PolarHBondContact O-OG1 3.49Å; R300-T304 VanDerWaalsContact O-OG1 3.05Å; Y301-T304 PolarHBondContact O-OG1 3.47Å; Y301-T304 VanDerWaalsContact O-OG1 3.11Å; L302-T304 VanDerWaalsContact C-N 3.33Å; T304-P306 WeakPolarHBondContact O-CD 3.35Å
305	T	34.5	Very low	36.6	Very low	109 Å²	109	135.7 Å²	135.7	67%	0.669	70%	0.695	S	S	*	*			trans	-92.2	110.9	171.1	51.6	0	0	0	0	110.5
306	P	34.5	Very low	35.7	Very low	116 Å²	116	143.6 Å²	143.6	75%	0.753	72%	0.715	S	S	*	*			trans	-74.1	139.7	-179	30.1	-34.6	0	0	0	111.9	T304	T304-P306 WeakPolarHBondContact O-CD 3.35Å
307	E	36.4	Very low	34.8	Very low	189 Å²	189	145.4 Å²	145.4	88%	0.883	73%	0.734	S	S	*	*			trans	-72	137	169.7	-60.4	-177	118.2	0	0	110.8
308	T	30.8	Very low	33.8	Very low	134 Å²	134	146 Å²	146	82%	0.822	75%	0.746	S	S	*	*			trans	-130.3	116.8	165.5	55.9	0	0	0	0	109.6
309	T	36.3	Very low	33.2	Very low	119 Å²	119	150.1 Å²	150.1	73%	0.73	76%	0.755	S	S	*	*			trans	-106	171.1	177.3	54.8	0	0	0	0	111.1
310	H	31	Very low	32.5	Very low	178 Å²	178	151.5 Å²	151.5	82%	0.824	77%	0.765	S	S	*	*			trans	89.7	140.5	-167	-67.4	-96.9	0	0	0	115.2
311	C	25.3	Very low	31.8	Very low	114 Å²	114	150.8 Å²	150.8	77%	0.77	77%	0.767	S	S	*	*			cis	-143	164.7	1.8	-147	0	0	0	0	113.8
312	R	30.3	Very low	31.2	Very low	229 Å²	229	148.2 Å²	148.2	86%	0.864	77%	0.77	S	S	*	*			trans	-66.5	139.2	-178.6	-73.1	171.6	161.5	147.2	-8.7	113.5
313	K	30.4	Very low	30.6	Very low	212 Å²	212	150.6 Å²	150.6	92%	0.922	78%	0.782	S	S	*	*			trans	-137.1	134.3	131.2	-72.3	-167.4	179.8	176.2	0	109.9
314	Q	29.1	Very low	30.2	Very low	165 Å²	165	152.3 Å²	152.3	77%	0.771	79%	0.789	S	S	*	*			trans	-114.4	134.9	178.1	-80.8	-89.8	-10.2	0	0	108.6
315	P	30.1	Very low	29.7	Very low	114 Å²	114	150.8 Å²	150.8	74%	0.74	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-72.6	138.8	165.7	31.2	-31.9	0	0	0	109.9
316	R	25.9	Very low	29.4	Very low	233 Å²	233	152.5 Å²	152.5	88%	0.879	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-81.4	146.2	175.9	-68.5	-176.3	177.7	-174.1	0.1	110.8
317	P	27.6	Very low	29.2	Very low	128 Å²	128	154.7 Å²	154.7	83%	0.831	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-70.6	135.4	169.8	30.2	-33.8	0	0	0	110.6
318	V	25.8	Very low	28.6	Very low	130 Å²	130	154.3 Å²	154.3	79%	0.788	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-100.4	122.4	170.6	177.3	0	0	0	0	109	I320	V318-I320 HydrophobicContact CG1-CG1 4.42Å
319	R	24.6	Very low	28.7	Very low	205 Å²	205	155 Å²	155	77%	0.774	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-86.8	126.1	173.9	177.9	-173.3	-175.2	130.9	-2	109.1
320	I	28.7	Very low	28.2	Very low	156 Å²	156	158.4 Å²	158.4	80%	0.8	80%	0.802	S	S	*	*			trans	-114.4	125.6	163.2	-58.6	-177.7	0	0	0	107.4	V318	V318-I320 HydrophobicContact CG1-CG1 4.42Å
321	Q	26.1	Very low	27.9	Very low	130 Å²	130	158 Å²	158	61%	0.607	80%	0.8	S	S	*	*			trans	-86.8	141.8	-178	-168.3	75.4	32.3	0	0	109.3
322	T	29.1	Very low	27.9	Very low	119 Å²	119	160.4 Å²	160.4	73%	0.73	80%	0.8	S	S	*	*			trans	-68.1	149.6	179.6	32.7	0	0	0	0	113.6
323	L	29.1	Very low	27.8	Very low	177 Å²	177	156.8 Å²	156.8	93%	0.927	80%	0.795	S	S	*	*			trans	-132.4	163.5	152	-139.8	76.5	0	0	0	109.5
324	V	30.4	Very low	27.6	Very low	138 Å²	138	155 Å²	155	84%	0.836	79%	0.79	S	S	*	*			trans	-114.6	142.5	-159.3	-179.3	0	0	0	0	111.4
325	G	27.7	Very low	27.5	Very low	71 Å²	71	154.6 Å²	154.6	73%	0.732	79%	0.793	S	S	*	*			trans	176.4	74.3	175.6	0	0	0	0	0	118.2
326	N	27.5	Very low	27.3	Very low	145 Å²	145	156.2 Å²	156.2	78%	0.775	80%	0.795	S	S	*	*			trans	31	114	148.2	-60.2	-2.6	0	0	0	122.5
327	I	30.6	Very low	27.4	Very low	162 Å²	162	154.2 Å²	154.2	83%	0.831	79%	0.789	S	S	*	*			trans	2.1	129.3	134.1	34.3	169.2	0	0	0	119.9
328	H	24.5	Very low	27.5	Very low	181 Å²	181	154.2 Å²	154.2	84%	0.838	78%	0.782	S	S	*	*				-150.8	154.3	122.6	-147.5	-86.1	0	0	0	112.1
329	I	31.9	Very low	27.4	Very low	149 Å²	149	158.5 Å²	158.5	76%	0.764	79%	0.785	S	S	*	*			trans	-104	137	172.3	-66.2	166	0	0	0	108.8
330	K	26.5	Very low	27.8	Very low	191 Å²	191	158 Å²	158	83%	0.83	79%	0.785	S	S	*	*			trans	-164.7	172.3	143.3	-116.3	-175.4	177.5	-155.4	0	113.2
331	Q	25.7	Very low	27.9	Very low	169 Å²	169	153.6 Å²	153.6	79%	0.79	78%	0.778	S	S	*	*			trans	-125.6	140.5	-167.8	159.7	-170.2	-7.5	0	0	108.1
332	E	24.5	Very low	28.2	Very low	165 Å²	165	156.3 Å²	156.3	77%	0.771	79%	0.791	S	S	*	*			trans	163.5	133.4	160.6	-89	138.3	-138.8	0	0	104.8
333	M	28.4	Very low	28.1	Very low	152 Å²	152	159.7 Å²	159.7	75%	0.749	80%	0.798	S	S	*	*			cis	78.2	93.8	42.8	-166.5	-162.8	91.7	0	0	113.2
334	E	26.6	Very low	28.1	Very low	175 Å²	175	161.9 Å²	161.9	82%	0.818	79%	0.794	S	S	*	*				-179.3	155.5	125.8	-99.4	173.3	172.7	0	0	111.6
335	D	25.9	Very low	28.2	Very low	156 Å²	156	161.1 Å²	161.1	83%	0.834	79%	0.79	S	S	*	*			trans	-98.8	155.6	178.4	-52.8	-91.4	0	0	0	111.3
336	D	26.1	Very low	28.2	Very low	149 Å²	149	167 Å²	167	80%	0.797	80%	0.798	S	S	*	*			trans	-168.5	130.1	132.6	-133.9	-140	0	0	0	116.3
337	Y	27	Very low	28.3	Very low	191 Å²	191	167 Å²	167	75%	0.749	80%	0.797	S	S	*	*			trans	31.6	123.2	144.2	-83.8	-100	0	0	0	126.7
338	D	29.8	Very low	28.3	Very low	127 Å²	127	167.2 Å²	167.2	68%	0.679	80%	0.799	S	S	*	*				40.7	136	125	-70.9	-10.8	0	0	0	125.1
339	Y	25.5	Very low	28.5	Very low	220 Å²	220	166.8 Å²	166.8	86%	0.863	80%	0.797	S	S	*	*				-151.9	159.6	121.6	-155.8	-108.3	0	0	0	114.3
340	Y	33	Very low	28.4	Very low	195 Å²	195	169.2 Å²	169.2	77%	0.765	80%	0.797	S	S	*	*			trans	-73.4	168.8	-179.8	-82.2	-118.7	0	0	0	113.4
341	G	29.9	Very low	28.3	Very low	64 Å²	64	164.1 Å²	164.1	66%	0.66	78%	0.779	S	S	*	*			cis	143.2	134.7	-4.7	0	0	0	0	0	114.1
342	Q	32.8	Very low	28.4	Very low	186 Å²	186	163.6 Å²	163.6	87%	0.869	78%	0.776	S	S	*	*			trans	43.1	124.5	154.5	-166.3	169.4	56.6	0	0	121.7
343	Q	25.9	Very low	28.5	Very low	190 Å²	190	160.5 Å²	160.5	89%	0.888	77%	0.773	S	S	*	*			trans	-127.5	145	164.1	-166.5	85.4	38.2	0	0	111.1
344	R	29.5	Very low	28.8	Very low	223 Å²	223	161.4 Å²	161.4	84%	0.842	78%	0.775	S	S	*	*			trans	-112.7	158.8	177.8	-109	177.7	62.3	-178.4	-1.1	112.6
345	V	32.6	Very low	28.8	Very low	123 Å²	123	161.6 Å²	161.6	75%	0.745	78%	0.776	S	S	*	*			trans	-45.6	139.2	171.6	178.8	0	0	0	0	114
346	Q	27.9	Very low	28.9	Very low	195 Å²	195	160.1 Å²	160.1	91%	0.911	78%	0.776	S	S	*	*			trans	-149.3	166.7	146.3	-124	171.9	8.2	0	0	112
347	I	29.4	Very low	29.1	Very low	145 Å²	145	157.8 Å²	157.8	74%	0.744	77%	0.768	S	S	*	*			trans	-121.8	136.3	-167.2	-63.4	162.1	0	0	0	109.4
348	L	30.7	Very low	29.4	Very low	166 Å²	166	157 Å²	157	87%	0.869	77%	0.771	S	S	*	*			trans	-155.6	159.2	139.9	-141	71.4	0	0	0	111.4
349	E	30	Very low	29.6	Very low	172 Å²	172	157.6 Å²	157.6	80%	0.804	77%	0.774	S	S	*	*			trans	-81.9	161.9	-178.1	-50.3	168.5	128.2	0	0	111.8
350	R	27.9	Very low	30	Very low	199 Å²	199	152.5 Å²	152.5	75%	0.751	77%	0.766	S	S	*	*				158.8	140	104.8	-177.6	165.6	-176.9	98.6	22.3	114.3
351	N	25.3	Very low	30	Very low	85 Å²	85	149.2 Å²	149.2	46%	0.455	76%	0.761	S	S	.	*			trans	69.9	119.7	162.6	-76.4	22.8	0	0	0	117.1
352	E	27.3	Very low	30.3	Very low	157 Å²	157	154.1 Å²	154.1	73%	0.734	77%	0.767	S	S	*	*				85.1	136.6	93.3	-71.8	158.9	-164.6	0	0	111.9
353	S	27.5	Very low	30.5	Very low	100 Å²	100	149.4 Å²	149.4	70%	0.699	76%	0.76	S	S	*	*			cis	-156.9	-164.6	-0	52.4	0	0	0	0	111.2
354	E	33.4	Very low	31.1	Very low	172 Å²	172	148.3 Å²	148.3	80%	0.804	76%	0.755	S	S	*	*			trans	-36.7	161.5	177.5	-67.1	124	140.2	0	0	117.5
355	E	27.4	Very low	31.1	Very low	179 Å²	179	139.9 Å²	139.9	84%	0.836	74%	0.738	S	S	*	*				-166.2	177.4	52.4	-158.7	171.6	131.1	0	0	112.6
356	C	27.6	Very low	31.3	Very low	124 Å²	124	139.8 Å²	139.8	84%	0.838	74%	0.738	S	S	*	*			trans	-151.6	116.4	179.3	-170.8	0	0	0	0	114.2
357	T	29.8	Very low	31.3	Very low	101 Å²	101	139.6 Å²	139.6	62%	0.62	74%	0.737	S	S	*	*			trans	-152.7	141.1	168.9	51.3	0	0	0	0	107.3
358	E	34.8	Very low	31.5	Very low	175 Å²	175	137.9 Å²	137.9	82%	0.818	74%	0.737	S	S	*	*				59.9	133.4	63.5	-63.6	-176.6	151	0	0	112.7
359	D	32.6	Very low	31.8	Very low	139 Å²	139	138.4 Å²	138.4	74%	0.743	74%	0.735	S	S	*	*			cis	-166.1	172.6	-14.2	-149.2	-139.6	0	0	0	108.1
360	T	34.7	Very low	32.5	Very low	113 Å²	113	135.6 Å²	135.6	69%	0.693	73%	0.732	S	S	*	*			cis	-127.3	-109.2	2.7	-43.2	0	0	0	0	111.6
361	D	33.3	Very low	33	Very low	125 Å²	125	136 Å²	136	67%	0.668	74%	0.739	S	S	*	*			cis	-154.9	178.1	1.4	-163	14.4	0	0	0	112.7
362	Q	36.6	Very low	33.1	Very low	168 Å²	168	135.2 Å²	135.2	79%	0.785	75%	0.751	S	S	*	*			trans	-74.1	171.1	-169.5	-71.9	157.4	90.8	0	0	116.3
363	A	37.1	Very low	33.1	Very low	86 Å²	86	136.3 Å²	136.3	71%	0.711	76%	0.756	S	S	*	*			cis	-175.3	-170.7	-24.4	0	0	0	0	0	106.3
364	E	36.6	Very low	33.1	Very low	167 Å²	167	136.3 Å²	136.3	78%	0.78	76%	0.756	S	S	*	*			cis	-153.1	-171.9	-4.7	-133.1	-125.4	118.8	0	0	105.8	T366	E364-T366 PolarHBondContact OE1-N 3.35Å
365	G	30.2	Very low	32.8	Very low	47 Å²	47	137.1 Å²	137.1	49%	0.485	76%	0.757	S	S	.	*			cis	177.6	171.6	6.7	0	0	0	0	0	117.7
366	T	37.4	Very low	32.7	Very low	121 Å²	121	134.2 Å²	134.2	74%	0.742	75%	0.748	S	S	*	*			trans	59	142.9	164.7	62.7	0	0	0	0	119	E364	E364-T366 PolarHBondContact OE1-N 3.35Å
367	E	28.2	Very low	32.9	Very low	191 Å²	191	132.3 Å²	132.3	89%	0.893	74%	0.736	S	S	*	*			cis	-111.2	-165.5	7.3	-54.9	175.2	52.5	0	0	111
368	S	33.4	Very low	32.8	Very low	108 Å²	108	131.3 Å²	131.3	76%	0.755	75%	0.746	S	S	*	*			cis	-156.1	-170.7	8.4	68.7	0	0	0	0	113.2
369	E	35.9	Very low	32.4	Very low	178 Å²	178	129.3 Å²	129.3	83%	0.832	75%	0.745	S	S	*	*			trans	-134.7	175.1	-173.9	-97.9	-161	104	0	0	111.9
370	P	44.9	Very low	32.4	Very low	113 Å²	113	128.1 Å²	128.1	73%	0.734	75%	0.747	S	S	*	*			cis	-134.2	-162.4	-25.5	35.2	-15.2	0	0	0	113
371	K	37.9	Very low	32.1	Very low	207 Å²	207	128 Å²	128	90%	0.9	75%	0.752	S	S	*	*			trans	-97.5	158.4	173.6	-83.6	179.9	175.5	175.1	0	114
372	G	27.4	Very low	32.2	Very low	68 Å²	68	127 Å²	127	70%	0.701	75%	0.754	S	S	*	*			trans	149.9	149.8	155.3	0	0	0	0	0	111.7
373	E	28.5	Very low	31.7	Very low	180 Å²	180	127.5 Å²	127.5	84%	0.841	76%	0.76	S	S	*	*			cis	174.3	155.7	-28.4	-115.2	178.5	-143.6	0	0	105.8
374	S	27	Very low	31.2	Very low	100 Å²	100	126.1 Å²	126.1	70%	0.699	76%	0.755	S	S	*	*			trans	80.3	133.2	156.5	117	0	0	0	0	121.5
375	F	26.4	Very low	30.9	Very low	189 Å²	189	125.1 Å²	125.1	83%	0.829	76%	0.76	S	S	*	*			trans	63.4	145	152.7	-76.2	-101.6	0	0	0	120.4
376	D	26.3	Very low	31.1	Very low	118 Å²	118	130.8 Å²	130.8	63%	0.631	77%	0.774	S	S	*	*			cis	-149.4	179.7	-6.8	-160.8	-115.7	0	0	0	113.2
377	S	31.5	Very low	31.5	Very low	85 Å²	85	130.7 Å²	130.7	59%	0.594	78%	0.776	S	S	*	*			trans	-39	164.4	163.1	-28.3	0	0	0	0	116.4
378	G	28.8	Very low	31.6	Very low	80 Å²	80	128.2 Å²	128.2	83%	0.825	77%	0.768	S	S	*	*			cis	99.1	48.9	7	0	0	0	0	0	114.7
379	V	26.3	Very low	31.7	Very low	133 Å²	133	127.6 Å²	127.6	81%	0.806	76%	0.764	S	S	*	*			trans	-128.2	142.1	178.3	-177.3	0	0	0	0	111.5
380	S	31.8	Very low	31.7	Very low	113 Å²	113	124.2 Å²	124.2	79%	0.79	76%	0.755	S	S	*	*			trans	-114.9	134.1	172.6	-58.4	0	0	0	0	111.9
381	S	28.4	Very low	31.1	Very low	112 Å²	112	125.8 Å²	125.8	78%	0.783	75%	0.753	S	S	*	*			trans	-166.2	136.7	151.6	-82.1	0	0	0	0	107.9
382	S	34.4	Very low	30.9	Very low	103 Å²	103	122.7 Å²	122.7	72%	0.72	74%	0.742	S	S	*	*			cis	81.6	137.4	44.9	-59.4	0	0	0	0	112.7
383	I	27.2	Very low	31.1	Very low	178 Å²	178	125.5 Å²	125.5	91%	0.913	74%	0.736	S	S	*	*			trans	76.1	138	-173.1	-50.7	163.5	0	0	0	112.8
384	G	27.4	Very low	31.1	Very low	58 Å²	58	126 Å²	126	60%	0.598	74%	0.736	S	S	*	*			cis	152.6	130.4	-12.5	0	0	0	0	0	114.9
385	T	28.6	Very low	31.1	Very low	146 Å²	146	124.3 Å²	124.3	90%	0.896	74%	0.735	S	S	*	*			trans	75.7	130.9	159.3	-38	0	0	0	0	119.5
386	E	35.3	Very low	32.1	Very low	165 Å²	165	121.8 Å²	121.8	77%	0.771	74%	0.737	S	S	*	*			trans	-39.2	153.8	159.1	-59.2	-66.4	122.7	0	0	114.6
387	P	46.7	Very low	32.1	Very low	120 Å²	120	119.7 Å²	119.7	78%	0.779	74%	0.744	S	S	*	*				-152.4	142.5	76.8	38.6	-18.3	0	0	0	119.6
388	D	29	Very low	31.9	Very low	138 Å²	138	120.8 Å²	120.8	74%	0.738	76%	0.758	S	S	*	*				50.2	155.5	121.8	-150.6	-106.1	0	0	0	124.3
389	S	35.2	Very low	31.8	Very low	95 Å²	95	121.6 Å²	121.6	66%	0.664	76%	0.757	S	S	*	*			trans	79.1	145.1	153.7	-92.5	0	0	0	0	120.2
390	V	36	Very low	31.9	Very low	107 Å²	107	126 Å²	126	65%	0.648	76%	0.759	S	S	*	*			cis	-163.3	160.2	-4	85.4	0	0	0	0	114.1
391	E	33	Very low	31.7	Very low	147 Å²	147	127.1 Å²	127.1	69%	0.687	76%	0.756	S	S	*	*			trans	64.9	155.4	158	-77.8	172.7	82.6	0	0	120.7
392	Q	33.6	Very low	31.7	Very low	141 Å²	141	125.5 Å²	125.5	66%	0.659	76%	0.757	S	S	*	*			cis	-160.5	173.5	9.7	-125.5	-179.5	49.5	0	0	108.4
393	Q	32.5	Very low	31.4	Very low	127 Å²	127	129.7 Å²	129.7	59%	0.593	77%	0.765	S	S	*	*			cis	-162.9	-177.1	-9.7	-150.3	170	69.8	0	0	109.9
394	F	27	Very low	31.4	Very low	191 Å²	191	125.3 Å²	125.3	84%	0.838	76%	0.756	S	S	*	*			trans	77.5	133.8	163.9	-74.5	-72.3	0	0	0	122.6
395	G	27.2	Very low	31.5	Very low	65 Å²	65	130.3 Å²	130.3	67%	0.67	76%	0.763	S	S	*	*			trans	-127.9	-143.5	168.9	0	0	0	0	0	110.4
396	P	48.2	Very low	32.2	Very low	135 Å²	135	128.8 Å²	128.8	88%	0.877	76%	0.756	S	S	*	*			cis	-107.6	-165.4	0.1	43.3	-33.7	0	0	0	111.7
397	G	26.1	Very low	31.8	Very low	75 Å²	75	124.8 Å²	124.8	77%	0.773	75%	0.751	S	S	*	*			cis	121.3	132.2	-3.6	0	0	0	0	0	114.4
398	A	28.1	Very low	30.9	Very low	108 Å²	108	127.2 Å²	127.2	89%	0.893	75%	0.752	S	S	*	*			trans	-150.2	166.4	178.5	0	0	0	0	0	111.1
399	A	25.9	Very low	31.4	Very low	97 Å²	97	125.9 Å²	125.9	80%	0.802	75%	0.751	S	S	*	*			trans	-151.7	169.2	-166.4	0	0	0	0	0	116.1
400	R	29.4	Very low	31.2	Very low	225 Å²	225	127.8 Å²	127.8	85%	0.849	75%	0.749	S	S	*	*			trans	72.1	154.1	169.3	-83.5	-174.2	158.9	132.3	0.1	117.4
401	D	27	Very low	31	Very low	137 Å²	137	130.6 Å²	130.6	73%	0.733	76%	0.755	S	S	*	*			cis	-128.2	158.4	-3.8	-86.9	-59.2	0	0	0	109.9
402	G	28.1	Very low	30.7	Very low	77 Å²	77	128 Å²	128	79%	0.794	76%	0.759	S	S	*	*				90.1	140.6	104.2	0	0	0	0	0	113.6
403	Q	28.1	Very low	30.5	Very low	192 Å²	192	125.8 Å²	125.8	90%	0.897	77%	0.765	S	S	*	*			cis	-167.6	145.4	12.9	176.4	172.1	-17.4	0	0	112
404	A	27.8	Very low	30.2	Very low	86 Å²	86	129.1 Å²	129.1	71%	0.711	78%	0.781	S	S	*	*			trans	60.2	106.1	158.7	0	0	0	0	0	123.2
405	E	28	Very low	30.4	Very low	163 Å²	163	124.2 Å²	124.2	76%	0.762	78%	0.775	S	S	*	*				13.4	155.8	104.7	-86.5	-80.8	94.8	0	0	119.8
406	P	43.2	Very low	31.3	Very low	114 Å²	114	126.9 Å²	126.9	74%	0.74	78%	0.781	S	S	*	*			cis	-145.2	172.3	34.7	44.1	-25.1	0	0	0	121.3
407	A	28	Very low	30.4	Very low	80 Å²	80	124.8 Å²	124.8	66%	0.661	78%	0.775	S	S	*	*			trans	92.7	106.9	139.5	0	0	0	0	0	121.5
408	Q	27.5	Very low	30.4	Very low	172 Å²	172	130.2 Å²	130.2	80%	0.804	78%	0.78	S	S	*	*			trans	-77.8	178.2	143.7	-52.8	-178.1	-52.2	0	0	110
409	P	40.3	Very low	30.4	Very low	110 Å²	110	128.4 Å²	128.4	71%	0.714	77%	0.772	S	S	*	*				-131.3	141.4	73.7	5.7	19.7	0	0	0	114.4
410	E	30.3	Very low	30.3	Very low	134 Å²	134	127.5 Å²	127.5	63%	0.626	77%	0.772	S	S	*	*				83.4	115.5	83	-67.8	-177.5	115.6	0	0	114.5
411	Q	30.9	Very low	30.9	Very low	166 Å²	166	123.2 Å²	123.2	78%	0.776	77%	0.773	S	S	*	*				95.8	154.9	100.5	-80.2	175.1	27.1	0	0	114
412	A	28.1	Very low	31	Very low	92 Å²	92	125.2 Å²	125.2	76%	0.76	78%	0.778	S	S	*	*			cis	-146.1	175.1	-7.6	0	0	0	0	0	111.2
413	A	29.7	Very low	31.6	Very low	96 Å²	96	126.1 Å²	126.1	79%	0.793	77%	0.77	S	S	*	*			trans	-86.9	168.3	-176.2	0	0	0	0	0	114.7
414	E	26	Very low	31.6	Very low	197 Å²	197	122.9 Å²	122.9	92%	0.921	76%	0.759	S	S	*	*			trans	-157.2	163.4	148.1	-120.2	177.9	163.3	0	0	112.9
415	A	30.7	Very low	31.5	Very low	88 Å²	88	126.4 Å²	126.4	73%	0.727	76%	0.761	S	S	*	*			trans	-158	-175.9	178.7	0	0	0	0	0	107.2
416	P	45.2	Very low	31.5	Very low	121 Å²	121	124.8 Å²	124.8	79%	0.786	76%	0.757	S	S	*	*			cis	-139.2	-147.7	3.5	43.5	-22.2	0	0	0	113.2
417	A	29.3	Very low	30.7	Very low	90 Å²	90	126.7 Å²	126.7	74%	0.744	76%	0.756	S	S	*	*			trans	73.2	153.6	160.2	0	0	0	0	0	117.8
418	E	27.2	Very low	30.7	Very low	190 Å²	190	129.3 Å²	129.3	89%	0.888	76%	0.763	S	S	*	*			cis	-164.1	162.1	-10.2	-113.8	-84.8	79.6	0	0	109.3
419	G	28.2	Very low	30.6	Very low	70 Å²	70	124.8 Å²	124.8	72%	0.722	76%	0.763	S	S	*	*			trans	113.9	138	156	0	0	0	0	0	120.8
420	G	24	Very low	29.9	Very low	78 Å²	78	124 Å²	124	80%	0.804	77%	0.766	S	S	*	*			trans	-117.9	-157.9	161.1	0	0	0	0	0	111.1
421	P	40.7	Very low	29.8	Very low	135 Å²	135	123.6 Å²	123.6	88%	0.877	78%	0.778	S	S	*	*			cis	-134.9	-162	8.2	42.7	-23.2	0	0	0	115.1
422	Q	28.9	Very low	29.6	Very low	178 Å²	178	121.1 Å²	121.1	83%	0.832	78%	0.779	S	S	*	*			trans	-76.3	179.2	169.8	-90.5	-164.7	5.4	0	0	113.2
423	P	41.7	Very low	30	Very low	97 Å²	97	122.8 Å²	122.8	63%	0.63	78%	0.782	S	S	*	*			cis	-151.4	-170.5	27.1	45.5	-23.9	0	0	0	120
424	N	27	Very low	29.9	Very low	124 Å²	124	126 Å²	126	66%	0.663	78%	0.781	S	S	*	*			trans	71.5	116	152.5	-74.7	-14.8	0	0	0	120.8
425	Q	27.4	Very low	30	Very low	159 Å²	159	126.7 Å²	126.7	74%	0.743	78%	0.775	S	S	*	*				82.7	143.5	91.1	-73.2	-174.1	72.4	0	0	113.9
426	L	26.5	Very low	29.8	Very low	130 Å²	130	126.5 Å²	126.5	68%	0.681	77%	0.768	S	S	*	*			cis	-155	148.9	41	-163.1	75.6	0	0	0	114.8
427	E	27.6	Very low	28.9	Very low	154 Å²	154	127.7 Å²	127.7	72%	0.72	77%	0.768	S	S	*	*			trans	65.1	137.2	150.1	-89.3	-176	121.6	0	0	128.6
428	T	26.6	Very low	28.9	Very low	134 Å²	134	132.1 Å²	132.1	82%	0.822	77%	0.773	S	S	*	*			trans	67	123.2	149.5	53.7	0	0	0	0	122.6
429	G	26.9	Very low	29.1	Very low	78 Å²	78	129.8 Å²	129.8	80%	0.804	77%	0.772	S	S	*	*			trans	161.1	56.2	163.8	0	0	0	0	0	120.7
430	A	25.6	Very low	29.1	Very low	94 Å²	94	135.5 Å²	135.5	78%	0.777	78%	0.78	S	S	*	*			trans	36.4	120.4	155.6	0	0	0	0	0	123.6
431	S	27.2	Very low	29.5	Very low	124 Å²	124	140.8 Å²	140.8	87%	0.867	79%	0.786	S	S	*	*			trans	72.7	139.7	130.9	-56.9	0	0	0	0	123.3
432	S	26.2	Very low	28.8	Very low	114 Å²	114	141.1 Å²	141.1	80%	0.797	78%	0.78	S	S	*	*			trans	-71.7	160.1	177.7	-56.3	0	0	0	0	115.2
433	P	37.6	Very low	28.8	Very low	128 Å²	128	139.8 Å²	139.8	83%	0.831	78%	0.779	S	S	*	*			trans	-83.4	146.6	177.1	33.6	-35.7	0	0	0	114.1
434	E	27.5	Very low	28.2	Very low	163 Å²	163	141.7 Å²	141.7	76%	0.762	79%	0.788	S	S	*	*			trans	-128	140.8	157.7	-108.4	-152.4	91.3	0	0	109.4
435	R	28.8	Very low	28.2	Very low	212 Å²	212	141.6 Å²	141.6	80%	0.8	79%	0.792	S	S	*	*			trans	49	129.3	137.3	-135.3	177.7	179.6	163.4	-2.8	118.6
436	S	25.8	Very low	28.1	Very low	84 Å²	84	141.4 Å²	141.4	59%	0.587	80%	0.795	S	S	*	*				178.7	-166.3	76.4	-67.2	0	0	0	0	112.2
437	N	26.8	Very low	28	Very low	146 Å²	146	141.5 Å²	141.5	78%	0.781	80%	0.801	S	S	*	*			trans	115.4	96.3	163.3	-59	7.9	0	0	0	111.3
438	E	27.9	Very low	28.1	Very low	183 Å²	183	140 Å²	140	86%	0.855	80%	0.802	S	S	*	*			cis	83.8	154.6	48.2	-57.4	-157.5	120.4	0	0	114
439	V	33	Very low	28	Very low	140 Å²	140	139.3 Å²	139.3	85%	0.848	80%	0.802	S	S	*	*			trans	-130.7	114.7	-165.6	176.9	0	0	0	0	108.4
440	E	27.1	Very low	27.9	Very low	191 Å²	191	143.2 Å²	143.2	89%	0.893	81%	0.805	S	S	*	*			trans	-77.2	145.9	174.3	-78.1	179.5	106.7	0	0	112.3
441	M	33	Very low	27.9	Very low	189 Å²	189	144.6 Å²	144.6	93%	0.931	81%	0.809	S	S	*	*			trans	-157.5	108.2	178.6	-166.5	172.8	-162.1	0	0	107.2
442	D	26.3	Very low	28	Very low	141 Å²	141	144 Å²	144	75%	0.754	81%	0.805	S	S	*	*			trans	-126.3	156.1	-169.8	-147.4	-30.5	0	0	0	112.7
443	N	28.3	Very low	27.9	Very low	151 Å²	151	145.3 Å²	145.3	81%	0.807	80%	0.803	S	S	*	*			trans	-134.5	133	-178.6	-86.3	-52.1	0	0	0	109.5
444	T	28.3	Very low	27.5	Very low	136 Å²	136	147.9 Å²	147.9	83%	0.834	80%	0.801	S	S	*	*			trans	-145.2	147.5	167	-37.1	0	0	0	0	110.8
445	V	27.3	Very low	27.4	Very low	123 Å²	123	144.6 Å²	144.6	75%	0.745	80%	0.796	S	S	*	*			trans	-135.6	161	-172.5	-179.8	0	0	0	0	108.6
446	I	26.4	Very low	27.2	Very low	155 Å²	155	140.3 Å²	140.3	80%	0.795	79%	0.793	S	S	*	*			trans	77.7	130.8	-176.6	-42.8	-178.9	0	0	0	110
447	T	23.6	Very low	27.3	Very low	132 Å²	132	143.2 Å²	143.2	81%	0.81	80%	0.801	S	S	*	*			cis	-143.5	164.6	36.2	-34	0	0	0	0	113.3
448	V	29.2	Very low	27.3	Very low	123 Å²	123	144 Å²	144	75%	0.745	80%	0.8	S	S	*	*			trans	-86.4	145.5	172.4	175.6	0	0	0	0	111.8
449	S	24.5	Very low	27.3	Very low	118 Å²	118	142.8 Å²	142.8	83%	0.825	80%	0.795	S	S	*	*			trans	-157.9	141.2	154.2	-80.9	0	0	0	0	112.1
450	N	25.9	Very low	27.5	Very low	160 Å²	160	141.6 Å²	141.6	86%	0.856	79%	0.79	S	S	*	*			trans	-104.5	143.6	173.3	-85.9	-20.4	0	0	0	110.2
451	S	25.7	Very low	27.5	Very low	124 Å²	124	137 Å²	137	87%	0.867	78%	0.779	S	S	*	*			trans	-160.7	149	150.1	54.6	0	0	0	0	111.4
452	S	28.3	Very low	27.4	Very low	112 Å²	112	133.9 Å²	133.9	78%	0.783	77%	0.77	S	S	*	*			trans	-129.2	145.3	-176.6	-54.5	0	0	0	0	110.3
453	D	25.2	Very low	27.4	Very low	140 Å²	140	133.8 Å²	133.8	75%	0.749	77%	0.77	S	S	*	*			trans	179	146.2	146.1	-92.5	-33	0	0	0	108.1
454	K	28.9	Very low	27.4	Very low	183 Å²	183	131.9 Å²	131.9	80%	0.796	76%	0.763	S	S	*	*				64.9	137.7	57.4	-64.4	-176.4	-176.3	168.6	0	112.5
455	S	24.6	Very low	27.4	Very low	94 Å²	94	130 Å²	130	66%	0.657	76%	0.756	S	S	*	*			cis	-165.3	141.1	7.2	-118.3	0	0	0	0	113.7
456	V	26.3	Very low	27.4	Very low	121 Å²	121	132.4 Å²	132.4	73%	0.733	76%	0.763	S	S	*	*				74.8	161.4	124.8	174.9	0	0	0	0	121.9
457	L	26	Very low	27.4	Very low	145 Å²	145	128.5 Å²	128.5	76%	0.759	76%	0.761	S	S	*	*			trans	84.9	140.5	178.4	-47.2	-177.3	0	0	0	115.6
458	Q	26.7	Very low	27.6	Very low	162 Å²	162	131.2 Å²	131.2	76%	0.757	76%	0.764	S	S	*	*			cis	-153.4	157.5	-1	-164.7	70.2	67.4	0	0	111.3
459	Q	29.2	Very low	27.9	Very low	159 Å²	159	131 Å²	131	74%	0.743	77%	0.766	S	S	*	*			trans	-122.1	158.7	161.6	-75.6	-168.1	3.4	0	0	111.4
460	P	37.7	Very low	28	Very low	115 Å²	115	132.5 Å²	132.5	75%	0.747	76%	0.764	S	S	*	*				-134.4	158.3	106.2	18.4	3.2	0	0	0	112.5
461	S	26.7	Very low	28.4	Very low	94 Å²	94	130.3 Å²	130.3	66%	0.657	76%	0.758	S	S	*	*			cis	71.5	139.8	47.6	-50.3	0	0	0	0	113.4
462	V	30	Very low	28.4	Very low	123 Å²	123	129.2 Å²	129.2	75%	0.745	75%	0.75	S	S	*	*			cis	-155.6	167.9	25.3	-142.6	0	0	0	0	113.5
463	N	26.5	Very low	28.3	Very low	140 Å²	140	129.9 Å²	129.9	75%	0.749	75%	0.75	S	S	*	*			trans	81	159.5	148.8	-75.7	-27.7	0	0	0	122.9
464	T	28.2	Very low	28.3	Very low	110 Å²	110	130.5 Å²	130.5	68%	0.675	75%	0.748	S	S	*	*			cis	-174.9	128.8	-39.2	-95.3	0	0	0	0	113.9
465	S	28.2	Very low	28.1	Very low	98 Å²	98	128.6 Å²	128.6	69%	0.685	75%	0.746	S	S	*	*			trans	55.9	161.1	149.2	79.6	0	0	0	0	126.8
466	I	28.6	Very low	28	Very low	172 Å²	172	133.4 Å²	133.4	88%	0.882	75%	0.751	S	S	*	*			trans	76.2	136.2	170.5	-49	168.3	0	0	0	115.4
467	G	26.4	Very low	27.9	Very low	73 Å²	73	134.3 Å²	134.3	75%	0.753	75%	0.751	S	S	*	*			cis	-171.8	173	-2.3	0	0	0	0	0	112.6
468	Q	28	Very low	27.9	Very low	189 Å²	189	137.8 Å²	137.8	88%	0.883	75%	0.754	S	S	*	*			trans	-81.7	167.8	-178.3	-95.5	-171.7	-4.9	0	0	113.7
469	P	33.6	Very low	27.9	Very low	120 Å²	120	139 Å²	139	78%	0.779	76%	0.76	S	S	*	*			cis	-145.4	-171	34.6	43.9	-23	0	0	0	118.6
470	L	26.6	Very low	27.9	Very low	149 Å²	149	137.1 Å²	137.1	78%	0.78	76%	0.759	S	S	*	*			trans	-81	155.3	168.1	-101.2	122.4	0	0	0	111.8
471	P	34.6	Very low	27.4	Very low	114 Å²	114	139.3 Å²	139.3	74%	0.74	76%	0.76	S	S	*	*				-152.6	155.8	76.1	39.9	-19.9	0	0	0	119.7
472	S	25.4	Very low	27.5	Very low	100 Å²	100	141.8 Å²	141.8	70%	0.699	77%	0.771	S	S	*	*			trans	50.1	135.7	141.2	-51.8	0	0	0	0	124.9
473	T	26.7	Very low	27.5	Very low	126 Å²	126	142.7 Å²	142.7	77%	0.773	77%	0.771	S	S	*	*			trans	107.7	80.7	140.4	-21.6	0	0	0	0	121.2
474	Q	25.9	Very low	27.7	Very low	153 Å²	153	141.9 Å²	141.9	72%	0.715	77%	0.771	S	S	*	*				71.1	126.9	127.7	-65.6	-67.2	17.1	0	0	125.1
475	L	23.7	Very low	27.9	Very low	143 Å²	143	142.2 Å²	142.2	75%	0.749	78%	0.778	S	S	*	*			trans	69.4	151.6	148.4	-54.4	165.9	0	0	0	117.7
476	Y	23.9	Very low	28.1	Very low	195 Å²	195	144.7 Å²	144.7	77%	0.765	78%	0.783	S	S	*	*			cis	-153.7	168.5	15.6	-154.2	-148.7	0	0	0	114
477	L	24.1	Very low	28.1	Very low	141 Å²	141	144.7 Å²	144.7	74%	0.738	78%	0.784	S	S	*	*			trans	65.3	149	175.1	-98.2	69.9	0	0	0	117.4
478	R	24.9	Very low	28.1	Very low	218 Å²	218	152.7 Å²	152.7	82%	0.823	79%	0.792	S	S	*	*			cis	-152.2	131.6	-7.2	-177.2	-171.2	-178.9	-151.5	1.8	109.2
479	Q	26.7	Very low	28.2	Very low	187 Å²	187	151.8 Å²	151.8	87%	0.874	79%	0.789	S	S	*	*			trans	-144.1	155.6	165.7	-155.7	164.9	29.5	0	0	111
480	T	29.2	Very low	28.1	Very low	119 Å²	119	151.1 Å²	151.1	73%	0.73	79%	0.785	S	S	*	*			trans	-101.5	122.1	-174.7	48.5	0	0	0	0	111.5
481	E	27	Very low	28.1	Very low	162 Å²	162	152.4 Å²	152.4	76%	0.757	79%	0.792	S	S	*	*			trans	-94.8	143	180	-59.9	-176.8	140.7	0	0	112.4
482	T	28.5	Very low	27.8	Very low	146 Å²	146	153.9 Å²	153.9	90%	0.896	80%	0.799	S	S	*	*			trans	-123.7	87.9	163.8	55	0	0	0	0	108.7
483	L	30.3	Very low	27.9	Very low	141 Å²	141	156.7 Å²	156.7	74%	0.738	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-90.6	136	-175.7	-84.9	165.4	0	0	0	112.7
484	T	31.2	Very low	28	Very low	124 Å²	124	157.5 Å²	157.5	76%	0.761	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-79.8	117.3	169.7	51.1	0	0	0	0	110.5
485	S	32.1	Very low	28.2	Very low	116 Å²	116	154.5 Å²	154.5	81%	0.811	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-81.3	123.1	177.8	44	0	0	0	0	112.5
486	N	32.3	Very low	28.4	Very low	151 Å²	151	155.4 Å²	155.4	81%	0.807	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-84.8	152.5	159	-75.9	-99	0	0	0	108.7
487	L	28.3	Very low	28.7	Very low	172 Å²	172	152.4 Å²	152.4	90%	0.901	81%	0.814	S	S	*	*			trans	-127.3	127.9	168.7	-83.6	171.4	0	0	0	111.4
488	R	27.9	Very low	28.9	Very low	241 Å²	241	154.8 Å²	154.8	91%	0.909	82%	0.821	S	S	*	*			trans	-140.4	135.9	168.6	175.7	178	179.6	154.8	0.8	106.8
489	M	28.4	Very low	29.1	Very low	169 Å²	169	150.9 Å²	150.9	83%	0.833	82%	0.821	S	S	*	*			trans	-121.7	154.2	168.2	-84.6	-171.8	67.8	0	0	110.9
490	P	32.7	Very low	29.2	Very low	107 Å²	107	149.4 Å²	149.4	70%	0.695	82%	0.818	S	S	*	*			trans	-87.9	161	177.6	36.4	-34.8	0	0	0	111.9
491	L	27	Very low	29.2	Very low	175 Å²	175	146.9 Å²	146.9	92%	0.916	82%	0.816	S	S	*	*			trans	-129.1	134.9	160.3	-76.1	172.9	0	0	0	108.8
492	T	28.1	Very low	29.5	Very low	145 Å²	145	146.2 Å²	146.2	89%	0.89	82%	0.823	S	S	*	*			trans	-84.7	152.7	174.1	43.2	0	0	0	0	110.5
493	L	27.7	Very low	29.6	Very low	160 Å²	160	144.1 Å²	144.1	84%	0.838	82%	0.821	S	S	*	*			trans	-119.2	123.4	-172.5	-163.4	159.9	0	0	0	109.7
494	T	27.1	Very low	29.5	Very low	142 Å²	142	140.4 Å²	140.4	87%	0.871	82%	0.816	S	S	*	*			trans	-124	130.8	167.2	44.6	0	0	0	0	109.4
495	S	31.5	Very low	29.8	Very low	91 Å²	91	142 Å²	142	64%	0.636	82%	0.82	S	S	*	*			trans	-96	156.4	-179.1	54.7	0	0	0	0	111.7
496	N	26.9	Very low	29.8	Very low	162 Å²	162	141.6 Å²	141.6	87%	0.866	81%	0.812	S	S	*	*				-164.9	145.2	121.8	-92.2	-18.9	0	0	0	110.9
497	T	30.8	Very low	30	Very low	132 Å²	132	145.7 Å²	145.7	81%	0.81	82%	0.818	S	S	*	*			trans	-126.2	151.9	-175.4	49.3	0	0	0	0	111.1
498	Q	27.5	Very low	30.2	Very low	190 Å²	190	144.8 Å²	144.8	89%	0.888	81%	0.813	S	S	*	*			trans	-161	142.4	153.1	-118	166.1	69.5	0	0	111.9
499	V	30.4	Very low	31.2	Very low	136 Å²	136	138.7 Å²	138.7	82%	0.824	81%	0.805	S	S	*	*			trans	-150.2	142.5	-178.9	-179.9	0	0	0	0	109.9
500	I	27.7	Very low	31.4	Very low	157 Å²	157	134.8 Å²	134.8	81%	0.805	80%	0.8	S	S	*	*			trans	-149.5	150.8	175.4	-55.7	179.5	0	0	0	106
501	G	29.1	Very low	31.3	Very low	66 Å²	66	136.6 Å²	136.6	68%	0.68	80%	0.803	S	S	*	*			cis	136.1	145.9	4.3	0	0	0	0	0	109.6
502	T	34.1	Very low	31.3	Very low	148 Å²	148	137 Å²	137	91%	0.908	80%	0.798	S	S	*	*			cis	-130.4	-129	7.8	61.4	0	0	0	0	112.1
503	A	30.8	Very low	31.4	Very low	102 Å²	102	135.7 Å²	135.7	84%	0.843	79%	0.789	S	S	*	*			trans	-161.8	162.9	-172.8	0	0	0	0	0	115.5
504	G	28.5	Very low	31.5	Very low	62 Å²	62	133.4 Å²	133.4	64%	0.639	78%	0.782	S	S	*	*			trans	153.5	164.4	170.8	0	0	0	0	0	111.7
505	N	36.3	Very low	31.9	Very low	158 Å²	158	135.3 Å²	135.3	85%	0.845	78%	0.781	S	S	*	*			cis	-172	177.1	-6.9	-92.1	-13.7	0	0	0	107.4
506	T	33.6	Very low	32.6	Very low	107 Å²	107	136.9 Å²	136.9	66%	0.656	79%	0.789	S	S	*	*			cis	171.6	134.3	-33	-75.5	0	0	0	0	107.6
507	Y	35.3	Very low	32.8	Very low	237 Å²	237	133.7 Å²	133.7	93%	0.929	79%	0.785	S	S	*	*			trans	-175.8	166.5	155.4	-100.4	-60.6	0	0	0	115.9
508	L	32.8	Very low	32.7	Very low	153 Å²	153	130.9 Å²	130.9	80%	0.801	78%	0.783	S	S	*	*			trans	-152.4	168.1	-170.9	-116.6	178.2	0	0	0	109.9
509	P	48.8	Very low	32.9	Very low	114 Å²	114	127.9 Å²	127.9	74%	0.74	78%	0.783	S	S	*	*				-166.4	168.1	84.4	44.2	-22	0	0	0	122.1
510	A	33.3	Very low	32.9	Very low	86 Å²	86	124.9 Å²	124.9	71%	0.711	78%	0.78	S	S	*	*			trans	72.9	158.4	146.2	0	0	0	0	0	121.7
511	L	29.5	Very low	33.5	Very low	145 Å²	145	123 Å²	123	76%	0.759	78%	0.778	S	S	*	*			cis	-147.1	139.6	15.7	-76	167.5	0	0	0	114.9
512	F	28.5	Very low	33.5	Very low	185 Å²	185	129 Å²	129	81%	0.811	79%	0.785	S	S	*	*			trans	47.6	160.4	148.2	-69	-74.3	0	0	0	124
513	T	30	Very low	34.1	Very low	116 Å²	116	126.8 Å²	126.8	71%	0.712	77%	0.773	S	S	*	*			cis	-138.7	143.1	16.4	51.6	0	0	0	0	116.4
514	T	29.2	Very low	33.8	Very low	113 Å²	113	132.2 Å²	132.2	69%	0.693	78%	0.778	S	S	*	*			trans	44.8	115.4	146.4	57.2	0	0	0	0	121.8
515	Q	34.9	Very low	33.7	Very low	182 Å²	182	136.5 Å²	136.5	85%	0.85	79%	0.785	S	S	*	*				81.7	149.7	70.4	-95.3	-163.4	-5.6	0	0	115.9
516	P	46.4	Very low	33.1	Very low	123 Å²	123	138.5 Å²	138.5	80%	0.799	79%	0.787	S	S	*	*			cis	-103.7	-156.2	-16.3	40.8	-29.7	0	0	0	110.4
517	A	30.6	Very low	32.7	Very low	95 Å²	95	137.6 Å²	137.6	79%	0.785	79%	0.785	S	S	*	*			cis	-145.9	-167	-0.9	0	0	0	0	0	107.9
518	G	29.9	Very low	32.4	Very low	73 Å²	73	133.8 Å²	133.8	75%	0.753	78%	0.78	S	S	*	*			cis	109.7	128.3	5.7	0	0	0	0	0	113.4
519	S	31.4	Very low	32.4	Very low	127 Å²	127	132.5 Å²	132.5	89%	0.888	78%	0.781	S	S	*	*			cis	-162.2	159.3	-4.3	61.2	0	0	0	0	114
520	G	29.7	Very low	31.7	Very low	74 Å²	74	135.4 Å²	135.4	76%	0.763	78%	0.784	S	S	*	*			trans	97.8	155.1	149.3	0	0	0	0	0	119.3
521	P	41.9	Very low	32.5	Very low	118 Å²	118	136.1 Å²	136.1	77%	0.766	78%	0.782	S	S	*	*			trans	-133.6	147.3	-165.4	38.5	-19.2	0	0	0	118.3
522	K	27.3	Very low	32.5	Very low	192 Å²	192	137 Å²	137	84%	0.835	79%	0.786	S	S	*	*			trans	64.8	176.4	159	-66.2	179.1	-179.8	174.4	0	116
523	P	46.7	Very low	32.5	Very low	100 Å²	100	132.8 Å²	132.8	65%	0.649	79%	0.786	S	S	*	*				-134.5	136.5	-54.7	35.6	-20.7	0	0	0	113.4
524	F	24.7	Very low	32.5	Very low	216 Å²	216	130.6 Å²	130.6	95%	0.947	79%	0.787	S	S	*	*			trans	-143	152.5	168.6	-83.1	-71.4	0	0	0	115.6
525	L	26.8	Very low	32.7	Very low	153 Å²	153	134.8 Å²	134.8	80%	0.801	80%	0.798	S	S	*	*			trans	-91	153.5	177.6	-59.5	157.1	0	0	0	110.2
526	F	23.6	Very low	32.5	Very low	199 Å²	199	134.1 Å²	134.1	87%	0.873	80%	0.795	S	S	*	*				-171.9	176.7	108	-120.7	-95.5	0	0	0	113.3
527	S	24.8	Very low	31.6	Very low	89 Å²	89	133.8 Å²	133.8	62%	0.622	79%	0.791	S	S	*	*			trans	-108.9	155	-162.2	-45.6	0	0	0	0	115
528	L	29.4	Very low	31.6	Very low	157 Å²	157	137.7 Å²	137.7	82%	0.822	79%	0.793	S	S	*	*			trans	67.1	164.4	154.4	-102.8	73.8	0	0	0	116.4
529	P	33.8	Very low	31.6	Very low	125 Å²	125	144 Å²	144	81%	0.812	80%	0.8	S	S	*	*			cis	-128.9	165.5	29.8	41.7	-25.3	0	0	0	118.7
530	Q	34.2	Very low	31.5	Very low	175 Å²	175	144.2 Å²	144.2	82%	0.818	80%	0.796	S	S	*	*			trans	-105.7	-175.2	159.9	-125.2	-178.1	-14.1	0	0	107.1
531	P	50.3	Low	31.6	Very low	102 Å²	102	147.1 Å²	147.1	66%	0.662	80%	0.799	S	S	*	*			cis	-136.6	-176.3	-8.3	41.4	-23.7	0	0	0	114.8
532	L	27.6	Very low	31	Very low	162 Å²	162	147.6 Å²	147.6	85%	0.848	80%	0.799	S	S	*	*			trans	-172	111.9	133.1	-120.5	61.8	0	0	0	106.1
533	A	29.8	Very low	31.1	Very low	97 Å²	97	143.6 Å²	143.6	80%	0.802	80%	0.795	S	S	*	*				55.4	120.7	79.2	0	0	0	0	0	114
534	G	29.2	Very low	30.5	Very low	71 Å²	71	147.5 Å²	147.5	73%	0.732	81%	0.805	S	S	*	*			cis	150.8	141.9	-10.2	0	0	0	0	0	113.5
535	Q	33.3	Very low	30.9	Very low	200 Å²	200	143.4 Å²	143.4	94%	0.935	80%	0.8	S	S	*	*			trans	-166.1	158.9	162	-121.2	168.9	82.3	0	0	112.7
536	Q	31.2	Very low	31.1	Very low	168 Å²	168	139.3 Å²	139.3	79%	0.785	80%	0.795	S	S	*	*			trans	-87	172.9	168.8	-60.3	175.1	3.5	0	0	108.3
537	T	26.7	Very low	31.5	Very low	117 Å²	117	138.3 Å²	138.3	72%	0.718	80%	0.798	S	S	*	*			cis	-172.1	172.7	40.3	-31.9	0	0	0	0	111
538	Q	31.4	Very low	31.6	Very low	177 Å²	177	139.1 Å²	139.1	83%	0.827	80%	0.804	S	S	*	*			trans	81.8	139.1	159.9	-63.8	-177	8	0	0	119.6
539	F	30	Very low	31.7	Very low	205 Å²	205	137.7 Å²	137.7	90%	0.899	80%	0.801	S	S	*	*			trans	-93.2	143.8	170.3	-73	-108.7	0	0	0	109.8
540	V	28.6	Very low	31.5	Very low	131 Å²	131	140.4 Å²	140.4	79%	0.794	80%	0.801	S	S	*	*			trans	-133	115.9	159	-179.4	0	0	0	0	108.8	V542	V540-V542 HydrophobicContact CG1-CG2 4.21Å
541	T	31.4	Very low	31.5	Very low	135 Å²	135	138 Å²	138	83%	0.828	80%	0.798	S	S	*	*			trans	-85.6	125.9	174.1	-31.1	0	0	0	0	109.3
542	V	29.2	Very low	30.9	Very low	128 Å²	128	135.8 Å²	135.8	78%	0.776	79%	0.789	S	S	*	*			trans	-122.7	124.3	168.3	179.5	0	0	0	0	108.9	V540	V540-V542 HydrophobicContact CG1-CG2 4.21Å
543	S	29.2	Very low	31.5	Very low	108 Å²	108	137.1 Å²	137.1	76%	0.755	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-74.4	148.6	-176	-55	0	0	0	0	112.5
544	Q	35	Very low	32.4	Very low	183 Å²	183	135.8 Å²	135.8	86%	0.855	77%	0.77	S	S	*	*	P	Polyproline II helix	trans	-72.5	148.1	167.7	-69.7	-172.2	-16.1	0	0	111.5	G546	Q544-G546 PolarHBondContact O-N 3.14Å
545	P	33.4	Very low	33.3	Very low	129 Å²	129	136.4 Å²	136.4	84%	0.838	76%	0.761	S	S	*	*	P	Polyproline II helix	trans	-72.1	123.4	169.7	30	-33	0	0	0	110.4
546	G	30	Very low	34.1	Very low	68 Å²	68	130 Å²	130	70%	0.701	74%	0.743	S	S	*	*	P	Polyproline II helix	trans	-79	148	177.4	0	0	0	0	0	113.1	Q544 S548	Q544-G546 PolarHBondContact O-N 3.14Å; G546-S548 PolarHBondContact O-N 3.2Å
547	L	33.6	Very low	34.9	Very low	178 Å²	178	123.4 Å²	123.4	93%	0.932	71%	0.714	S	S	*	*			trans	-72.7	113.6	168.9	-79	164.2	0	0	0	110.1	T549	L547-T549 PolarHBondContact O-N 3.31Å; L547-T549 VanDerWaalsContact O-N 3.12Å
548	S	27	Very low	36	Very low	106 Å²	106	124.5 Å²	124.5	74%	0.741	71%	0.711	S	S	*	*			trans	-71.3	100.9	-178	-58.1	0	0	0	0	112.6	G546 F550	G546-S548 PolarHBondContact O-N 3.2Å; S548-F550 PolarHBondContact O-N 3.45Å
549	T	31.2	Very low	36.7	Very low	126 Å²	126	120.2 Å²	120.2	77%	0.773	70%	0.698	S	S	*	*			trans	-65.6	97.9	162.3	-60.4	0	0	0	0	109	L547 T551	L547-T549 PolarHBondContact O-N 3.31Å; L547-T549 VanDerWaalsContact O-N 3.12Å; T549-T551 VanDerWaalsContact C-N 3.31Å; T549-T551 PolarHBondContact O-N 3.3Å
550	F	29	Very low	37.6	Very low	182 Å²	182	116.6 Å²	116.6	80%	0.798	69%	0.688	S	S	*	*			trans	-80.7	73.6	-172.7	-146.8	-83.7	0	0	0	111.8	S548 A552	S548-F550 PolarHBondContact O-N 3.45Å; F550-A552 VanDerWaalsContact C-N 3.3Å; F550-A552 PolarHBondContact O-N 3.09Å
551	T	34.3	Very low	38.1	Very low	124 Å²	124	115.1 Å²	115.1	76%	0.761	69%	0.69	S	S	*	*			trans	-67.4	89.4	166	39.3	0	0	0	0	109.7	T549 Q553	T549-T551 VanDerWaalsContact C-N 3.31Å; T549-T551 PolarHBondContact O-N 3.3Å; T551-Q553 PolarHBondContact O-N 2.82Å; T551-Q553 VanDerWaalsContact O-N 3.09Å
552	A	36.8	Very low	38.5	Very low	57 Å²	57	113.3 Å²	113.3	47%	0.471	68%	0.682	S	S	.	*			trans	-59.5	110.9	169	0	0	0	0	0	108.9	F550 L554	F550-A552 VanDerWaalsContact C-N 3.3Å; F550-A552 PolarHBondContact O-N 3.09Å; A552-L554 PolarHBondContact O-N 2.88Å; A552-L554 VanDerWaalsContact O-N 3.08Å
553	Q	40.8	Very low	38.8	Very low	190 Å²	190	112.9 Å²	112.9	89%	0.888	69%	0.685	S	S	*	*			trans	-80.4	99.6	-171.8	-155	163.1	18.8	0	0	109.2	T551	T551-Q553 PolarHBondContact O-N 2.82Å; T551-Q553 VanDerWaalsContact O-N 3.09Å
554	L	48.1	Very low	39.2	Very low	68 Å²	68	112.9 Å²	112.9	36%	0.356	69%	0.692	S	S	.	*	P	Polyproline II helix	trans	-46.3	129.2	178.5	-81.5	167.8	0	0	0	110.7	A552 A556 M597 F598 T601	A552-L554 PolarHBondContact O-N 2.88Å; A552-L554 VanDerWaalsContact O-N 3.08Å; L554-A556 PolarHBondContact O-N 3.12Å; L554-M597 HydrophobicContact CD2-CB 4.09Å; L554-F598 HydrophobicContact CD1-CE1 4.37Å; L554-T601 HydrophobicContact CD2-CG2 3.9Å
555	P	50	Low	39.2	Very low	84 Å²	84	107.4 Å²	107.4	55%	0.545	68%	0.684	S	S	.	*	P	Polyproline II helix	trans	-51.8	125.7	-178.9	-29.4	35.6	0	0	0	111.7	P557	P555-P557 WeakPolarHBondContact O-CD 3.2Å
556	A	49.3	Very low	39.3	Very low	67 Å²	67	110.6 Å²	110.6	55%	0.554	69%	0.687	S	S	*	*	P	Polyproline II helix	trans	-59	122.2	179.7	0	0	0	0	0	109	L554 Q558	L554-A556 PolarHBondContact O-N 3.12Å; A556-Q558 PolarHBondContact O-N 3.41Å; A556-Q558 PolarHBondContact O-NE2 3.33Å
557	P	46.8	Very low	39.6	Very low	29 Å²	29	112.7 Å²	112.7	19%	0.188	69%	0.691	C	S	.	*			trans	-65.6	112.3	-176.7	21.4	-29.9	0	0	0	109.6	P555 P559 Y578 K590 Y593	P555-P557 WeakPolarHBondContact O-CD 3.2Å; P557-P559 VanDerWaalsContact O-CD 3.24Å; P557-P559 WeakPolarHBondContact O-CD 3.41Å; P557-Y578 HydrophobicContact CB-CD1 4.12Å; P557-K590 HydrophobicContact CG-CD 3.91Å; P557-K590 HydrophobicContact CG-CG 4.09Å; P557-Y593 HydrophobicContact CB-CD1 3.87Å; P557-Y593 HydrophobicContact CB-CE1 3.67Å
558	Q	50.9	Low	39.5	Very low	140 Å²	140	111 Å²	111	65%	0.654	69%	0.689	S	S	*	*			trans	-76.4	113.9	-179.6	-55.8	-59.5	-57.2	0	0	109.5	A556	A556-Q558 PolarHBondContact O-N 3.41Å; A556-Q558 PolarHBondContact O-NE2 3.33Å
559	P	45.7	Very low	40.1	Very low	86 Å²	86	110.3 Å²	110.3	56%	0.558	69%	0.689	S	S	*	*	P	Polyproline II helix	trans	-76.5	128.7	162.7	32.5	-30	0	0	0	108.4	P557 A561	P557-P559 VanDerWaalsContact O-CD 3.24Å; P557-P559 WeakPolarHBondContact O-CD 3.41Å; P559-A561 PolarHBondContact O-N 2.87Å; P559-A561 VanDerWaalsContact O-N 3.14Å
560	L	48.4	Very low	40.6	Very low	130 Å²	130	110.6 Å²	110.6	68%	0.681	70%	0.696	S	S	*	*	P	Polyproline II helix	trans	-64.3	118.1	170.7	-78.9	81.3	0	0	0	109.3	S562	L560-S562 PolarHBondContact O-N 3.28Å
561	A	39.2	Very low	41.2	Very low	100 Å²	100	105.2 Å²	105.2	83%	0.826	69%	0.692	S	S	*	*	P	Polyproline II helix	trans	-63	129.8	171.8	0	0	0	0	0	109.4	P559 S563	P559-A561 PolarHBondContact O-N 2.87Å; P559-A561 VanDerWaalsContact O-N 3.14Å; A561-S563 PolarHBondContact O-N 3.18Å
562	S	40.3	Very low	41.7	Very low	96 Å²	96	109.1 Å²	109.1	67%	0.671	70%	0.702	S	S	*	*			trans	-78.9	112	178.3	-65.2	0	0	0	0	110.1	L560 A564	L560-S562 PolarHBondContact O-N 3.28Å; S562-A564 PolarHBondContact O-N 3.49Å
563	S	35.2	Very low	42.2	Very low	120 Å²	120	109.4 Å²	109.4	84%	0.839	71%	0.71	S	S	*	*			trans	-66.4	126.1	161.5	40.7	0	0	0	0	109.3	A561	A561-S563 PolarHBondContact O-N 3.18Å
564	A	38.3	Very low	42.9	Very low	108 Å²	108	106.7 Å²	106.7	89%	0.893	70%	0.698	S	S	*	*			trans	-90.6	126.1	174.2	0	0	0	0	0	109.4	S562	S562-A564 PolarHBondContact O-N 3.49Å
565	G	34.4	Very low	43.4	Very low	67 Å²	67	111.4 Å²	111.4	69%	0.691	72%	0.715	S	S	*	*			trans	-169.8	71.1	-172.9	0	0	0	0	0	113.9
566	H	36.9	Very low	44.5	Very low	196 Å²	196	111.5 Å²	111.5	91%	0.907	71%	0.707	S	S	*	*			trans	65	167.4	172.2	-65	-86.1	0	0	0	117.4
567	S	35.9	Very low	45.9	Very low	112 Å²	112	110.4 Å²	110.4	78%	0.783	69%	0.694	S	S	*	*			trans	-131.9	145.4	-151.7	-48.2	0	0	0	0	112.6
568	T	31.8	Very low	47.6	Very low	144 Å²	144	111.4 Å²	111.4	88%	0.883	70%	0.695	S	S	*	*			trans	-163	146.5	136.1	13.8	0	0	0	0	113
569	A	38.4	Very low	49.3	Very low	90 Å²	90	108.7 Å²	108.7	74%	0.744	68%	0.682	S	S	*	*			trans	41.5	115.8	153.9	0	0	0	0	0	122
570	S	42.8	Very low	51.3	Low	132 Å²	132	104.6 Å²	104.6	92%	0.923	66%	0.655	S	S	*	*			trans	49.8	77.7	131.5	-57	0	0	0	0	120.3
571	G	41.5	Very low	52.9	Low	70 Å²	70	103.8 Å²	103.8	72%	0.722	66%	0.656	S	S	*	*			trans	-158.3	123.9	150.7	0	0	0	0	0	110.8	G573	G571-G573 PolarHBondContact O-N 3.15Å
572	Q	44.3	Very low	55	Low	205 Å²	205	104.4 Å²	104.4	96%	0.958	65%	0.645	S	S	*	*			trans	-76.7	66.9	170.8	-73.8	-167.8	-1.2	0	0	110.2	E574	Q572-E574 PolarHBondContact O-N 2.85Å
573	G	47.3	Very low	57.2	Low	63 Å²	63	101.9 Å²	101.9	65%	0.649	63%	0.626	S	S	*	*			trans	-65.2	114.2	174.1	0	0	0	0	0	110.4	G571 K575	G571-G573 PolarHBondContact O-N 3.15Å; G573-K575 VanDerWaalsContact C-N 3.34Å; G573-K575 PolarHBondContact O-N 3.08Å
574	E	55.8	Low	59.6	Low	134 Å²	134	101.8 Å²	101.8	63%	0.626	62%	0.617	S	S	*	*			trans	-57.8	94.1	170	-66.8	-173	128.7	0	0	110	Q572 K576	Q572-E574 PolarHBondContact O-N 2.85Å; E574-K576 PolarHBondContact O-N 3.07Å; E574-K576 VanDerWaalsContact O-N 3.08Å; E574-K576 WeakPolarHBondContact OE2-CE 3.47Å; E574-K576 IonicContact OE2-NZ 2.9Å; E574-K576 PolarHBondContact OE2-NZ 3.04Å
575	K	59.1	Low	61.8	Low	167 Å²	167	102 Å²	102	73%	0.726	60%	0.598	S	S	*	*			trans	-58.5	118.7	169.1	-68.3	-171.8	177.1	-173.7	0	107.5	G573 P577	G573-K575 VanDerWaalsContact C-N 3.34Å; G573-K575 PolarHBondContact O-N 3.08Å; K575-P577 VanDerWaalsContact C-CD 3.45Å; K575-P577 WeakPolarHBondContact O-CD 3.45Å
576	K	72.3	Confident	64.3	Low	86 Å²	86	102.2 Å²	102.2	37%	0.374	59%	0.586	S	S	.	*			trans	-109.5	75.3	179.3	-76	156.2	-178.8	156.2	0	108.8	E574 Y578 F587 T588	E574-K576 PolarHBondContact O-N 3.07Å; E574-K576 VanDerWaalsContact O-N 3.08Å; E574-K576 WeakPolarHBondContact OE2-CE 3.47Å; E574-K576 IonicContact OE2-NZ 2.9Å; E574-K576 PolarHBondContact OE2-NZ 3.04Å; K576-Y578 PolarHBondContact O-N 3.12Å; K576-F587 CarbonylContact C-O 3.54Å; K576-F587 VanDerWaalsContact C-O 3.3Å; K576-F587 WeakPolarHBondContact CA-O 3.29Å; K576-T588 HydrophobicContact CD-CG2 4.47Å; K576-T588 HydrophobicContact CG-CG2 3.6Å
577	P	78.8	Confident	66.7	Low	43 Å²	43	95 Å²	95	28%	0.279	55%	0.551	S	S	.	*			trans	-76.6	7.7	-162.1	33.7	-39.6	0	0	0	114.7	K575	K575-P577 VanDerWaalsContact C-CD 3.45Å; K575-P577 WeakPolarHBondContact O-CD 3.45Å
578	Y	81.9	Confident	69.1	Low	51 Å²	51	93.1 Å²	93.1	20%	0.2	54%	0.536	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	99.5	-179.9	-52.7	-67.7	0	0	0	110.1	P557 K576 F587 A589 K590	P557-Y578 HydrophobicContact CB-CD1 4.12Å; K576-Y578 PolarHBondContact O-N 3.12Å; Y578-F587 PolarHBondContact N-O 2.8Å; Y578-F587 PolarHBondContact O-N 3.45Å; Y578-A589 VanDerWaalsContact CD2-C 3.45Å; Y578-K590 HydrophobicContact CD1-CB 4.36Å; Y578-K590 HydrophobicContact CD2-CB 4.25Å; Y578-K590 HydrophobicContact CE1-CB 3.94Å; Y578-K590 HydrophobicContact CE1-CD 4.42Å; Y578-K590 HydrophobicContact CE1-CG 4.39Å; Y578-K590 HydrophobicContact CE2-CB 3.8Å
579	E	87.6	Confident	71.7	Confident	82 Å²	82	88 Å²	88	38%	0.383	51%	0.508	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	133.5	179.2	-174.8	168.5	-172.3	0	0	112.3	T581 T586 Y593	E579-T581 PolarHBondContact O-N 2.82Å; E579-T586 HydrophobicContact CB-CG2 4.09Å; E579-T586 HydrophobicContact CG-CG2 3.91Å; E579-Y593 VanDerWaalsContact O-CE2 3.27Å; E579-Y593 WeakPolarHBondContact O-CE2 3.3Å
580	C	87.6	Confident	73.9	Confident	0 Å²	0	89 Å²	89	0%	0	50%	0.495	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	106.2	170.4	178.9	0	0	0	0	111.2	L582 C583 N584 K585 F587 Y593 H596 M597 H600	C580-L582 PolarHBondContact O-N 2.93Å; C580-L582 PolarHBondContact SG-N 2.89Å; C580-C583 PolarHBondContact O-N 3.08Å; C580-N584 VanDerWaalsContact O-CA 3.23Å; C580-N584 WeakPolarHBondContact O-CA 3.23Å; C580-N584 PolarHBondContact O-N 3.37Å; C580-K585 HydrophobicContact CB-CB 4.39Å; C580-K585 PolarHBondContact N-O 2.66Å; C580-F587 HydrophobicContact CB-CE2 4.43Å; C580-Y593 HydrophobicContact CB-CE2 4.42Å; C580-H596 PolarHBondContact SG-NE2 3.45Å; C580-H596 VanDerWaalsContact SG-NE2 3.45Å; C580-M597 HydrophobicContact CB-CE 3.78Å; C580-M597 VanDerWaalsContact SG-CE 3.58Å; C580-H600 PolarHBondContact SG-NE2 3.04Å
581	T	81.9	Confident	75.8	Confident	114 Å²	114	89.5 Å²	89.5	70%	0.699	48%	0.483	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.4	-6.5	175.2	52.8	0	0	0	0	115.2	E579	E579-T581 PolarHBondContact O-N 2.82Å
582	L	83.3	Confident	77.9	Confident	113 Å²	113	89.7 Å²	89.7	59%	0.592	47%	0.468	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.4	-12.4	-179.3	-57.5	176.8	0	0	0	113.5	C580 H600	C580-L582 PolarHBondContact O-N 2.93Å; C580-L582 PolarHBondContact SG-N 2.89Å; L582-H600 HydrophobicContact CD1-CB 3.63Å; L582-H600 PolarHBondContact O-CE1 3.29Å; L582-H600 VanDerWaalsContact O-CE1 3.27Å
583	C	86.8	Confident	80	Confident	42 Å²	42	80.5 Å²	80.5	28%	0.284	42%	0.424	S	S	.	.	T	Hydrogen-bonded Turn	trans	-157.9	21.7	174.1	67.2	0	0	0	0	114.4	C580 K585 H596 H600	C580-C583 PolarHBondContact O-N 3.08Å; C583-K585 WeakPolarHBondContact O-CG 3.4Å; C583-K585 PolarHBondContact O-N 2.95Å; C583-K585 VanDerWaalsContact O-N 3.1Å; C583-H596 PolarHBondContact SG-NE2 2.66Å; C583-H600 WeakPolarHBondContact CB-CE1 3.45Å; C583-H600 PolarHBondContact SG-CE1 3.1Å; C583-H600 PolarHBondContact SG-NE2 3.14Å
584	N	84.9	Confident	81.7	Confident	118 Å²	118	79.7 Å²	79.7	63%	0.631	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	46.5	39.7	177.3	-54.4	-1.3	0	0	0	114.1	C580	C580-N584 VanDerWaalsContact O-CA 3.23Å; C580-N584 WeakPolarHBondContact O-CA 3.23Å; C580-N584 PolarHBondContact O-N 3.37Å
585	K	83.9	Confident	83.2	Confident	114 Å²	114	77.2 Å²	77.2	50%	0.496	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	120.1	176.7	-69.3	-172.4	-164.7	-46.6	0	110	C580 C583 F587	C580-K585 HydrophobicContact CB-CB 4.39Å; C580-K585 PolarHBondContact N-O 2.66Å; C583-K585 WeakPolarHBondContact O-CG 3.4Å; C583-K585 PolarHBondContact O-N 2.95Å; C583-K585 VanDerWaalsContact O-N 3.1Å; K585-F587 HydrophobicContact CB-CE2 3.67Å; K585-F587 HydrophobicContact CB-CZ 3.94Å; K585-F587 VanDerWaalsContact O-CD2 3.3Å; K585-F587 WeakPolarHBondContact O-CD2 3.39Å; K585-F587 WeakPolarHBondContact O-CE2 3.14Å
586	T	86.8	Confident	84.5	Confident	71 Å²	71	70.5 Å²	70.5	44%	0.436	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	138.7	179.3	59.4	0	0	0	0	111.2	E579	E579-T586 HydrophobicContact CB-CG2 4.09Å; E579-T586 HydrophobicContact CG-CG2 3.91Å
587	F	87.4	Confident	85.1	Confident	43 Å²	43	67 Å²	67	19%	0.189	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	139.9	-177.7	-60.7	-92.8	0	0	0	110.6	K576 Y578 C580 K585 A589 N592 Y593 H596	K576-F587 CarbonylContact C-O 3.54Å; K576-F587 VanDerWaalsContact C-O 3.3Å; K576-F587 WeakPolarHBondContact CA-O 3.29Å; Y578-F587 PolarHBondContact N-O 2.8Å; Y578-F587 PolarHBondContact O-N 3.45Å; C580-F587 HydrophobicContact CB-CE2 4.43Å; K585-F587 HydrophobicContact CB-CE2 3.67Å; K585-F587 HydrophobicContact CB-CZ 3.94Å; K585-F587 VanDerWaalsContact O-CD2 3.3Å; K585-F587 WeakPolarHBondContact O-CD2 3.39Å; K585-F587 WeakPolarHBondContact O-CE2 3.14Å; F587-A589 VanDerWaalsContact C-N 3.33Å; F587-N592 HydrophobicContact CD1-CB 3.91Å; F587-Y593 HydrophobicContact CD2-CD2 4.28Å; F587-H596 HydrophobicContact CE1-CB 4.14Å; F587-H596 HydrophobicContact CE2-CB 4.17Å; F587-H596 AromaticContact CE2-CD2 3.3Å; F587-H596 WeakPolarHBondContact CE2-CD2 3.25Å; F587-H596 AromaticContact CE2-CG 3.91Å; F587-H596 HydrophobicContact CZ-CB 3.64Å; F587-H596 AromaticContact CZ-CD2 3.31Å; F587-H596 WeakPolarHBondContact CZ-CD2 3.48Å; F587-H596 AromaticContact CZ-CG 3.46Å; F587-H596 VanDerWaalsContact CZ-CG 3.46Å
588	T	87	Confident	85.5	Confident	74 Å²	74	66.7 Å²	66.7	45%	0.454	34%	0.344	S	S	.	.	S	Bend	trans	-69.6	-28.7	173.6	48.6	0	0	0	0	113	K576	K576-T588 HydrophobicContact CD-CG2 4.47Å; K576-T588 HydrophobicContact CG-CG2 3.6Å
589	A	86.3	Confident	85.6	Confident	36 Å²	36	69.4 Å²	69.4	30%	0.298	37%	0.366	S	S	.	.	S	Bend	trans	-128.6	132.5	-171.6	0	0	0	0	0	113.3	Y578 F587 Q591 N592 Y593	Y578-A589 VanDerWaalsContact CD2-C 3.45Å; F587-A589 VanDerWaalsContact C-N 3.33Å; A589-Q591 PolarHBondContact O-N 3.23Å; A589-Q591 VanDerWaalsContact O-N 3.15Å; A589-N592 PolarHBondContact O-N 3.49Å; A589-Y593 PolarHBondContact O-N 3.42Å
590	K	84.1	Confident	85.4	Confident	112 Å²	112	69.3 Å²	69.3	49%	0.487	37%	0.365	S	S	.	.	H	α-helix	trans	-52.6	-37.2	178.6	179.5	165.2	167.3	166.6	0	112.8	P557 Y578 N592 Y593 V594	P557-K590 HydrophobicContact CG-CD 3.91Å; P557-K590 HydrophobicContact CG-CG 4.09Å; Y578-K590 HydrophobicContact CD1-CB 4.36Å; Y578-K590 HydrophobicContact CD2-CB 4.25Å; Y578-K590 HydrophobicContact CE1-CB 3.94Å; Y578-K590 HydrophobicContact CE1-CD 4.42Å; Y578-K590 HydrophobicContact CE1-CG 4.39Å; Y578-K590 HydrophobicContact CE2-CB 3.8Å; K590-N592 VanDerWaalsContact C-N 3.34Å; K590-N592 PolarHBondContact O-N 2.89Å; K590-Y593 PolarHBondContact O-N 2.89Å; K590-V594 HydrophobicContact CG-CG2 4.48Å; K590-V594 WeakPolarHBondContact O-CG2 3.3Å; K590-V594 PolarHBondContact O-N 3.34Å
591	Q	83.1	Confident	85.1	Confident	141 Å²	141	72.3 Å²	72.3	66%	0.659	38%	0.384	S	S	*	.	H	α-helix	trans	-62.5	-39.5	176.9	-61.7	-173.5	14.8	0	0	112.3	A589 K595	A589-Q591 PolarHBondContact O-N 3.23Å; A589-Q591 VanDerWaalsContact O-N 3.15Å; Q591-K595 WeakPolarHBondContact O-CB 3.32Å; Q591-K595 WeakPolarHBondContact O-CG 3.39Å; Q591-K595 PolarHBondContact O-N 3.23Å
592	N	85.5	Confident	85.1	Confident	75 Å²	75	68.7 Å²	68.7	40%	0.401	37%	0.369	S	S	.	.	H	α-helix	trans	-73.9	-37.1	-179.7	-67.2	-17.3	0	0	0	111.3	F587 A589 K590 K595 H596	F587-N592 HydrophobicContact CD1-CB 3.91Å; A589-N592 PolarHBondContact O-N 3.49Å; K590-N592 VanDerWaalsContact C-N 3.34Å; K590-N592 PolarHBondContact O-N 2.89Å; N592-K595 PolarHBondContact O-N 3.24Å; N592-H596 WeakPolarHBondContact O-CB 3Å; N592-H596 PolarHBondContact O-N 3.46Å
593	Y	87.8	Confident	85.1	Confident	11 Å²	11	66.4 Å²	66.4	4%	0.043	36%	0.355	C	S	.	.	H	α-helix	trans	-58.1	-51.3	169.1	170.8	-89.6	0	0	0	112	P557 E579 C580 F587 A589 K590 K595 H596 M597	P557-Y593 HydrophobicContact CB-CD1 3.87Å; P557-Y593 HydrophobicContact CB-CE1 3.67Å; E579-Y593 VanDerWaalsContact O-CE2 3.27Å; E579-Y593 WeakPolarHBondContact O-CE2 3.3Å; C580-Y593 HydrophobicContact CB-CE2 4.42Å; F587-Y593 HydrophobicContact CD2-CD2 4.28Å; A589-Y593 PolarHBondContact O-N 3.42Å; K590-Y593 PolarHBondContact O-N 2.89Å; Y593-K595 PolarHBondContact O-N 2.84Å; Y593-H596 CarbonylContact O-C 3.56Å; Y593-H596 WeakPolarHBondContact O-CA 3.39Å; Y593-H596 WeakPolarHBondContact O-CB 3.46Å; Y593-H596 PolarHBondContact O-N 3.34Å; Y593-M597 HydrophobicContact CD1-CG 4.26Å; Y593-M597 HydrophobicContact CD2-CE 3.82Å; Y593-M597 HydrophobicContact CE1-CE 4.32Å; Y593-M597 HydrophobicContact CE1-CG 3.81Å; Y593-M597 HydrophobicContact CE1-SD 4.04Å; Y593-M597 HydrophobicContact CE2-CE 3.52Å; Y593-M597 HydrophobicContact CE2-SD 3.96Å; Y593-M597 HydrophobicContact CG-CE 4.35Å; Y593-M597 PolarHBondContact O-N 2.77Å
594	V	84.6	Confident	85	Confident	47 Å²	47	70.3 Å²	70.3	29%	0.285	37%	0.368	S	S	.	.	H	α-helix	trans	-63.1	-42.7	179.1	173	0	0	0	0	111.3	K590 H596 M597 F598	K590-V594 HydrophobicContact CG-CG2 4.48Å; K590-V594 WeakPolarHBondContact O-CG2 3.3Å; K590-V594 PolarHBondContact O-N 3.34Å; V594-H596 PolarHBondContact O-N 3.1Å; V594-M597 PolarHBondContact O-N 2.13Å; V594-M597 VanDerWaalsContact O-N 3.13Å; V594-F598 HydrophobicContact CG1-CZ 4.5Å
595	K	85.5	Confident	84.9	Confident	81 Å²	81	68.6 Å²	68.6	35%	0.352	36%	0.363	S	S	.	.	H	α-helix	trans	-59.5	-30.5	173.4	-72.8	176.6	-179.4	-176.4	0	112.8	Q591 N592 Y593 L617	Q591-K595 WeakPolarHBondContact O-CB 3.32Å; Q591-K595 WeakPolarHBondContact O-CG 3.39Å; Q591-K595 PolarHBondContact O-N 3.23Å; N592-K595 PolarHBondContact O-N 3.24Å; Y593-K595 PolarHBondContact O-N 2.84Å; K595-L617 HydrophobicContact CB-CD1 4.39Å; K595-L617 HydrophobicContact CB-CD2 3.99Å; K595-L617 HydrophobicContact CD-CD1 4.22Å; K595-L617 HydrophobicContact CD-CD2 4.33Å; K595-L617 HydrophobicContact CG-CD1 4.32Å; K595-L617 HydrophobicContact CG-CD2 3.68Å
596	H	87.3	Confident	85	Confident	27 Å²	27	66 Å²	66	13%	0.125	35%	0.352	C	S	.	.	H	α-helix	trans	-78.6	-31.6	175.6	171.4	49.7	0	0	0	113.1	C580 C583 F587 N592 Y593 V594 F598 V599 H600	C580-H596 PolarHBondContact SG-NE2 3.45Å; C580-H596 VanDerWaalsContact SG-NE2 3.45Å; C583-H596 PolarHBondContact SG-NE2 2.66Å; F587-H596 HydrophobicContact CE1-CB 4.14Å; F587-H596 HydrophobicContact CE2-CB 4.17Å; F587-H596 AromaticContact CE2-CD2 3.3Å; F587-H596 WeakPolarHBondContact CE2-CD2 3.25Å; F587-H596 AromaticContact CE2-CG 3.91Å; F587-H596 HydrophobicContact CZ-CB 3.64Å; F587-H596 AromaticContact CZ-CD2 3.31Å; F587-H596 WeakPolarHBondContact CZ-CD2 3.48Å; F587-H596 AromaticContact CZ-CG 3.46Å; F587-H596 VanDerWaalsContact CZ-CG 3.46Å; N592-H596 WeakPolarHBondContact O-CB 3Å; N592-H596 PolarHBondContact O-N 3.46Å; Y593-H596 CarbonylContact O-C 3.56Å; Y593-H596 WeakPolarHBondContact O-CA 3.39Å; Y593-H596 WeakPolarHBondContact O-CB 3.46Å; Y593-H596 PolarHBondContact O-N 3.34Å; V594-H596 PolarHBondContact O-N 3.1Å; H596-F598 PolarHBondContact O-N 3.34Å; H596-V599 VanDerWaalsContact O-CB 3.26Å; H596-V599 WeakPolarHBondContact O-CB 3.37Å; H596-V599 WeakPolarHBondContact O-CG2 3.48Å; H596-V599 PolarHBondContact O-N 3.23Å; H596-H600 AromaticContact CD2-NE2 3.59Å; H596-H600 AromaticContact CE1-CD2 3.83Å; H596-H600 AromaticContact CE1-NE2 2.77Å; H596-H600 PolarHBondContact CE1-NE2 2.48Å; H596-H600 AromaticContact ND1-NE2 3.9Å; H596-H600 AromaticContact NE2-CD2 3.85Å; H596-H600 AromaticContact NE2-NE2 2.48Å; H596-H600 PolarHBondContact NE2-NE2 3.23Å
597	M	85.8	Confident	85.1	Confident	11 Å²	11	67.4 Å²	67.4	5%	0.054	35%	0.354	C	S	.	.	H	α-helix	trans	-57.4	-33.4	177.1	-66.4	-53	95.2	0	0	112.7	L554 C580 Y593 V594 V599 H600 T601	L554-M597 HydrophobicContact CD2-CB 4.09Å; C580-M597 HydrophobicContact CB-CE 3.78Å; C580-M597 VanDerWaalsContact SG-CE 3.58Å; Y593-M597 HydrophobicContact CD1-CG 4.26Å; Y593-M597 HydrophobicContact CD2-CE 3.82Å; Y593-M597 HydrophobicContact CE1-CE 4.32Å; Y593-M597 HydrophobicContact CE1-CG 3.81Å; Y593-M597 HydrophobicContact CE1-SD 4.04Å; Y593-M597 HydrophobicContact CE2-CE 3.52Å; Y593-M597 HydrophobicContact CE2-SD 3.96Å; Y593-M597 HydrophobicContact CG-CE 4.35Å; Y593-M597 PolarHBondContact O-N 2.77Å; V594-M597 PolarHBondContact O-N 2.13Å; V594-M597 VanDerWaalsContact O-N 3.13Å; M597-V599 PolarHBondContact O-N 2.47Å; M597-V599 VanDerWaalsContact O-N 3.08Å; M597-H600 PolarHBondContact O-N 3.18Å; M597-T601 PolarHBondContact O-N 2.64Å; M597-T601 PolarHBondContact O-OG1 3.21Å
598	F	86.3	Confident	85.2	Confident	38 Å²	38	65.4 Å²	65.4	17%	0.167	35%	0.345	C	S	.	.	H	α-helix	trans	-61.4	-14.7	174.1	-58.5	-51.2	0	0	0	114.8	L554 V594 H596 G602 E603 L617	L554-F598 HydrophobicContact CD1-CE1 4.37Å; V594-F598 HydrophobicContact CG1-CZ 4.5Å; H596-F598 PolarHBondContact O-N 3.34Å; F598-G602 PolarHBondContact O-N 3.14Å; F598-E603 HydrophobicContact CD1-CB 4.07Å; F598-L617 HydrophobicContact CD2-CD2 3.96Å; F598-L617 HydrophobicContact CE2-CD2 4.22Å
599	V	84.4	Confident	85.1	Confident	107 Å²	107	66.1 Å²	66.1	65%	0.648	35%	0.353	S	S	*	.	H	α-helix	trans	-73.6	-33.7	170.7	-176.9	0	0	0	0	110.8	H596 M597	H596-V599 VanDerWaalsContact O-CB 3.26Å; H596-V599 WeakPolarHBondContact O-CB 3.37Å; H596-V599 WeakPolarHBondContact O-CG2 3.48Å; H596-V599 PolarHBondContact O-N 3.23Å; M597-V599 PolarHBondContact O-N 2.47Å; M597-V599 VanDerWaalsContact O-N 3.08Å
600	H	83.4	Confident	85	Confident	81 Å²	81	69.1 Å²	69.1	38%	0.375	36%	0.363	S	S	.	.	H	α-helix	trans	-91.2	-41	-178.2	-64	-74	0	0	0	112.9	C580 L582 C583 H596 M597 G602	C580-H600 PolarHBondContact SG-NE2 3.04Å; L582-H600 HydrophobicContact CD1-CB 3.63Å; L582-H600 PolarHBondContact O-CE1 3.29Å; L582-H600 VanDerWaalsContact O-CE1 3.27Å; C583-H600 WeakPolarHBondContact CB-CE1 3.45Å; C583-H600 PolarHBondContact SG-CE1 3.1Å; C583-H600 PolarHBondContact SG-NE2 3.14Å; H596-H600 AromaticContact CD2-NE2 3.59Å; H596-H600 AromaticContact CE1-CD2 3.83Å; H596-H600 AromaticContact CE1-NE2 2.77Å; H596-H600 PolarHBondContact CE1-NE2 2.48Å; H596-H600 AromaticContact ND1-NE2 3.9Å; H596-H600 AromaticContact NE2-CD2 3.85Å; H596-H600 AromaticContact NE2-NE2 2.48Å; H596-H600 PolarHBondContact NE2-NE2 3.23Å; M597-H600 PolarHBondContact O-N 3.18Å; H600-G602 PolarHBondContact O-N 2.86Å
601	T	81.6	Confident	85.1	Confident	62 Å²	62	66.2 Å²	66.2	38%	0.38	36%	0.356	S	S	.	.	S	Bend	trans	-73.1	-17.7	175.2	64.4	0	0	0	0	112.6	L554 M597 E603	L554-T601 HydrophobicContact CD2-CG2 3.9Å; M597-T601 PolarHBondContact O-N 2.64Å; M597-T601 PolarHBondContact O-OG1 3.21Å; T601-E603 WeakPolarHBondContact CB-OE2 3.23Å; T601-E603 PolarHBondContact O-N 2.96Å; T601-E603 VanDerWaalsContact O-N 3.1Å; T601-E603 WeakPolarHBondContact OG1-CB 3.49Å; T601-E603 WeakPolarHBondContact OG1-CG 3.11Å; T601-E603 PolarHBondContact OG1-N 3Å; T601-E603 PolarHBondContact OG1-OE2 3.25Å
602	G	82	Confident	85.3	Confident	38 Å²	38	67.8 Å²	67.8	39%	0.392	36%	0.356	S	S	.	.			trans	69.1	-0.6	-175.7	0	0	0	0	0	114.5	F598 H600 K604	F598-G602 PolarHBondContact O-N 3.14Å; H600-G602 PolarHBondContact O-N 2.86Å; G602-K604 WeakPolarHBondContact O-CG 3.39Å
603	E	81.8	Confident	85.4	Confident	66 Å²	66	72.2 Å²	72.2	31%	0.308	37%	0.367	S	S	.	.			trans	-62.1	134.3	-175.2	-69.6	167.8	140.2	0	0	111.9	F598 T601	F598-E603 HydrophobicContact CD1-CB 4.07Å; T601-E603 WeakPolarHBondContact CB-OE2 3.23Å; T601-E603 PolarHBondContact O-N 2.96Å; T601-E603 VanDerWaalsContact O-N 3.1Å; T601-E603 WeakPolarHBondContact OG1-CB 3.49Å; T601-E603 WeakPolarHBondContact OG1-CG 3.11Å; T601-E603 PolarHBondContact OG1-N 3Å; T601-E603 PolarHBondContact OG1-OE2 3.25Å
604	K	85.7	Confident	85.4	Confident	124 Å²	124	73.7 Å²	73.7	54%	0.539	38%	0.38	S	S	.	.			trans	-132.4	70.6	-176.1	-72.1	157.7	-171.5	164.8	0	109.8	G602 H606 S614 F615	G602-K604 WeakPolarHBondContact O-CG 3.39Å; K604-H606 PolarHBondContact O-N 3.22Å; K604-H606 VanDerWaalsContact O-N 3.15Å; K604-S614 WeakPolarHBondContact O-CB 3.3Å; K604-F615 CarbonylContact C-O 3.55Å; K604-F615 VanDerWaalsContact C-O 3.24Å; K604-F615 VanDerWaalsContact CA-O 3.28Å; K604-F615 WeakPolarHBondContact CA-O 3.31Å
605	P	82.7	Confident	85.6	Confident	81 Å²	81	73.2 Å²	73.2	53%	0.526	37%	0.374	S	S	.	.			trans	-69.1	-9.7	-173.2	28.5	-36	0	0	0	114.2
606	H	86.5	Confident	85.7	Confident	61 Å²	61	70.7 Å²	70.7	28%	0.282	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	90	-177.1	-58.9	-58.8	0	0	0	111.4	K604 F615 K618 L621	K604-H606 PolarHBondContact O-N 3.22Å; K604-H606 VanDerWaalsContact O-N 3.15Å; H606-F615 HydrophobicContact CB-CB 4.47Å; H606-F615 WeakPolarHBondContact CB-O 3.3Å; H606-F615 PolarHBondContact N-O 3.19Å; H606-F615 VanDerWaalsContact N-O 3.07Å; H606-F615 PolarHBondContact O-N 3.42Å; H606-K618 PolarHBondContact CD2-N 2.94Å; H606-K618 PolarHBondContact NE2-N 3.34Å; H606-L621 HydrophobicContact CB-CB 4.15Å; H606-L621 HydrophobicContact CB-CD2 3.9Å
607	Q	88.4	Confident	85.6	Confident	100 Å²	100	70.5 Å²	70.5	47%	0.467	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	140.1	178.1	-165.5	168.6	36	0	0	112.7	W612 L621	Q607-W612 HydrophobicContact CG-CE3 4.48Å; Q607-W612 WeakPolarHBondContact CG-O 3.27Å; Q607-W612 PolarHBondContact NE2-O 3.35Å; Q607-L621 WeakPolarHBondContact O-CD2 3.26Å
608	C	89.3	Confident	85.6	Confident	0 Å²	0	76.2 Å²	76.2	0%	0	39%	0.39	C	S	.	.			trans	-76.8	123.1	169.6	178.3	0	0	0	0	110.9	I610 C611 W612 R613 F615 L621 M625 H628	C608-I610 PolarHBondContact O-N 3.24Å; C608-C611 VanDerWaalsContact SG-SG 3.68Å; C608-W612 WeakPolarHBondContact O-CA 3.24Å; C608-W612 PolarHBondContact O-N 3.46Å; C608-R613 WeakPolarHBondContact CB-O 2.98Å; C608-R613 PolarHBondContact N-O 3.03Å; C608-F615 HydrophobicContact CB-CE2 4.35Å; C608-L621 HydrophobicContact CB-CD1 3.79Å; C608-M625 WeakPolarHBondContact SG-CE 3.3Å; C608-H628 PolarHBondContact SG-NE2 3.24Å
609	S	85.6	Confident	85.5	Confident	89 Å²	89	78.1 Å²	78.1	62%	0.622	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.8	-5.6	179.2	51.8	0	0	0	0	115.1
610	I	83.3	Confident	85.6	Confident	100 Å²	100	78.7 Å²	78.7	51%	0.513	39%	0.394	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.7	-48.8	-177.7	-58.4	-179.9	0	0	0	111.5	C608 M625 H628	C608-I610 PolarHBondContact O-N 3.24Å; I610-M625 HydrophobicContact CB-CE 4.35Å; I610-M625 HydrophobicContact CD1-CE 3.62Å; I610-M625 HydrophobicContact CG1-CE 3.93Å; I610-H628 HydrophobicContact CD1-CB 3.73Å; I610-H628 WeakPolarHBondContact CG2-ND1 3.5Å
611	C	87.6	Confident	85.8	Confident	51 Å²	51	76.1 Å²	76.1	35%	0.345	38%	0.383	S	S	.	.	T	Hydrogen-bonded Turn	trans	-117.4	14.2	179.3	68.3	0	0	0	0	114.4	C608 R613 H624 H628	C608-C611 VanDerWaalsContact SG-SG 3.68Å; C611-R613 PolarHBondContact O-N 2.82Å; C611-H624 PolarHBondContact SG-NE2 3.27Å; C611-H628 WeakPolarHBondContact CB-CE1 3.37Å; C611-H628 PolarHBondContact SG-CE1 3.2Å; C611-H628 PolarHBondContact SG-NE2 2.74Å
612	W	87.2	Confident	85.9	Confident	174 Å²	174	77.7 Å²	77.7	66%	0.659	39%	0.388	S	S	*	.			trans	58	6.7	175.3	-53.8	97	0	0	0	115.9	Q607 C608	Q607-W612 HydrophobicContact CG-CE3 4.48Å; Q607-W612 WeakPolarHBondContact CG-O 3.27Å; Q607-W612 PolarHBondContact NE2-O 3.35Å; C608-W612 WeakPolarHBondContact O-CA 3.24Å; C608-W612 PolarHBondContact O-N 3.46Å
613	R	87.1	Confident	86	Confident	167 Å²	167	81 Å²	81	63%	0.63	39%	0.391	S	S	*	.			trans	-72.1	128.3	178	-170.9	173.6	-177.2	126.4	-1.3	110.7	C608 C611 F615	C608-R613 WeakPolarHBondContact CB-O 2.98Å; C608-R613 PolarHBondContact N-O 3.03Å; C611-R613 PolarHBondContact O-N 2.82Å; R613-F615 HydrophobicContact CB-CE2 4.21Å; R613-F615 HydrophobicContact CG-CE2 4.06Å; R613-F615 HydrophobicContact CG-CZ 4Å; R613-F615 WeakPolarHBondContact O-CD2 3.21Å; R613-F615 VanDerWaalsContact O-CE2 3.24Å; R613-F615 WeakPolarHBondContact O-CE2 3.38Å
614	S	88.5	Confident	86.2	Confident	43 Å²	43	79.2 Å²	79.2	30%	0.301	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	145.2	-174.8	-50.4	0	0	0	0	113.4	K604	K604-S614 WeakPolarHBondContact O-CB 3.3Å
615	F	88.4	Confident	86.1	Confident	36 Å²	36	75.7 Å²	75.7	16%	0.158	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	147.5	-176.3	-61.1	-93	0	0	0	111.2	K604 H606 C608 R613 L621 H624	K604-F615 CarbonylContact C-O 3.55Å; K604-F615 VanDerWaalsContact C-O 3.24Å; K604-F615 VanDerWaalsContact CA-O 3.28Å; K604-F615 WeakPolarHBondContact CA-O 3.31Å; H606-F615 HydrophobicContact CB-CB 4.47Å; H606-F615 WeakPolarHBondContact CB-O 3.3Å; H606-F615 PolarHBondContact N-O 3.19Å; H606-F615 VanDerWaalsContact N-O 3.07Å; H606-F615 PolarHBondContact O-N 3.42Å; C608-F615 HydrophobicContact CB-CE2 4.35Å; R613-F615 HydrophobicContact CB-CE2 4.21Å; R613-F615 HydrophobicContact CG-CE2 4.06Å; R613-F615 HydrophobicContact CG-CZ 4Å; R613-F615 WeakPolarHBondContact O-CD2 3.21Å; R613-F615 VanDerWaalsContact O-CE2 3.24Å; R613-F615 WeakPolarHBondContact O-CE2 3.38Å; F615-L621 HydrophobicContact CB-CB 4.4Å; F615-L621 HydrophobicContact CD2-CB 4.14Å; F615-L621 HydrophobicContact CD2-CD1 4.12Å; F615-L621 HydrophobicContact CE2-CD1 4.35Å; F615-L621 HydrophobicContact CG-CB 4.41Å; F615-H624 HydrophobicContact CE1-CB 4.09Å; F615-H624 HydrophobicContact CE2-CB 4.08Å; F615-H624 AromaticContact CE2-CD2 3.27Å; F615-H624 WeakPolarHBondContact CE2-CD2 3.34Å; F615-H624 AromaticContact CE2-CG 3.81Å; F615-H624 HydrophobicContact CZ-CB 3.62Å; F615-H624 AromaticContact CZ-CD2 3.3Å; F615-H624 WeakPolarHBondContact CZ-CD2 3.45Å; F615-H624 AromaticContact CZ-CG 3.39Å; F615-H624 AromaticContact CZ-NE2 3.99Å
616	S	86.8	Confident	86	Confident	28 Å²	28	73.7 Å²	73.7	20%	0.196	36%	0.355	C	S	.	.	S	Bend	trans	-70.7	-33.2	176.1	47.9	0	0	0	0	113
617	L	86.1	Confident	85.8	Confident	24 Å²	24	74.9 Å²	74.9	13%	0.126	37%	0.367	C	S	.	.	S	Bend	trans	-123.6	139	-178.5	-54.1	-176.2	0	0	0	112.5	K595 F598 D619 Y620 L621	K595-L617 HydrophobicContact CB-CD1 4.39Å; K595-L617 HydrophobicContact CB-CD2 3.99Å; K595-L617 HydrophobicContact CD-CD1 4.22Å; K595-L617 HydrophobicContact CD-CD2 4.33Å; K595-L617 HydrophobicContact CG-CD1 4.32Å; K595-L617 HydrophobicContact CG-CD2 3.68Å; F598-L617 HydrophobicContact CD2-CD2 3.96Å; F598-L617 HydrophobicContact CE2-CD2 4.22Å; L617-D619 PolarHBondContact O-N 3.48Å; L617-Y620 HydrophobicContact CB-CD2 3.71Å; L617-Y620 HydrophobicContact CB-CE2 4.11Å; L617-Y620 HydrophobicContact CB-CG 4.39Å; L617-Y620 HydrophobicContact CD1-CD2 4.13Å; L617-Y620 HydrophobicContact CD1-CE2 3.62Å; L617-Y620 HydrophobicContact CG-CD2 4.01Å; L617-Y620 HydrophobicContact CG-CE2 3.93Å; L617-Y620 PolarHBondContact O-N 3.46Å; L617-L621 PolarHBondContact O-N 2.92Å
618	K	84.7	Confident	85.3	Confident	130 Å²	130	73.8 Å²	73.8	57%	0.565	36%	0.362	S	S	*	.	H	α-helix	trans	-54.3	-37.1	175.8	-170.5	-179.9	179.7	-178.7	0	112.3	H606 Y620 L621 I622	H606-K618 PolarHBondContact CD2-N 2.94Å; H606-K618 PolarHBondContact NE2-N 3.34Å; K618-Y620 VanDerWaalsContact C-N 3.27Å; K618-Y620 PolarHBondContact O-N 3.42Å; K618-L621 PolarHBondContact O-N 2.88Å; K618-I622 HydrophobicContact CG-CD1 4.03Å; K618-I622 HydrophobicContact CG-CG1 4.49Å; K618-I622 WeakPolarHBondContact O-CG1 3.46Å; K618-I622 PolarHBondContact O-N 3.15Å
619	D	84.1	Confident	84.6	Confident	78 Å²	78	78.2 Å²	78.2	42%	0.417	39%	0.389	S	S	.	.	H	α-helix	trans	-62.9	-32.3	178.4	-53.7	-31.6	0	0	0	112.8	L617 K623	L617-D619 PolarHBondContact O-N 3.48Å; D619-K623 WeakPolarHBondContact O-CB 3.16Å; D619-K623 WeakPolarHBondContact O-CD 3.38Å; D619-K623 VanDerWaalsContact O-CG 3.23Å; D619-K623 WeakPolarHBondContact O-CG 3.36Å; D619-K623 PolarHBondContact O-N 3.12Å; D619-K623 VanDerWaalsContact O-N 3.12Å
620	Y	86.2	Confident	84	Confident	120 Å²	120	76.1 Å²	76.1	47%	0.471	38%	0.381	S	S	.	.	H	α-helix	trans	-77.2	-38.1	175.2	-62.9	-43.1	0	0	0	111.5	L617 K618 K623 H624	L617-Y620 HydrophobicContact CB-CD2 3.71Å; L617-Y620 HydrophobicContact CB-CE2 4.11Å; L617-Y620 HydrophobicContact CB-CG 4.39Å; L617-Y620 HydrophobicContact CD1-CD2 4.13Å; L617-Y620 HydrophobicContact CD1-CE2 3.62Å; L617-Y620 HydrophobicContact CG-CD2 4.01Å; L617-Y620 HydrophobicContact CG-CE2 3.93Å; L617-Y620 PolarHBondContact O-N 3.46Å; K618-Y620 VanDerWaalsContact C-N 3.27Å; K618-Y620 PolarHBondContact O-N 3.42Å; Y620-K623 PolarHBondContact O-N 3.06Å; Y620-H624 VanDerWaalsContact O-CB 3.3Å; Y620-H624 WeakPolarHBondContact O-CB 3.22Å; Y620-H624 PolarHBondContact O-N 2.96Å
621	L	87.8	Confident	83.5	Confident	27 Å²	27	75.3 Å²	75.3	14%	0.141	38%	0.381	C	S	.	.	H	α-helix	trans	-59.6	-47.1	170.6	172.2	59.2	0	0	0	111.1	H606 Q607 C608 F615 L617 K618 K623 H624 M625	H606-L621 HydrophobicContact CB-CB 4.15Å; H606-L621 HydrophobicContact CB-CD2 3.9Å; Q607-L621 WeakPolarHBondContact O-CD2 3.26Å; C608-L621 HydrophobicContact CB-CD1 3.79Å; F615-L621 HydrophobicContact CB-CB 4.4Å; F615-L621 HydrophobicContact CD2-CB 4.14Å; F615-L621 HydrophobicContact CD2-CD1 4.12Å; F615-L621 HydrophobicContact CE2-CD1 4.35Å; F615-L621 HydrophobicContact CG-CB 4.41Å; L617-L621 PolarHBondContact O-N 2.92Å; K618-L621 PolarHBondContact O-N 2.88Å; L621-K623 PolarHBondContact O-N 3.41Å; L621-H624 CarbonylContact O-C 3.59Å; L621-H624 WeakPolarHBondContact O-CB 3.47Å; L621-H624 PolarHBondContact O-N 2.92Å; L621-H624 VanDerWaalsContact O-N 3.12Å; L621-M625 HydrophobicContact CD1-CG 4.07Å; L621-M625 HydrophobicContact CD1-SD 4.36Å; L621-M625 HydrophobicContact CG-CG 4.42Å; L621-M625 WeakPolarHBondContact O-CG 3.42Å; L621-M625 PolarHBondContact O-N 3.14Å
622	I	85.2	Confident	83	Confident	94 Å²	94	79.4 Å²	79.4	48%	0.482	39%	0.389	S	S	.	.	H	α-helix	trans	-60.4	-46.8	178	-67.4	166	0	0	0	110.9	K618 H624 M625 V626	K618-I622 HydrophobicContact CG-CD1 4.03Å; K618-I622 HydrophobicContact CG-CG1 4.49Å; K618-I622 WeakPolarHBondContact O-CG1 3.46Å; K618-I622 PolarHBondContact O-N 3.15Å; I622-H624 VanDerWaalsContact C-N 3.25Å; I622-H624 PolarHBondContact O-N 3.37Å; I622-M625 PolarHBondContact O-N 3.1Å; I622-M625 VanDerWaalsContact O-N 3.15Å; I622-V626 PolarHBondContact O-N 2.91Å
623	K	83.8	Confident	82.5	Confident	107 Å²	107	74.2 Å²	74.2	47%	0.465	38%	0.383	S	S	.	.	H	α-helix	trans	-62.6	-30.8	175.7	-73	167.3	-173.7	170.8	0	113	D619 Y620 L621	D619-K623 WeakPolarHBondContact O-CB 3.16Å; D619-K623 WeakPolarHBondContact O-CD 3.38Å; D619-K623 VanDerWaalsContact O-CG 3.23Å; D619-K623 WeakPolarHBondContact O-CG 3.36Å; D619-K623 PolarHBondContact O-N 3.12Å; D619-K623 VanDerWaalsContact O-N 3.12Å; Y620-K623 PolarHBondContact O-N 3.06Å; L621-K623 PolarHBondContact O-N 3.41Å
624	H	86.3	Confident	82.2	Confident	30 Å²	30	70.8 Å²	70.8	14%	0.139	37%	0.371	C	S	.	.	H	α-helix	trans	-75.5	-33.5	173.6	172.9	51	0	0	0	112.7	C611 F615 Y620 L621 I622 V626 T627 H628	C611-H624 PolarHBondContact SG-NE2 3.27Å; F615-H624 HydrophobicContact CE1-CB 4.09Å; F615-H624 HydrophobicContact CE2-CB 4.08Å; F615-H624 AromaticContact CE2-CD2 3.27Å; F615-H624 WeakPolarHBondContact CE2-CD2 3.34Å; F615-H624 AromaticContact CE2-CG 3.81Å; F615-H624 HydrophobicContact CZ-CB 3.62Å; F615-H624 AromaticContact CZ-CD2 3.3Å; F615-H624 WeakPolarHBondContact CZ-CD2 3.45Å; F615-H624 AromaticContact CZ-CG 3.39Å; F615-H624 AromaticContact CZ-NE2 3.99Å; Y620-H624 VanDerWaalsContact O-CB 3.3Å; Y620-H624 WeakPolarHBondContact O-CB 3.22Å; Y620-H624 PolarHBondContact O-N 2.96Å; L621-H624 CarbonylContact O-C 3.59Å; L621-H624 WeakPolarHBondContact O-CB 3.47Å; L621-H624 PolarHBondContact O-N 2.92Å; L621-H624 VanDerWaalsContact O-N 3.12Å; I622-H624 VanDerWaalsContact C-N 3.25Å; I622-H624 PolarHBondContact O-N 3.37Å; H624-V626 PolarHBondContact O-N 3.5Å; H624-T627 PolarHBondContact ND1-OG1 2.79Å; H624-T627 VanDerWaalsContact ND1-OG1 3.09Å; H624-T627 PolarHBondContact O-N 3.29Å; H624-T627 PolarHBondContact O-OG1 3.12Å; H624-H628 AromaticContact CD2-NE2 3.21Å; H624-H628 PolarHBondContact CD2-NE2 3.31Å; H624-H628 AromaticContact CE1-CD2 3.71Å; H624-H628 AromaticContact CE1-NE2 2.47Å; H624-H628 PolarHBondContact CE1-NE2 3.27Å; H624-H628 AromaticContact CG-NE2 3.93Å; H624-H628 AromaticContact ND1-NE2 3.56Å; H624-H628 AromaticContact NE2-CD2 3.66Å; H624-H628 AromaticContact NE2-NE2 2.13Å; H624-H628 PolarHBondContact NE2-NE2 2.78Å
625	M	82.4	Confident	82.1	Confident	50 Å²	50	73.1 Å²	73.1	25%	0.246	38%	0.377	C	S	.	.	H	α-helix	trans	-60.8	-29.2	176.2	-63.9	-94	62.2	0	0	111.8	C608 I610 L621 I622 T627 H628 T629	C608-M625 WeakPolarHBondContact SG-CE 3.3Å; I610-M625 HydrophobicContact CB-CE 4.35Å; I610-M625 HydrophobicContact CD1-CE 3.62Å; I610-M625 HydrophobicContact CG1-CE 3.93Å; L621-M625 HydrophobicContact CD1-CG 4.07Å; L621-M625 HydrophobicContact CD1-SD 4.36Å; L621-M625 HydrophobicContact CG-CG 4.42Å; L621-M625 WeakPolarHBondContact O-CG 3.42Å; L621-M625 PolarHBondContact O-N 3.14Å; I622-M625 PolarHBondContact O-N 3.1Å; I622-M625 VanDerWaalsContact O-N 3.15Å; M625-T627 PolarHBondContact O-N 3.45Å; M625-H628 HydrophobicContact CE-CB 4.34Å; M625-H628 PolarHBondContact O-N 3.34Å; M625-T629 PolarHBondContact O-N 3.03Å; M625-T629 VanDerWaalsContact O-N 3.07Å
626	V	81.8	Confident	82.1	Confident	39 Å²	39	71.4 Å²	71.4	24%	0.236	37%	0.37	C	S	.	.	H	α-helix	trans	-62.1	-25	171.2	-172	0	0	0	0	113.1	I622 H624 H628 G630 V631 T644	I622-V626 PolarHBondContact O-N 2.91Å; H624-V626 PolarHBondContact O-N 3.5Å; V626-H628 VanDerWaalsContact C-N 3.32Å; V626-G630 PolarHBondContact O-N 3.49Å; V626-V631 HydrophobicContact CG1-CB 4.48Å; V626-V631 VanDerWaalsContact CG1-O 3.28Å; V626-V631 WeakPolarHBondContact CG1-O 3.44Å; V626-T644 HydrophobicContact CG1-CG2 3.94Å
627	T	81.2	Confident	81.9	Confident	85 Å²	85	74.9 Å²	74.9	52%	0.521	39%	0.394	S	S	.	.	H	α-helix	trans	-76.7	-20.1	174	71.1	0	0	0	0	112.9	H624 M625	H624-T627 PolarHBondContact ND1-OG1 2.79Å; H624-T627 VanDerWaalsContact ND1-OG1 3.09Å; H624-T627 PolarHBondContact O-N 3.29Å; H624-T627 PolarHBondContact O-OG1 3.12Å; M625-T627 PolarHBondContact O-N 3.45Å
628	H	77.5	Confident	81.8	Confident	78 Å²	78	78.6 Å²	78.6	36%	0.361	41%	0.413	S	S	.	.	H	α-helix	trans	-88.7	-36.4	174.4	-68.8	-74.2	0	0	0	112.5	C608 I610 C611 H624 M625 V626 G630	C608-H628 PolarHBondContact SG-NE2 3.24Å; I610-H628 HydrophobicContact CD1-CB 3.73Å; I610-H628 WeakPolarHBondContact CG2-ND1 3.5Å; C611-H628 WeakPolarHBondContact CB-CE1 3.37Å; C611-H628 PolarHBondContact SG-CE1 3.2Å; C611-H628 PolarHBondContact SG-NE2 2.74Å; H624-H628 AromaticContact CD2-NE2 3.21Å; H624-H628 PolarHBondContact CD2-NE2 3.31Å; H624-H628 AromaticContact CE1-CD2 3.71Å; H624-H628 AromaticContact CE1-NE2 2.47Å; H624-H628 PolarHBondContact CE1-NE2 3.27Å; H624-H628 AromaticContact CG-NE2 3.93Å; H624-H628 AromaticContact ND1-NE2 3.56Å; H624-H628 AromaticContact NE2-CD2 3.66Å; H624-H628 AromaticContact NE2-NE2 2.13Å; H624-H628 PolarHBondContact NE2-NE2 2.78Å; M625-H628 HydrophobicContact CE-CB 4.34Å; M625-H628 PolarHBondContact O-N 3.34Å; V626-H628 VanDerWaalsContact C-N 3.32Å; H628-G630 VanDerWaalsContact C-N 3.27Å; H628-G630 PolarHBondContact O-N 3.24Å
629	T	76.3	Confident	81.7	Confident	93 Å²	93	74.2 Å²	74.2	57%	0.571	40%	0.398	S	S	*	.	H	α-helix	trans	-78.7	-10.1	175.7	62.8	0	0	0	0	113.5	M625 V631	M625-T629 PolarHBondContact O-N 3.03Å; M625-T629 VanDerWaalsContact O-N 3.07Å; T629-V631 PolarHBondContact O-N 2.66Å
630	G	71.8	Confident	81.6	Confident	45 Å²	45	75.3 Å²	75.3	46%	0.464	40%	0.404	S	S	.	.			trans	66.2	6.2	-179.7	0	0	0	0	0	115	V626 H628 R632	V626-G630 PolarHBondContact O-N 3.49Å; H628-G630 VanDerWaalsContact C-N 3.27Å; H628-G630 PolarHBondContact O-N 3.24Å; G630-R632 WeakPolarHBondContact O-CG 3.45Å; G630-R632 PolarHBondContact O-N 2.89Å
631	V	72.4	Confident	81.5	Confident	83 Å²	83	75.7 Å²	75.7	50%	0.503	41%	0.408	S	S	.	.			trans	-70.7	94.9	-171.1	178.1	0	0	0	0	111.1	V626 T629 A633	V626-V631 HydrophobicContact CG1-CB 4.48Å; V626-V631 VanDerWaalsContact CG1-O 3.28Å; V626-V631 WeakPolarHBondContact CG1-O 3.44Å; T629-V631 PolarHBondContact O-N 2.66Å; V631-A633 HydrophobicContact CG1-CB 4.38Å; V631-A633 PolarHBondContact O-N 2.93Å
632	R	77.6	Confident	81.2	Confident	136 Å²	136	80.4 Å²	80.4	51%	0.513	42%	0.424	S	S	.	.			trans	-92.8	74.6	178	-64.8	163.6	85.5	140.5	4.9	109.5	G630 Y634 R642 F643 T644	G630-R632 WeakPolarHBondContact O-CG 3.45Å; G630-R632 PolarHBondContact O-N 2.89Å; R632-Y634 VanDerWaalsContact C-N 3.28Å; R632-Y634 PolarHBondContact O-N 3.49Å; R632-R642 HydrophobicContact CB-CB 3.63Å; R632-R642 VanDerWaalsContact CZ-O 3.32Å; R632-R642 PolarHBondContact NE-O 2.96Å; R632-R642 PolarHBondContact NH2-O 3.13Å; R632-R642 PolarHBondContact O-NE 3.2Å; R632-R642 PolarHBondContact O-NH2 3.45Å; R632-F643 CarbonylContact C-O 3.2Å; R632-F643 VanDerWaalsContact C-O 3.28Å; R632-F643 VanDerWaalsContact CA-O 3.29Å; R632-F643 WeakPolarHBondContact CA-O 3.34Å; R632-T644 HydrophobicContact CG-CG2 3.78Å
633	A	76.4	Confident	81.1	Confident	66 Å²	66	77.9 Å²	77.9	55%	0.545	41%	0.41	S	S	.	.			trans	-68.4	-19.7	-174.6	0	0	0	0	0	114.7	V631 F643	V631-A633 HydrophobicContact CG1-CB 4.38Å; V631-A633 PolarHBondContact O-N 2.93Å; A633-F643 PolarHBondContact N-O 2.85Å
634	Y	81.8	Confident	81	Confident	94 Å²	94	74.9 Å²	74.9	37%	0.369	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	101	-172.7	-59.4	-79.8	0	0	0	110.9	R632 R642 F643 Q645 K646	R632-Y634 VanDerWaalsContact C-N 3.28Å; R632-Y634 PolarHBondContact O-N 3.49Å; Y634-R642 CarbonylContact O-C 3.53Å; Y634-R642 WeakPolarHBondContact O-CA 3.46Å; Y634-F643 PolarHBondContact N-O 3.15Å; Y634-F643 PolarHBondContact O-N 3.07Å; Y634-Q645 VanDerWaalsContact CD2-C 3.43Å; Y634-K646 HydrophobicContact CD1-CB 3.86Å; Y634-K646 HydrophobicContact CD1-CG 4.2Å; Y634-K646 HydrophobicContact CE1-CB 3.57Å; Y634-K646 HydrophobicContact CE1-CD 4.37Å; Y634-K646 HydrophobicContact CE1-CG 4.06Å; Y634-K646 HydrophobicContact CG-CB 4.43Å
635	Q	85.9	Confident	80.7	Confident	93 Å²	93	77 Å²	77	44%	0.435	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	139.2	179.2	-175.4	161.5	-29.3	0	0	111.8	N640 R642 L649	Q635-N640 PolarHBondContact NE2-OD1 2.87Å; Q635-R642 HydrophobicContact CB-CG 4.22Å; Q635-R642 HydrophobicContact CG-CG 4.18Å; Q635-L649 WeakPolarHBondContact O-CD2 3.32Å
636	C	87.4	Confident	80.7	Confident	0 Å²	0	81.8 Å²	81.8	0%	0	43%	0.43	C	S	.	.			trans	-75.5	125	166.6	176.7	0	0	0	0	110.1	I638 C639 N640 K641 F643 L649 H652 M653 H656	C636-I638 PolarHBondContact O-N 2.92Å; C636-I638 PolarHBondContact SG-N 3.34Å; C636-I638 VanDerWaalsContact SG-N 3.37Å; C636-C639 PolarHBondContact SG-N 2.88Å; C636-N640 WeakPolarHBondContact O-CA 3.31Å; C636-N640 PolarHBondContact O-N 3.08Å; C636-K641 WeakPolarHBondContact CB-O 3.3Å; C636-K641 PolarHBondContact N-O 3.39Å; C636-F643 HydrophobicContact CB-CE2 4.39Å; C636-L649 HydrophobicContact CB-CD1 3.88Å; C636-H652 PolarHBondContact SG-NE2 2.69Å; C636-H652 VanDerWaalsContact SG-NE2 3.44Å; C636-M653 HydrophobicContact CB-SD 4.36Å; C636-H656 PolarHBondContact SG-NE2 3.49Å
637	S	83.8	Confident	80.8	Confident	101 Å²	101	83 Å²	83	71%	0.706	44%	0.44	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.3	-14.8	177	49.8	0	0	0	0	114.6
638	I	83.4	Confident	80.9	Confident	101 Å²	101	81.1 Å²	81.1	52%	0.518	43%	0.431	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.9	-38.2	-173.5	-58.3	172.5	0	0	0	112	C636 M653 H656	C636-I638 PolarHBondContact O-N 2.92Å; C636-I638 PolarHBondContact SG-N 3.34Å; C636-I638 VanDerWaalsContact SG-N 3.37Å; I638-M653 HydrophobicContact CD1-CE 3.58Å; I638-M653 HydrophobicContact CG1-CE 4.07Å; I638-H656 HydrophobicContact CD1-CB 3.59Å; I638-H656 HydrophobicContact CG2-CB 4.48Å
639	C	83.6	Confident	81.3	Confident	39 Å²	39	78.8 Å²	78.8	26%	0.264	42%	0.421	S	S	.	.	T	Hydrogen-bonded Turn	trans	-130.2	15	179.9	72.5	0	0	0	0	114.8	C636 K641 H652 H656	C636-C639 PolarHBondContact SG-N 2.88Å; C639-K641 PolarHBondContact O-N 2.91Å; C639-H652 PolarHBondContact SG-NE2 2.83Å; C639-H656 WeakPolarHBondContact CB-CE1 3.27Å; C639-H656 WeakPolarHBondContact CB-NE2 3.2Å; C639-H656 PolarHBondContact SG-CE1 2.87Å; C639-H656 PolarHBondContact SG-NE2 3.41Å
640	N	81.6	Confident	81.6	Confident	100 Å²	100	79.7 Å²	79.7	54%	0.535	42%	0.422	S	S	.	.			trans	56.2	5.1	176.6	-66.6	-47	0	0	0	116.7	Q635 C636 R642	Q635-N640 PolarHBondContact NE2-OD1 2.87Å; C636-N640 WeakPolarHBondContact O-CA 3.31Å; C636-N640 PolarHBondContact O-N 3.08Å; N640-R642 PolarHBondContact O-N 2.83Å
641	K	83.1	Confident	82	Confident	128 Å²	128	79.7 Å²	79.7	56%	0.557	41%	0.413	S	S	*	.			trans	-61.7	130.6	174.3	-67.4	-177.4	-165.1	-63.5	0	110.1	C636 C639 F643	C636-K641 WeakPolarHBondContact CB-O 3.3Å; C636-K641 PolarHBondContact N-O 3.39Å; C639-K641 PolarHBondContact O-N 2.91Å; K641-F643 HydrophobicContact CB-CE2 3.97Å; K641-F643 HydrophobicContact CB-CZ 4.14Å; K641-F643 WeakPolarHBondContact O-CD2 3.37Å; K641-F643 VanDerWaalsContact O-CE2 3.28Å; K641-F643 WeakPolarHBondContact O-CE2 3.42Å
642	R	82.8	Confident	82.6	Confident	127 Å²	127	76.8 Å²	76.8	48%	0.479	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	140.2	-176	-57.7	179.8	62.6	162.4	3.3	111.8	R632 Y634 Q635 N640	R632-R642 HydrophobicContact CB-CB 3.63Å; R632-R642 VanDerWaalsContact CZ-O 3.32Å; R632-R642 PolarHBondContact NE-O 2.96Å; R632-R642 PolarHBondContact NH2-O 3.13Å; R632-R642 PolarHBondContact O-NE 3.2Å; R632-R642 PolarHBondContact O-NH2 3.45Å; Y634-R642 CarbonylContact O-C 3.53Å; Y634-R642 WeakPolarHBondContact O-CA 3.46Å; Q635-R642 HydrophobicContact CB-CG 4.22Å; Q635-R642 HydrophobicContact CG-CG 4.18Å; N640-R642 PolarHBondContact O-N 2.83Å
643	F	82.9	Confident	82.7	Confident	41 Å²	41	72.3 Å²	72.3	18%	0.18	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	151.6	-175.5	-59.6	-90.1	0	0	0	111.3	R632 A633 Y634 C636 K641 L649 H652	R632-F643 CarbonylContact C-O 3.2Å; R632-F643 VanDerWaalsContact C-O 3.28Å; R632-F643 VanDerWaalsContact CA-O 3.29Å; R632-F643 WeakPolarHBondContact CA-O 3.34Å; A633-F643 PolarHBondContact N-O 2.85Å; Y634-F643 PolarHBondContact N-O 3.15Å; Y634-F643 PolarHBondContact O-N 3.07Å; C636-F643 HydrophobicContact CB-CE2 4.39Å; K641-F643 HydrophobicContact CB-CE2 3.97Å; K641-F643 HydrophobicContact CB-CZ 4.14Å; K641-F643 WeakPolarHBondContact O-CD2 3.37Å; K641-F643 VanDerWaalsContact O-CE2 3.28Å; K641-F643 WeakPolarHBondContact O-CE2 3.42Å; F643-L649 HydrophobicContact CB-CB 4.4Å; F643-L649 HydrophobicContact CD2-CB 4.06Å; F643-L649 HydrophobicContact CD2-CD1 3.98Å; F643-L649 HydrophobicContact CE2-CD1 4.15Å; F643-L649 HydrophobicContact CG-CB 4.36Å; F643-H652 HydrophobicContact CE1-CB 4.1Å; F643-H652 HydrophobicContact CE2-CB 4.14Å; F643-H652 AromaticContact CE2-CD2 3.33Å; F643-H652 WeakPolarHBondContact CE2-CD2 3.28Å; F643-H652 AromaticContact CE2-CG 3.8Å; F643-H652 AromaticContact CE2-NE2 3.96Å; F643-H652 HydrophobicContact CZ-CB 3.62Å; F643-H652 AromaticContact CZ-CD2 3.38Å; F643-H652 WeakPolarHBondContact CZ-CD2 3.47Å; F643-H652 AromaticContact CZ-CG 3.35Å; F643-H652 AromaticContact CZ-ND1 3.91Å; F643-H652 AromaticContact CZ-NE2 3.94Å
644	T	80.4	Confident	82.9	Confident	44 Å²	44	71.1 Å²	71.1	27%	0.27	36%	0.361	S	S	.	.	S	Bend	trans	-82	-14.2	175.8	51	0	0	0	0	113.4	V626 R632	V626-T644 HydrophobicContact CG1-CG2 3.94Å; R632-T644 HydrophobicContact CG-CG2 3.78Å
645	Q	80.4	Confident	82.7	Confident	73 Å²	73	70.7 Å²	70.7	34%	0.341	36%	0.364	S	S	.	.	S	Bend	trans	-138.2	141	-177.9	-54.5	-175	23.9	0	0	112.3	Y634 S647 S648 L649	Y634-Q645 VanDerWaalsContact CD2-C 3.43Å; Q645-S647 WeakPolarHBondContact CB-OG 3.5Å; Q645-S647 PolarHBondContact O-N 2.94Å; Q645-S647 PolarHBondContact OE1-OG 3.42Å; Q645-S648 PolarHBondContact O-N 3.19Å; Q645-L649 PolarHBondContact O-N 3.26Å; Q645-L649 VanDerWaalsContact O-N 3.13Å
646	K	82.6	Confident	82.2	Confident	151 Å²	151	70.3 Å²	70.3	66%	0.657	36%	0.362	S	S	*	.	H	α-helix	trans	-59.7	-34.1	175.9	-166.8	174.9	179.7	177.6	0	112.8	Y634 L649 N650	Y634-K646 HydrophobicContact CD1-CB 3.86Å; Y634-K646 HydrophobicContact CD1-CG 4.2Å; Y634-K646 HydrophobicContact CE1-CB 3.57Å; Y634-K646 HydrophobicContact CE1-CD 4.37Å; Y634-K646 HydrophobicContact CE1-CG 4.06Å; Y634-K646 HydrophobicContact CG-CB 4.43Å; K646-L649 PolarHBondContact O-N 3.24Å; K646-N650 WeakPolarHBondContact O-CB 3.39Å; K646-N650 PolarHBondContact O-N 3Å
647	S	83.2	Confident	81.5	Confident	64 Å²	64	78.9 Å²	78.9	45%	0.448	40%	0.395	S	S	.	.	H	α-helix	trans	-59.2	-50.7	173.6	44.9	0	0	0	0	111.6	Q645 L649 N650 V651	Q645-S647 WeakPolarHBondContact CB-OG 3.5Å; Q645-S647 PolarHBondContact O-N 2.94Å; Q645-S647 PolarHBondContact OE1-OG 3.42Å; S647-L649 VanDerWaalsContact C-N 3.34Å; S647-L649 PolarHBondContact O-N 3.34Å; S647-N650 PolarHBondContact O-N 3Å; S647-V651 WeakPolarHBondContact O-CB 3.21Å; S647-V651 VanDerWaalsContact O-CG2 3.28Å; S647-V651 WeakPolarHBondContact O-CG2 3.43Å; S647-V651 PolarHBondContact O-N 3.49Å
648	S	83.5	Confident	80.7	Confident	47 Å²	47	76.5 Å²	76.5	33%	0.329	39%	0.385	S	S	.	.	H	α-helix	trans	-61.7	-40.2	177.5	-52.4	0	0	0	0	112.3	Q645 H652	Q645-S648 PolarHBondContact O-N 3.19Å; S648-H652 VanDerWaalsContact O-CB 3.3Å; S648-H652 WeakPolarHBondContact O-CB 3.11Å; S648-H652 PolarHBondContact O-N 2.74Å
649	L	86.2	Confident	80	Confident	29 Å²	29	75.2 Å²	75.2	15%	0.152	38%	0.377	C	S	.	.	H	α-helix	trans	-62.2	-51.9	173.2	171.9	59.5	0	0	0	111.5	Q635 C636 F643 Q645 K646 S647 V651 H652 M653	Q635-L649 WeakPolarHBondContact O-CD2 3.32Å; C636-L649 HydrophobicContact CB-CD1 3.88Å; F643-L649 HydrophobicContact CB-CB 4.4Å; F643-L649 HydrophobicContact CD2-CB 4.06Å; F643-L649 HydrophobicContact CD2-CD1 3.98Å; F643-L649 HydrophobicContact CE2-CD1 4.15Å; F643-L649 HydrophobicContact CG-CB 4.36Å; Q645-L649 PolarHBondContact O-N 3.26Å; Q645-L649 VanDerWaalsContact O-N 3.13Å; K646-L649 PolarHBondContact O-N 3.24Å; S647-L649 VanDerWaalsContact C-N 3.34Å; S647-L649 PolarHBondContact O-N 3.34Å; L649-V651 VanDerWaalsContact C-N 3.34Å; L649-V651 PolarHBondContact O-N 3.27Å; L649-H652 CarbonylContact O-C 3.57Å; L649-H652 WeakPolarHBondContact O-CA 3.37Å; L649-H652 WeakPolarHBondContact O-CB 3.27Å; L649-H652 PolarHBondContact O-N 3.03Å; L649-M653 HydrophobicContact CD1-CG 4.03Å; L649-M653 HydrophobicContact CD1-SD 4.04Å; L649-M653 HydrophobicContact CG-CG 4.39Å; L649-M653 WeakPolarHBondContact O-CG 3.47Å; L649-M653 PolarHBondContact O-N 2.95Å
650	N	83.8	Confident	79.3	Confident	111 Å²	111	79.7 Å²	79.7	59%	0.594	39%	0.392	S	S	*	.	H	α-helix	trans	-59.4	-45.1	-178.9	-170.8	7.1	0	0	0	111.6	K646 S647 H652 M653 R654	K646-N650 WeakPolarHBondContact O-CB 3.39Å; K646-N650 PolarHBondContact O-N 3Å; S647-N650 PolarHBondContact O-N 3Å; N650-H652 VanDerWaalsContact C-N 3.28Å; N650-H652 PolarHBondContact O-N 3.02Å; N650-M653 PolarHBondContact O-N 3.24Å; N650-M653 VanDerWaalsContact O-N 3.11Å; N650-R654 PolarHBondContact O-N 3.22Å
651	V	80	Confident	79	Confident	46 Å²	46	78.3 Å²	78.3	28%	0.279	39%	0.39	S	S	.	.	H	α-helix	trans	-57.8	-40.1	173.8	167	0	0	0	0	111.9	S647 L649 R654 H673	S647-V651 WeakPolarHBondContact O-CB 3.21Å; S647-V651 VanDerWaalsContact O-CG2 3.28Å; S647-V651 WeakPolarHBondContact O-CG2 3.43Å; S647-V651 PolarHBondContact O-N 3.49Å; L649-V651 VanDerWaalsContact C-N 3.34Å; L649-V651 PolarHBondContact O-N 3.27Å; V651-R654 PolarHBondContact O-N 3.09Å; V651-H673 WeakPolarHBondContact CG1-CE1 3.42Å; V651-H673 WeakPolarHBondContact CG1-ND1 3.22Å
652	H	84.3	Confident	78.6	Confident	21 Å²	21	75.6 Å²	75.6	10%	0.097	38%	0.377	C	S	.	.	H	α-helix	trans	-69.2	-35.8	174.4	166.4	67.4	0	0	0	113.3	C636 C639 F643 S648 L649 N650 R654 L655 H656	C636-H652 PolarHBondContact SG-NE2 2.69Å; C636-H652 VanDerWaalsContact SG-NE2 3.44Å; C639-H652 PolarHBondContact SG-NE2 2.83Å; F643-H652 HydrophobicContact CE1-CB 4.1Å; F643-H652 HydrophobicContact CE2-CB 4.14Å; F643-H652 AromaticContact CE2-CD2 3.33Å; F643-H652 WeakPolarHBondContact CE2-CD2 3.28Å; F643-H652 AromaticContact CE2-CG 3.8Å; F643-H652 AromaticContact CE2-NE2 3.96Å; F643-H652 HydrophobicContact CZ-CB 3.62Å; F643-H652 AromaticContact CZ-CD2 3.38Å; F643-H652 WeakPolarHBondContact CZ-CD2 3.47Å; F643-H652 AromaticContact CZ-CG 3.35Å; F643-H652 AromaticContact CZ-ND1 3.91Å; F643-H652 AromaticContact CZ-NE2 3.94Å; S648-H652 VanDerWaalsContact O-CB 3.3Å; S648-H652 WeakPolarHBondContact O-CB 3.11Å; S648-H652 PolarHBondContact O-N 2.74Å; L649-H652 CarbonylContact O-C 3.57Å; L649-H652 WeakPolarHBondContact O-CA 3.37Å; L649-H652 WeakPolarHBondContact O-CB 3.27Å; L649-H652 PolarHBondContact O-N 3.03Å; N650-H652 VanDerWaalsContact C-N 3.28Å; N650-H652 PolarHBondContact O-N 3.02Å; H652-R654 PolarHBondContact O-N 3.45Å; H652-L655 VanDerWaalsContact O-CB 3.24Å; H652-L655 WeakPolarHBondContact O-CB 3.1Å; H652-L655 WeakPolarHBondContact O-CG 3.4Å; H652-L655 PolarHBondContact O-N 2.91Å; H652-H656 AromaticContact CD2-NE2 3.57Å; H652-H656 AromaticContact CE1-NE2 2.91Å; H652-H656 PolarHBondContact CE1-NE2 2.94Å; H652-H656 AromaticContact NE2-CD2 3.78Å; H652-H656 AromaticContact NE2-NE2 2.49Å; H652-H656 PolarHBondContact NE2-NE2 3.46Å
653	M	80	Confident	78.6	Confident	42 Å²	42	73.5 Å²	73.5	21%	0.207	37%	0.373	C	S	.	.	H	α-helix	trans	-61.2	-28.8	176.1	-66.1	-58.4	-69.3	0	0	112.5	C636 I638 L649 N650 L655 H656 R657	C636-M653 HydrophobicContact CB-SD 4.36Å; I638-M653 HydrophobicContact CD1-CE 3.58Å; I638-M653 HydrophobicContact CG1-CE 4.07Å; L649-M653 HydrophobicContact CD1-CG 4.03Å; L649-M653 HydrophobicContact CD1-SD 4.04Å; L649-M653 HydrophobicContact CG-CG 4.39Å; L649-M653 WeakPolarHBondContact O-CG 3.47Å; L649-M653 PolarHBondContact O-N 2.95Å; N650-M653 PolarHBondContact O-N 3.24Å; N650-M653 VanDerWaalsContact O-N 3.11Å; M653-L655 PolarHBondContact O-N 2.8Å; M653-H656 PolarHBondContact O-N 3.46Å; M653-H656 VanDerWaalsContact O-N 3.16Å; M653-R657 PolarHBondContact O-N 3.48Å; M653-R657 VanDerWaalsContact O-N 3.15Å
654	R	80.6	Confident	78.6	Confident	42 Å²	42	71.6 Å²	71.6	16%	0.158	36%	0.364	C	S	.	.	H	α-helix	trans	-63.4	-24	172.5	-61	-165.9	-60.7	-165.2	-0.1	113.6	N650 V651 H652 G658 E659 Y662 S672	N650-R654 PolarHBondContact O-N 3.22Å; V651-R654 PolarHBondContact O-N 3.09Å; H652-R654 PolarHBondContact O-N 3.45Å; R654-G658 PolarHBondContact O-N 3.04Å; R654-E659 HydrophobicContact CB-CB 4.05Å; R654-E659 HydrophobicContact CG-CB 4.37Å; R654-E659 WeakPolarHBondContact CG-OE2 3.37Å; R654-E659 PolarHBondContact O-N 2.86Å; R654-Y662 PolarHBondContact NH1-OH 3.35Å; R654-Y662 VanDerWaalsContact NH1-OH 3.09Å; R654-S672 VanDerWaalsContact CZ-O 3.31Å; R654-S672 PolarHBondContact NE-O 2.97Å; R654-S672 PolarHBondContact NH2-O 3.09Å
655	L	76.6	Confident	78.8	Confident	85 Å²	85	76.9 Å²	76.9	45%	0.445	38%	0.381	S	S	.	.	H	α-helix	trans	-68.4	-44.7	172.8	-56	176.8	0	0	0	110.7	H652 M653 R657 G658 S672	H652-L655 VanDerWaalsContact O-CB 3.24Å; H652-L655 WeakPolarHBondContact O-CB 3.1Å; H652-L655 WeakPolarHBondContact O-CG 3.4Å; H652-L655 PolarHBondContact O-N 2.91Å; M653-L655 PolarHBondContact O-N 2.8Å; L655-R657 VanDerWaalsContact C-N 3.3Å; L655-R657 PolarHBondContact O-N 3.1Å; L655-G658 PolarHBondContact O-N 2.83Å; L655-G658 VanDerWaalsContact O-N 3.16Å; L655-S672 WeakPolarHBondContact CD2-OG 3.39Å
656	H	75.8	Confident	78.8	Confident	84 Å²	84	77.1 Å²	77.1	39%	0.389	38%	0.384	S	S	.	.	H	α-helix	trans	-65.9	-31	177.2	-70.1	-62.4	0	0	0	113.3	C636 I638 C639 H652 M653	C636-H656 PolarHBondContact SG-NE2 3.49Å; I638-H656 HydrophobicContact CD1-CB 3.59Å; I638-H656 HydrophobicContact CG2-CB 4.48Å; C639-H656 WeakPolarHBondContact CB-CE1 3.27Å; C639-H656 WeakPolarHBondContact CB-NE2 3.2Å; C639-H656 PolarHBondContact SG-CE1 2.87Å; C639-H656 PolarHBondContact SG-NE2 3.41Å; H652-H656 AromaticContact CD2-NE2 3.57Å; H652-H656 AromaticContact CE1-NE2 2.91Å; H652-H656 PolarHBondContact CE1-NE2 2.94Å; H652-H656 AromaticContact NE2-CD2 3.78Å; H652-H656 AromaticContact NE2-NE2 2.49Å; H652-H656 PolarHBondContact NE2-NE2 3.46Å; M653-H656 PolarHBondContact O-N 3.46Å; M653-H656 VanDerWaalsContact O-N 3.16Å
657	R	72.4	Confident	78.9	Confident	181 Å²	181	72.1 Å²	72.1	68%	0.683	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.1	-5.8	174.4	-65.5	-172.8	170.8	-166.8	-6.3	114.6	M653 L655 E659	M653-R657 PolarHBondContact O-N 3.48Å; M653-R657 VanDerWaalsContact O-N 3.15Å; L655-R657 VanDerWaalsContact C-N 3.3Å; L655-R657 PolarHBondContact O-N 3.1Å; R657-E659 HydrophobicContact CB-CB 4.42Å; R657-E659 HydrophobicContact CB-CG 3.8Å; R657-E659 WeakPolarHBondContact CD-OE1 3.46Å; R657-E659 IonicContact CZ-OE1 3.71Å; R657-E659 IonicContact NE-OE1 2.66Å; R657-E659 IonicContact NH1-OE1 2.72Å; R657-E659 PolarHBondContact NH1-OE1 3.06Å; R657-E659 PolarHBondContact O-N 2.74Å
658	G	67.6	Low	78.8	Confident	50 Å²	50	75.1 Å²	75.1	52%	0.515	37%	0.372	S	S	.	.	T	Hydrogen-bonded Turn	trans	64.7	14.4	-172.2	0	0	0	0	0	115	R654 L655 K660	R654-G658 PolarHBondContact O-N 3.04Å; L655-G658 PolarHBondContact O-N 2.83Å; L655-G658 VanDerWaalsContact O-N 3.16Å; G658-K660 VanDerWaalsContact C-N 3.3Å; G658-K660 PolarHBondContact O-N 2.95Å
659	E	68	Low	78.5	Confident	75 Å²	75	79.1 Å²	79.1	35%	0.35	38%	0.384	S	S	.	.			trans	-69.4	76.5	-174	-79.3	177.2	-165.3	0	0	112.3	R654 R657 S661	R654-E659 HydrophobicContact CB-CB 4.05Å; R654-E659 HydrophobicContact CG-CB 4.37Å; R654-E659 WeakPolarHBondContact CG-OE2 3.37Å; R654-E659 PolarHBondContact O-N 2.86Å; R657-E659 HydrophobicContact CB-CB 4.42Å; R657-E659 HydrophobicContact CB-CG 3.8Å; R657-E659 WeakPolarHBondContact CD-OE1 3.46Å; R657-E659 IonicContact CZ-OE1 3.71Å; R657-E659 IonicContact NE-OE1 2.66Å; R657-E659 IonicContact NH1-OE1 2.72Å; R657-E659 PolarHBondContact NH1-OE1 3.06Å; R657-E659 PolarHBondContact O-N 2.74Å; E659-S661 PolarHBondContact O-N 3Å; E659-S661 PolarHBondContact O-OG 3.38Å
660	K	69.8	Low	78.1	Confident	132 Å²	132	83.3 Å²	83.3	57%	0.574	40%	0.401	S	S	*	.			trans	-78	69.6	175.1	-68.1	173	174.6	-179.9	0	111.2	G658 Y662 K670 F671	G658-K660 VanDerWaalsContact C-N 3.3Å; G658-K660 PolarHBondContact O-N 2.95Å; K660-Y662 VanDerWaalsContact C-N 3.34Å; K660-Y662 PolarHBondContact O-N 3.19Å; K660-K670 HydrophobicContact CB-CB 3.64Å; K660-K670 HydrophobicContact CD-CB 4.34Å; K660-K670 WeakPolarHBondContact CD-O 3.43Å; K660-F671 CarbonylContact C-O 3.28Å; K660-F671 WeakPolarHBondContact CA-O 3.32Å
661	S	74.7	Confident	77.8	Confident	71 Å²	71	80 Å²	80	50%	0.497	38%	0.381	S	S	.	.			trans	-75.1	-7.1	-172.8	37	0	0	0	0	116.2	E659 F671	E659-S661 PolarHBondContact O-N 3Å; E659-S661 PolarHBondContact O-OG 3.38Å; S661-F671 PolarHBondContact N-O 3.14Å
662	Y	75.3	Confident	77.5	Confident	72 Å²	72	78.7 Å²	78.7	28%	0.282	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	112.3	-178	-54.7	-83.4	0	0	0	110.7	R654 K660 K670 F671 K674	R654-Y662 PolarHBondContact NH1-OH 3.35Å; R654-Y662 VanDerWaalsContact NH1-OH 3.09Å; K660-Y662 VanDerWaalsContact C-N 3.34Å; K660-Y662 PolarHBondContact O-N 3.19Å; Y662-K670 CarbonylContact O-C 3.58Å; Y662-K670 WeakPolarHBondContact O-CA 3.39Å; Y662-F671 PolarHBondContact N-O 3.33Å; Y662-F671 PolarHBondContact O-N 2.89Å; Y662-K674 HydrophobicContact CD1-CB 3.93Å; Y662-K674 HydrophobicContact CD1-CG 4.28Å; Y662-K674 HydrophobicContact CE1-CB 3.79Å; Y662-K674 HydrophobicContact CE1-CG 4.31Å; Y662-K674 HydrophobicContact CG-CB 4.42Å
663	E	82.5	Confident	77.1	Confident	83 Å²	83	79.9 Å²	79.9	39%	0.388	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	139.7	-177.8	-173	170.4	130.7	0	0	112.5	Y665 K668 K670 L677	E663-Y665 PolarHBondContact O-N 3.31Å; E663-K668 VanDerWaalsContact OE1-CD 3.31Å; E663-K668 WeakPolarHBondContact OE1-CD 3.48Å; E663-K670 HydrophobicContact CB-CG 4.3Å; E663-K670 HydrophobicContact CG-CG 4.08Å; E663-K670 VanDerWaalsContact OE2-CE 3.32Å; E663-K670 WeakPolarHBondContact OE2-CE 3.31Å; E663-K670 IonicContact OE2-NZ 2.63Å; E663-K670 PolarHBondContact OE2-NZ 3.04Å; E663-L677 WeakPolarHBondContact O-CD2 3.44Å
664	C	83.7	Confident	77.2	Confident	0 Å²	0	83.6 Å²	83.6	0%	0	39%	0.394	C	S	.	.			trans	-75.6	117.8	170.7	-173.5	0	0	0	0	110.7	I666 C667 K668 K669 F671 L677	C664-I666 PolarHBondContact O-N 3.23Å; C664-C667 VanDerWaalsContact SG-SG 3.61Å; C664-K668 WeakPolarHBondContact O-CA 3.35Å; C664-K668 PolarHBondContact O-N 3.43Å; C664-K669 PolarHBondContact N-O 3.18Å; C664-F671 HydrophobicContact CB-CE2 4.27Å; C664-L677 VanDerWaalsContact CA-CD1 3.45Å; C664-L677 HydrophobicContact CB-CD1 3.68Å
665	Y	83.4	Confident	77.2	Confident	155 Å²	155	85.6 Å²	85.6	61%	0.608	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.6	-33.2	179.6	64.2	-85	0	0	0	112.6	E663 K668 V681	E663-Y665 PolarHBondContact O-N 3.31Å; Y665-K668 WeakPolarHBondContact O-CE 3.28Å; Y665-K668 PolarHBondContact O-NZ 3Å; Y665-V681 HydrophobicContact CD1-CG2 4.45Å; Y665-V681 HydrophobicContact CE1-CG1 3.91Å; Y665-V681 HydrophobicContact CE1-CG2 4.02Å
666	I	81.3	Confident	77.4	Confident	79 Å²	79	84.6 Å²	84.6	41%	0.405	41%	0.406	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.8	-58.1	-178.3	-52.1	175.1	0	0	0	111.5	C664 H684	C664-I666 PolarHBondContact O-N 3.23Å; I666-H684 HydrophobicContact CD1-CB 3.42Å; I666-H684 VanDerWaalsContact CD1-CB 3.42Å; I666-H684 HydrophobicContact CG2-CB 4.49Å
667	C	84.1	Confident	77.9	Confident	46 Å²	46	81.8 Å²	81.8	31%	0.311	39%	0.393	S	S	.	.	T	Hydrogen-bonded Turn	trans	-113.8	6.4	-169.5	73	0	0	0	0	115.1	C664 K669 H680	C664-C667 VanDerWaalsContact SG-SG 3.61Å; C667-K669 PolarHBondContact O-N 2.86Å; C667-H680 PolarHBondContact SG-NE2 3.26Å
668	K	80.8	Confident	78.5	Confident	127 Å²	127	77.2 Å²	77.2	55%	0.552	38%	0.38	S	S	*	.			trans	57.9	5.6	-179.9	-47.5	-56.8	178.6	-165.8	0	116.4	E663 C664 Y665 K670	E663-K668 VanDerWaalsContact OE1-CD 3.31Å; E663-K668 WeakPolarHBondContact OE1-CD 3.48Å; C664-K668 WeakPolarHBondContact O-CA 3.35Å; C664-K668 PolarHBondContact O-N 3.43Å; Y665-K668 WeakPolarHBondContact O-CE 3.28Å; Y665-K668 PolarHBondContact O-NZ 3Å; K668-K670 PolarHBondContact O-N 3.14Å
669	K	77	Confident	79.3	Confident	131 Å²	131	82.5 Å²	82.5	57%	0.57	38%	0.384	S	S	*	.			trans	-62.5	130	172.3	-69.7	-176.1	178.9	-179.6	0	109.9	C664 C667 F671	C664-K669 PolarHBondContact N-O 3.18Å; C667-K669 PolarHBondContact O-N 2.86Å; K669-F671 HydrophobicContact CB-CE2 3.87Å; K669-F671 HydrophobicContact CB-CZ 4.05Å; K669-F671 WeakPolarHBondContact O-CD2 3.24Å; K669-F671 VanDerWaalsContact O-CE2 3.25Å; K669-F671 WeakPolarHBondContact O-CE2 3.34Å
670	K	77.9	Confident	80	Confident	117 Å²	117	80.4 Å²	80.4	51%	0.509	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	137.7	-178	-49.5	-173.4	-165.9	-108.6	0	111.6	K660 Y662 E663 K668	K660-K670 HydrophobicContact CB-CB 3.64Å; K660-K670 HydrophobicContact CD-CB 4.34Å; K660-K670 WeakPolarHBondContact CD-O 3.43Å; Y662-K670 CarbonylContact O-C 3.58Å; Y662-K670 WeakPolarHBondContact O-CA 3.39Å; E663-K670 HydrophobicContact CB-CG 4.3Å; E663-K670 HydrophobicContact CG-CG 4.08Å; E663-K670 VanDerWaalsContact OE2-CE 3.32Å; E663-K670 WeakPolarHBondContact OE2-CE 3.31Å; E663-K670 IonicContact OE2-NZ 2.63Å; E663-K670 PolarHBondContact OE2-NZ 3.04Å; K668-K670 PolarHBondContact O-N 3.14Å
671	F	77.9	Confident	80.7	Confident	42 Å²	42	75.4 Å²	75.4	18%	0.184	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	150.1	-174.4	-60.2	-90.4	0	0	0	110.9	K660 S661 Y662 C664 K669 L676 L677 H680	K660-F671 CarbonylContact C-O 3.28Å; K660-F671 WeakPolarHBondContact CA-O 3.32Å; S661-F671 PolarHBondContact N-O 3.14Å; Y662-F671 PolarHBondContact N-O 3.33Å; Y662-F671 PolarHBondContact O-N 2.89Å; C664-F671 HydrophobicContact CB-CE2 4.27Å; K669-F671 HydrophobicContact CB-CE2 3.87Å; K669-F671 HydrophobicContact CB-CZ 4.05Å; K669-F671 WeakPolarHBondContact O-CD2 3.24Å; K669-F671 VanDerWaalsContact O-CE2 3.25Å; K669-F671 WeakPolarHBondContact O-CE2 3.34Å; F671-L676 HydrophobicContact CB-CB 4.42Å; F671-L676 HydrophobicContact CD1-CB 3.99Å; F671-L676 HydrophobicContact CG-CB 4.48Å; F671-L677 HydrophobicContact CB-CB 4.39Å; F671-L677 HydrophobicContact CD2-CB 4.07Å; F671-L677 HydrophobicContact CD2-CD1 4.06Å; F671-L677 HydrophobicContact CE2-CD1 4.24Å; F671-L677 HydrophobicContact CG-CB 4.37Å; F671-H680 HydrophobicContact CE1-CB 4.18Å; F671-H680 HydrophobicContact CE2-CB 4.14Å; F671-H680 AromaticContact CE2-CD2 3.49Å; F671-H680 VanDerWaalsContact CE2-CD2 3.49Å; F671-H680 WeakPolarHBondContact CE2-CD2 3.41Å; F671-H680 AromaticContact CE2-CG 3.92Å; F671-H680 HydrophobicContact CZ-CB 3.67Å; F671-H680 AromaticContact CZ-CD2 3.37Å; F671-H680 WeakPolarHBondContact CZ-CD2 3.21Å; F671-H680 AromaticContact CZ-CG 3.4Å; F671-H680 VanDerWaalsContact CZ-CG 3.4Å
672	S	74.9	Confident	81.2	Confident	17 Å²	17	74.6 Å²	74.6	12%	0.119	35%	0.353	C	S	.	.	S	Bend	trans	-86.7	-2.6	176.9	42.3	0	0	0	0	113.9	R654 L655	R654-S672 VanDerWaalsContact CZ-O 3.31Å; R654-S672 PolarHBondContact NE-O 2.97Å; R654-S672 PolarHBondContact NH2-O 3.09Å; L655-S672 WeakPolarHBondContact CD2-OG 3.39Å
673	H	75.9	Confident	81.4	Confident	46 Å²	46	74.5 Å²	74.5	21%	0.213	36%	0.357	C	S	.	.			trans	-140.5	136.5	-179.6	-64.2	-130.4	0	0	0	111.2	V651 T675 L676 L677	V651-H673 WeakPolarHBondContact CG1-CE1 3.42Å; V651-H673 WeakPolarHBondContact CG1-ND1 3.22Å; H673-T675 VanDerWaalsContact C-N 3.29Å; H673-T675 PolarHBondContact O-N 3.18Å; H673-L676 HydrophobicContact CB-CB 4.17Å; H673-L676 HydrophobicContact CB-CD1 3.97Å; H673-L676 HydrophobicContact CB-CG 3.89Å; H673-L676 PolarHBondContact O-N 3.33Å; H673-L677 PolarHBondContact O-N 2.84Å
674	K	80.3	Confident	81.1	Confident	120 Å²	120	72.3 Å²	72.3	52%	0.522	35%	0.346	S	S	.	.	H	α-helix	trans	-57	-41.2	172.5	-165.7	178.7	-171.9	-91.8	0	112	Y662 L676 L677 E678	Y662-K674 HydrophobicContact CD1-CB 3.93Å; Y662-K674 HydrophobicContact CD1-CG 4.28Å; Y662-K674 HydrophobicContact CE1-CB 3.79Å; Y662-K674 HydrophobicContact CE1-CG 4.31Å; Y662-K674 HydrophobicContact CG-CB 4.42Å; K674-L676 VanDerWaalsContact C-N 3.32Å; K674-L676 PolarHBondContact O-N 2.98Å; K674-L677 CarbonylContact O-C 3.59Å; K674-L677 WeakPolarHBondContact O-CA 3.48Å; K674-L677 WeakPolarHBondContact O-CB 3.38Å; K674-L677 PolarHBondContact O-N 2.82Å; K674-L677 VanDerWaalsContact O-N 3.14Å; K674-E678 HydrophobicContact CG-CG 4.28Å; K674-E678 IonicContact NZ-OE1 2.69Å; K674-E678 PolarHBondContact NZ-OE1 3.08Å; K674-E678 VanDerWaalsContact O-CG 3.3Å; K674-E678 WeakPolarHBondContact O-CG 3.37Å; K674-E678 PolarHBondContact O-N 3.4Å
675	T	81.6	Confident	80.3	Confident	84 Å²	84	76.5 Å²	76.5	52%	0.515	38%	0.376	S	S	.	.	H	α-helix	trans	-68.7	-25.5	-179.7	52.5	0	0	0	0	114.6	H673 E678 R679	H673-T675 VanDerWaalsContact C-N 3.29Å; H673-T675 PolarHBondContact O-N 3.18Å; T675-E678 VanDerWaalsContact CA-OE2 3.27Å; T675-E678 WeakPolarHBondContact CA-OE2 3.49Å; T675-E678 PolarHBondContact N-OE2 3.09Å; T675-R679 WeakPolarHBondContact O-CB 3.39Å; T675-R679 PolarHBondContact O-N 3.2Å
676	L	80.9	Confident	79.1	Confident	64 Å²	64	72.7 Å²	72.7	34%	0.335	38%	0.377	S	S	.	.	H	α-helix	trans	-76.3	-39.3	171	-66.2	176.6	0	0	0	110.7	F671 H673 K674 H680	F671-L676 HydrophobicContact CB-CB 4.42Å; F671-L676 HydrophobicContact CD1-CB 3.99Å; F671-L676 HydrophobicContact CG-CB 4.48Å; H673-L676 HydrophobicContact CB-CB 4.17Å; H673-L676 HydrophobicContact CB-CD1 3.97Å; H673-L676 HydrophobicContact CB-CG 3.89Å; H673-L676 PolarHBondContact O-N 3.33Å; K674-L676 VanDerWaalsContact C-N 3.32Å; K674-L676 PolarHBondContact O-N 2.98Å; L676-H680 VanDerWaalsContact O-CB 3.26Å; L676-H680 WeakPolarHBondContact O-CB 3.31Å; L676-H680 PolarHBondContact O-N 3.31Å
677	L	85.8	Confident	77.8	Confident	25 Å²	25	72.7 Å²	72.7	13%	0.131	38%	0.384	C	S	.	.	H	α-helix	trans	-62.1	-47.4	171.1	170.2	61.8	0	0	0	111.6	E663 C664 F671 H673 K674 R679 H680 V681	E663-L677 WeakPolarHBondContact O-CD2 3.44Å; C664-L677 VanDerWaalsContact CA-CD1 3.45Å; C664-L677 HydrophobicContact CB-CD1 3.68Å; F671-L677 HydrophobicContact CB-CB 4.39Å; F671-L677 HydrophobicContact CD2-CB 4.07Å; F671-L677 HydrophobicContact CD2-CD1 4.06Å; F671-L677 HydrophobicContact CE2-CD1 4.24Å; F671-L677 HydrophobicContact CG-CB 4.37Å; H673-L677 PolarHBondContact O-N 2.84Å; K674-L677 CarbonylContact O-C 3.59Å; K674-L677 WeakPolarHBondContact O-CA 3.48Å; K674-L677 WeakPolarHBondContact O-CB 3.38Å; K674-L677 PolarHBondContact O-N 2.82Å; K674-L677 VanDerWaalsContact O-N 3.14Å; L677-R679 PolarHBondContact O-N 3.32Å; L677-H680 CarbonylContact O-C 3.58Å; L677-H680 PolarHBondContact O-N 3.2Å; L677-H680 VanDerWaalsContact O-N 3.07Å; L677-V681 HydrophobicContact CD1-CG2 3.7Å; L677-V681 HydrophobicContact CG-CG2 4.27Å; L677-V681 WeakPolarHBondContact O-CG2 3.33Å; L677-V681 PolarHBondContact O-N 3.22Å
678	E	85.1	Confident	76	Confident	86 Å²	86	77.2 Å²	77.2	40%	0.402	41%	0.405	S	S	.	.	H	α-helix	trans	-59.7	-46.7	179.8	-73.1	163.1	152.3	0	0	111.6	K674 T675 H680 V681 A682	K674-E678 HydrophobicContact CG-CG 4.28Å; K674-E678 IonicContact NZ-OE1 2.69Å; K674-E678 PolarHBondContact NZ-OE1 3.08Å; K674-E678 VanDerWaalsContact O-CG 3.3Å; K674-E678 WeakPolarHBondContact O-CG 3.37Å; K674-E678 PolarHBondContact O-N 3.4Å; T675-E678 VanDerWaalsContact CA-OE2 3.27Å; T675-E678 WeakPolarHBondContact CA-OE2 3.49Å; T675-E678 PolarHBondContact N-OE2 3.09Å; E678-H680 VanDerWaalsContact C-N 3.3Å; E678-H680 PolarHBondContact O-N 2.89Å; E678-V681 PolarHBondContact O-N 3.04Å; E678-A682 PolarHBondContact O-N 3.15Å; E678-A682 VanDerWaalsContact O-N 3.07Å
679	R	83.8	Confident	74.2	Confident	161 Å²	161	74 Å²	74	61%	0.608	41%	0.407	S	S	*	.	H	α-helix	trans	-58.8	-42.8	172.3	-174	-171	-61.1	158.2	-1	111.5	T675 L677 A682 L683	T675-R679 WeakPolarHBondContact O-CB 3.39Å; T675-R679 PolarHBondContact O-N 3.2Å; L677-R679 PolarHBondContact O-N 3.32Å; R679-A682 PolarHBondContact O-N 2.77Å; R679-L683 PolarHBondContact O-N 2.57Å
680	H	84.4	Confident	72.3	Confident	30 Å²	30	73.9 Å²	73.9	14%	0.139	42%	0.418	C	S	.	.	H	α-helix	trans	-69.2	-38.4	-179.2	179.5	59.9	0	0	0	113	C667 F671 L676 L677 E678 A682 L683 H684	C667-H680 PolarHBondContact SG-NE2 3.26Å; F671-H680 HydrophobicContact CE1-CB 4.18Å; F671-H680 HydrophobicContact CE2-CB 4.14Å; F671-H680 AromaticContact CE2-CD2 3.49Å; F671-H680 VanDerWaalsContact CE2-CD2 3.49Å; F671-H680 WeakPolarHBondContact CE2-CD2 3.41Å; F671-H680 AromaticContact CE2-CG 3.92Å; F671-H680 HydrophobicContact CZ-CB 3.67Å; F671-H680 AromaticContact CZ-CD2 3.37Å; F671-H680 WeakPolarHBondContact CZ-CD2 3.21Å; F671-H680 AromaticContact CZ-CG 3.4Å; F671-H680 VanDerWaalsContact CZ-CG 3.4Å; L676-H680 VanDerWaalsContact O-CB 3.26Å; L676-H680 WeakPolarHBondContact O-CB 3.31Å; L676-H680 PolarHBondContact O-N 3.31Å; L677-H680 CarbonylContact O-C 3.58Å; L677-H680 PolarHBondContact O-N 3.2Å; L677-H680 VanDerWaalsContact O-N 3.07Å; E678-H680 VanDerWaalsContact C-N 3.3Å; E678-H680 PolarHBondContact O-N 2.89Å; H680-A682 VanDerWaalsContact C-N 3.32Å; H680-L683 WeakPolarHBondContact O-CB 3.43Å; H680-L683 PolarHBondContact O-N 3.49Å; H680-H684 AromaticContact CD2-NE2 3.7Å; H680-H684 AromaticContact CE1-NE2 3.32Å; H680-H684 PolarHBondContact CE1-NE2 2.98Å; H680-H684 VanDerWaalsContact CE1-NE2 3.32Å; H680-H684 AromaticContact NE2-CD2 3.89Å; H680-H684 AromaticContact NE2-CE1 3.95Å; H680-H684 AromaticContact NE2-NE2 2.98Å; H680-H684 PolarHBondContact NE2-NE2 3.19Å; H680-H684 PolarHBondContact O-CD2 3.04Å
681	V	84.4	Confident	70.3	Confident	27 Å²	27	74 Å²	74	16%	0.164	43%	0.43	C	S	.	.	H	α-helix	trans	-61.9	-41.4	173.5	169.5	0	0	0	0	110.5	Y665 L677 E678 L683 H684 S685	Y665-V681 HydrophobicContact CD1-CG2 4.45Å; Y665-V681 HydrophobicContact CE1-CG1 3.91Å; Y665-V681 HydrophobicContact CE1-CG2 4.02Å; L677-V681 HydrophobicContact CD1-CG2 3.7Å; L677-V681 HydrophobicContact CG-CG2 4.27Å; L677-V681 WeakPolarHBondContact O-CG2 3.33Å; L677-V681 PolarHBondContact O-N 3.22Å; E678-V681 PolarHBondContact O-N 3.04Å; V681-L683 PolarHBondContact O-N 3.42Å; V681-H684 PolarHBondContact O-N 3.13Å; V681-S685 PolarHBondContact O-N 3.11Å; V681-S685 PolarHBondContact O-OG 3.44Å
682	A	83.6	Confident	68.3	Low	55 Å²	55	78.1 Å²	78.1	46%	0.455	46%	0.461	S	S	.	.	H	α-helix	trans	-61.4	-24	175.8	0	0	0	0	0	114	E678 R679 H680 S685 A686	E678-A682 PolarHBondContact O-N 3.15Å; E678-A682 VanDerWaalsContact O-N 3.07Å; R679-A682 PolarHBondContact O-N 2.77Å; H680-A682 VanDerWaalsContact C-N 3.32Å; A682-S685 PolarHBondContact O-N 3.34Å; A682-A686 PolarHBondContact O-N 3.32Å
683	L	79.5	Confident	66.6	Low	70 Å²	70	82.6 Å²	82.6	37%	0.366	50%	0.499	S	S	.	.	H	α-helix	trans	-69.2	-40.8	172.7	-59	174.4	0	0	0	111.6	R679 H680 V681 S685 A686 S687 T713	R679-L683 PolarHBondContact O-N 2.57Å; H680-L683 WeakPolarHBondContact O-CB 3.43Å; H680-L683 PolarHBondContact O-N 3.49Å; V681-L683 PolarHBondContact O-N 3.42Å; L683-S685 VanDerWaalsContact C-N 3.27Å; L683-S685 PolarHBondContact O-N 2.87Å; L683-A686 WeakPolarHBondContact O-CB 3.5Å; L683-A686 PolarHBondContact O-N 2.88Å; L683-A686 VanDerWaalsContact O-N 3.07Å; L683-S687 PolarHBondContact O-N 2.67Å; L683-T713 HydrophobicContact CD2-CG2 3.74Å
684	H	75.9	Confident	65.1	Low	36 Å²	36	83.7 Å²	83.7	17%	0.167	52%	0.523	C	S	.	.	H	α-helix	trans	-65.9	-31.7	174.3	-61.3	-83.2	0	0	0	112	I666 H680 V681 A686 S687	I666-H684 HydrophobicContact CD1-CB 3.42Å; I666-H684 VanDerWaalsContact CD1-CB 3.42Å; I666-H684 HydrophobicContact CG2-CB 4.49Å; H680-H684 AromaticContact CD2-NE2 3.7Å; H680-H684 AromaticContact CE1-NE2 3.32Å; H680-H684 PolarHBondContact CE1-NE2 2.98Å; H680-H684 VanDerWaalsContact CE1-NE2 3.32Å; H680-H684 AromaticContact NE2-CD2 3.89Å; H680-H684 AromaticContact NE2-CE1 3.95Å; H680-H684 AromaticContact NE2-NE2 2.98Å; H680-H684 PolarHBondContact NE2-NE2 3.19Å; H680-H684 PolarHBondContact O-CD2 3.04Å; V681-H684 PolarHBondContact O-N 3.13Å; H684-A686 PolarHBondContact O-N 2.79Å; H684-S687 WeakPolarHBondContact CA-OG 3.48Å; H684-S687 PolarHBondContact O-N 2.91Å; H684-S687 PolarHBondContact O-OG 3.49Å
685	S	67.9	Low	62.8	Low	88 Å²	88	84.6 Å²	84.6	62%	0.615	54%	0.539	S	S	*	.	H	α-helix	trans	-67.3	-23.8	172.5	-54.4	0	0	0	0	113.1	V681 A682 L683	V681-S685 PolarHBondContact O-N 3.11Å; V681-S685 PolarHBondContact O-OG 3.44Å; A682-S685 PolarHBondContact O-N 3.34Å; L683-S685 VanDerWaalsContact C-N 3.27Å; L683-S685 PolarHBondContact O-N 2.87Å
686	A	58.8	Low	60.7	Low	76 Å²	76	86 Å²	86	63%	0.628	55%	0.55	S	S	*	.	H	α-helix	trans	-86.5	-21.5	176.9	0	0	0	0	0	113.5	A682 L683 H684	A682-A686 PolarHBondContact O-N 3.32Å; L683-A686 WeakPolarHBondContact O-CB 3.5Å; L683-A686 PolarHBondContact O-N 2.88Å; L683-A686 VanDerWaalsContact O-N 3.07Å; H684-A686 PolarHBondContact O-N 2.79Å
687	S	52.7	Low	58.8	Low	79 Å²	79	89.4 Å²	89.4	55%	0.552	58%	0.575	S	S	*	*	H	α-helix	trans	-88.6	-10.9	-179.2	57.3	0	0	0	0	114.9	L683 H684 G689	L683-S687 PolarHBondContact O-N 2.67Å; H684-S687 WeakPolarHBondContact CA-OG 3.48Å; H684-S687 PolarHBondContact O-N 2.91Å; H684-S687 PolarHBondContact O-OG 3.49Å; S687-G689 PolarHBondContact O-N 2.91Å
688	N	47.4	Very low	56.6	Low	141 Å²	141	92.1 Å²	92.1	75%	0.754	61%	0.609	S	S	*	*			trans	-79.4	46.8	-177.3	-77.3	-3.7	0	0	0	113.6
689	G	43.5	Very low	54	Low	58 Å²	58	93.1 Å²	93.1	60%	0.598	63%	0.632	S	S	*	*	S	Bend	trans	-98.2	86.6	177.2	0	0	0	0	0	113	S687	S687-G689 PolarHBondContact O-N 2.91Å
690	T	35.3	Very low	51.6	Low	130 Å²	130	97.1 Å²	97.1	80%	0.798	65%	0.647	S	S	*	*			trans	58	128.2	172.7	43.4	0	0	0	0	118.2
691	P	37.2	Very low	49.5	Very low	118 Å²	118	100.9 Å²	100.9	77%	0.766	68%	0.684	S	S	*	*			trans	-73.8	136.8	169.1	31.3	-33.2	0	0	0	110.9	A693	P691-A693 PolarHBondContact O-N 2.92Å
692	P	36.4	Very low	46.8	Very low	130 Å²	130	102.9 Å²	102.9	84%	0.844	71%	0.71	S	S	*	*			trans	-72.2	108.5	172.8	28.8	-32.9	0	0	0	110.2	G694	P692-G694 PolarHBondContact O-N 2.9Å
693	A	38.1	Very low	44.5	Very low	110 Å²	110	106 Å²	106	91%	0.909	73%	0.725	S	S	*	*			trans	-79.5	108.1	175.8	0	0	0	0	0	111	P691	P691-A693 PolarHBondContact O-N 2.92Å
694	G	43.6	Very low	42.6	Very low	70 Å²	70	109 Å²	109	72%	0.722	75%	0.749	S	S	*	*			trans	140.5	82.3	162.3	0	0	0	0	0	117.2	P692	P692-G694 PolarHBondContact O-N 2.9Å
695	T	33.6	Very low	40.3	Very low	138 Å²	138	110.1 Å²	110.1	85%	0.847	77%	0.771	S	S	*	*			trans	-150.5	133.4	156.6	-14.7	0	0	0	0	109.5
696	P	36.8	Very low	38.7	Very low	115 Å²	115	112.8 Å²	112.8	75%	0.747	78%	0.783	S	S	*	*			trans	-79.9	157.9	-174.2	31.5	-36	0	0	0	113.5
697	P	41.1	Very low	37.4	Very low	134 Å²	134	115.3 Å²	115.3	87%	0.87	79%	0.79	S	S	*	*			trans	-79	129.4	-178.3	31.5	-34.2	0	0	0	112.3
698	G	38.9	Very low	36.5	Very low	82 Å²	82	114.8 Å²	114.8	85%	0.845	79%	0.791	S	S	*	*			trans	-175.6	33.8	-174.8	0	0	0	0	0	120.4
699	A	30.1	Very low	35.6	Very low	107 Å²	107	113.9 Å²	113.9	88%	0.884	79%	0.794	S	S	*	*			trans	-159.9	157	162.9	0	0	0	0	0	111.8
700	R	34.7	Very low	35.6	Very low	245 Å²	245	117.1 Å²	117.1	93%	0.925	80%	0.802	S	S	*	*			trans	-128.7	135	-177.8	-129	-175.3	178.1	-153.7	-0.7	112
701	A	39.1	Very low	36.1	Very low	109 Å²	109	120 Å²	120	90%	0.901	81%	0.806	S	S	*	*			trans	64.6	119.9	155.1	0	0	0	0	0	120.5
702	G	27.8	Very low	36.7	Very low	69 Å²	69	116.3 Å²	116.3	71%	0.711	79%	0.79	S	S	*	*			trans	-151.5	153.3	155.6	0	0	0	0	0	108.9
703	P	36	Very low	37.7	Very low	121 Å²	121	113 Å²	113	79%	0.786	77%	0.767	S	S	*	*			trans	-71.5	162	-174.2	29.1	-35	0	0	0	113.3	G705	P703-G705 PolarHBondContact O-N 2.96Å
704	P	40.5	Very low	39.2	Very low	134 Å²	134	111.2 Å²	111.2	87%	0.87	75%	0.745	S	S	*	*			trans	-75.6	86.8	-167.9	30.7	-36.6	0	0	0	113.4
705	G	27.7	Very low	40.7	Very low	59 Å²	59	111.2 Å²	111.2	61%	0.608	72%	0.724	S	S	*	*			trans	-62	142.8	158.5	0	0	0	0	0	110.8	P703 V707	P703-G705 PolarHBondContact O-N 2.96Å; G705-V707 PolarHBondContact O-N 2.74Å
706	V	34.1	Very low	42.7	Very low	144 Å²	144	108.3 Å²	108.3	87%	0.873	71%	0.706	S	S	*	*			trans	-63.9	103.8	-176.3	-179.8	0	0	0	0	110.2	A708	V706-A708 PolarHBondContact O-N 3.26Å
707	V	30.1	Very low	44.6	Very low	128 Å²	128	103.3 Å²	103.3	78%	0.776	67%	0.674	S	S	*	*			trans	-72.3	92.8	176	-159.7	0	0	0	0	108.7	G705 C709	G705-V707 PolarHBondContact O-N 2.74Å; V707-C709 PolarHBondContact O-N 2.89Å; V707-C709 VanDerWaalsContact O-N 3.09Å
708	A	33.5	Very low	46.2	Very low	69 Å²	69	102.1 Å²	102.1	57%	0.57	67%	0.669	S	S	*	*			trans	-69.6	102.6	172.4	0	0	0	0	0	108.8	V706 T710	V706-A708 PolarHBondContact O-N 3.26Å; A708-T710 HydrophobicContact CB-CG2 4.13Å; A708-T710 PolarHBondContact O-N 3.34Å
709	C	30	Very low	47.9	Very low	122 Å²	122	102.6 Å²	102.6	82%	0.824	66%	0.655	S	S	*	*			trans	-67.5	79	172.3	-57.1	0	0	0	0	110.3	V707 E711	V707-C709 PolarHBondContact O-N 2.89Å; V707-C709 VanDerWaalsContact O-N 3.09Å; C709-E711 PolarHBondContact O-N 3.47Å
710	T	43.1	Very low	50.3	Low	126 Å²	126	99.5 Å²	99.5	77%	0.773	63%	0.626	S	S	*	*			trans	-86.8	56.6	178	53.4	0	0	0	0	111.4	A708	A708-T710 HydrophobicContact CB-CG2 4.13Å; A708-T710 PolarHBondContact O-N 3.34Å
711	E	46.6	Very low	52.1	Low	189 Å²	189	93.8 Å²	93.8	88%	0.883	62%	0.621	S	S	*	*			trans	-118	82.7	172.1	-68.5	-175.9	179.1	0	0	107.8	C709	C709-E711 PolarHBondContact O-N 3.47Å
712	G	48.1	Very low	53.9	Low	41 Å²	41	89.9 Å²	89.9	42%	0.423	59%	0.589	S	S	.	*			trans	-84	149.7	-177.7	0	0	0	0	0	112.5	T714	G712-T714 PolarHBondContact O-N 2.95Å; G712-T714 VanDerWaalsContact O-N 3.07Å
713	T	57.9	Low	56.3	Low	60 Å²	60	93.2 Å²	93.2	37%	0.368	58%	0.584	S	S	.	*			trans	-70.6	101.2	166.2	48.8	0	0	0	0	109.2	L683 Y715	L683-T713 HydrophobicContact CD2-CG2 3.74Å; T713-Y715 VanDerWaalsContact O-CD2 3.31Å; T713-Y715 WeakPolarHBondContact O-CD2 3.45Å; T713-Y715 WeakPolarHBondContact O-CE2 3.32Å; T713-Y715 PolarHBondContact O-N 3.43Å
714	T	70.8	Confident	58.4	Low	73 Å²	73	89.2 Å²	89.2	45%	0.448	55%	0.554	S	S	.	*			trans	-62.2	108.1	177.4	53.2	0	0	0	0	111.4	G712 V716 D725	G712-T714 PolarHBondContact O-N 2.95Å; G712-T714 VanDerWaalsContact O-N 3.07Å; T714-V716 PolarHBondContact O-N 3.43Å; T714-D725 WeakPolarHBondContact CG2-OD1 3.37Å
715	Y	73.8	Confident	60	Low	70 Å²	70	87.7 Å²	87.7	28%	0.275	54%	0.538	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	115.6	169.1	-61.4	-81.9	0	0	0	108.6	T713 K723 F724 I727 F730	T713-Y715 VanDerWaalsContact O-CD2 3.31Å; T713-Y715 WeakPolarHBondContact O-CD2 3.45Å; T713-Y715 WeakPolarHBondContact O-CE2 3.32Å; T713-Y715 PolarHBondContact O-N 3.43Å; Y715-K723 CarbonylContact O-C 3.55Å; Y715-K723 WeakPolarHBondContact O-CA 3.43Å; Y715-F724 WeakPolarHBondContact CD2-O 3.12Å; Y715-F724 PolarHBondContact N-O 3.39Å; Y715-F724 PolarHBondContact O-N 3.4Å; Y715-I727 HydrophobicContact CD1-CG1 4.33Å; Y715-I727 HydrophobicContact CD2-CB 4.23Å; Y715-I727 HydrophobicContact CE1-CB 4.18Å; Y715-I727 HydrophobicContact CE1-CD1 3.93Å; Y715-I727 HydrophobicContact CE1-CG1 3.94Å; Y715-I727 HydrophobicContact CE2-CB 3.7Å; Y715-I727 HydrophobicContact CE2-CG1 4.35Å; Y715-F730 HydrophobicContact CG-CB 4.28Å; Y715-F730 HydrophobicContact CG-CG 4.35Å
716	V	76.1	Confident	62	Low	78 Å²	78	89.8 Å²	89.8	47%	0.473	53%	0.532	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	130.5	-178.2	-169.9	0	0	0	0	109.5	T714 K723 F730	T714-V716 PolarHBondContact O-N 3.43Å; V716-K723 HydrophobicContact CG1-CG 4.28Å; V716-K723 HydrophobicContact CG2-CD 4.3Å; V716-K723 HydrophobicContact CG2-CG 4.12Å; V716-F730 WeakPolarHBondContact O-CE2 3.31Å
717	C	76.8	Confident	64	Low	9 Å²	9	86.4 Å²	86.4	6%	0.061	51%	0.509	C	S	.	.			trans	-68.4	141.8	173.6	-176.6	0	0	0	0	111.1	V719 C720 A722 H733 M734 H737	C717-V719 PolarHBondContact SG-N 2.77Å; C717-C720 WeakPolarHBondContact CB-O 3.4Å; C717-C720 VanDerWaalsContact O-O 3.13Å; C717-A722 HydrophobicContact CB-CB 4.49Å; C717-A722 PolarHBondContact N-O 3.19Å; C717-H733 WeakPolarHBondContact CB-NE2 3.49Å; C717-H733 PolarHBondContact SG-NE2 3.23Å; C717-M734 VanDerWaalsContact SG-SD 3.63Å; C717-H737 PolarHBondContact SG-NE2 3.43Å
718	S	74.5	Confident	66.2	Low	109 Å²	109	87.1 Å²	87.1	76%	0.762	50%	0.503	S	S	*	.	S	Bend	trans	-85.7	-10.9	175.9	56	0	0	0	0	113.8
719	V	75.4	Confident	68.1	Low	92 Å²	92	88.2 Å²	88.2	56%	0.558	50%	0.497	S	S	*	.	S	Bend	trans	-103.7	-32.2	-175.3	-170.5	0	0	0	0	111.6	C717 M734 H737	C717-V719 PolarHBondContact SG-N 2.77Å; V719-M734 HydrophobicContact CG2-CE 4.46Å; V719-H737 WeakPolarHBondContact CG1-ND1 3.39Å; V719-H737 HydrophobicContact CG2-CB 4.33Å
720	C	79.2	Confident	70.6	Confident	42 Å²	42	84.4 Å²	84.4	28%	0.284	47%	0.466	S	S	.	.	S	Bend	trans	-143.3	164.9	176	80.9	0	0	0	0	110.9	C717 A722 H733	C717-C720 WeakPolarHBondContact CB-O 3.4Å; C717-C720 VanDerWaalsContact O-O 3.13Å; C720-A722 PolarHBondContact O-N 2.98Å; C720-H733 VanDerWaalsContact SG-CE1 3.56Å; C720-H733 PolarHBondContact SG-NE2 3.42Å; C720-H733 VanDerWaalsContact SG-NE2 3.38Å
721	P	73.3	Confident	72.3	Confident	125 Å²	125	82.1 Å²	82.1	81%	0.812	45%	0.45	S	S	*	.	S	Bend	trans	-74.4	16	-171.4	30.9	-36.6	0	0	0	115.2
722	A	77.8	Confident	73.9	Confident	27 Å²	27	77.4 Å²	77.4	22%	0.223	43%	0.43	C	S	.	.			trans	-71	144.2	-178.5	0	0	0	0	0	112.6	C717 C720 F724	C717-A722 HydrophobicContact CB-CB 4.49Å; C717-A722 PolarHBondContact N-O 3.19Å; C720-A722 PolarHBondContact O-N 2.98Å; A722-F724 HydrophobicContact CB-CE2 3.58Å; A722-F724 HydrophobicContact CB-CZ 3.67Å
723	K	77.7	Confident	75.5	Confident	140 Å²	140	77.2 Å²	77.2	61%	0.609	42%	0.418	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-129.5	141.8	179.1	-56.6	-170.8	-178.2	179.5	0	110	Y715 V716	Y715-K723 CarbonylContact O-C 3.55Å; Y715-K723 WeakPolarHBondContact O-CA 3.43Å; V716-K723 HydrophobicContact CG1-CG 4.28Å; V716-K723 HydrophobicContact CG2-CD 4.3Å; V716-K723 HydrophobicContact CG2-CG 4.12Å
724	F	80.4	Confident	76.5	Confident	36 Å²	36	76.6 Å²	76.6	16%	0.158	41%	0.412	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	131.7	-175.2	-54.3	-89.6	0	0	0	110.7	Y715 A722 Q726 Q729 F730 H733	Y715-F724 WeakPolarHBondContact CD2-O 3.12Å; Y715-F724 PolarHBondContact N-O 3.39Å; Y715-F724 PolarHBondContact O-N 3.4Å; A722-F724 HydrophobicContact CB-CE2 3.58Å; A722-F724 HydrophobicContact CB-CZ 3.67Å; F724-Q726 PolarHBondContact O-N 3.21Å; F724-Q729 HydrophobicContact CB-CB 4.36Å; F724-Q729 HydrophobicContact CD1-CB 3.89Å; F724-Q729 HydrophobicContact CG-CB 4.42Å; F724-F730 HydrophobicContact CB-CB 4.21Å; F724-F730 HydrophobicContact CD2-CB 4.27Å; F724-F730 HydrophobicContact CD2-CD2 4.14Å; F724-F730 HydrophobicContact CG-CB 4.39Å; F724-H733 HydrophobicContact CE1-CB 4.11Å; F724-H733 HydrophobicContact CE2-CB 3.94Å; F724-H733 AromaticContact CE2-CD2 3.3Å; F724-H733 WeakPolarHBondContact CE2-CD2 3.29Å; F724-H733 AromaticContact CE2-CG 3.58Å; F724-H733 AromaticContact CE2-NE2 3.8Å; F724-H733 HydrophobicContact CZ-CB 3.58Å; F724-H733 AromaticContact CZ-CD2 3.49Å; F724-H733 VanDerWaalsContact CZ-CD2 3.49Å; F724-H733 WeakPolarHBondContact CZ-CD2 3.44Å; F724-H733 AromaticContact CZ-CE1 3.93Å; F724-H733 AromaticContact CZ-CG 3.28Å; F724-H733 AromaticContact CZ-ND1 3.6Å; F724-H733 AromaticContact CZ-NE2 3.88Å
725	D	73.3	Confident	76.9	Confident	102 Å²	102	80.9 Å²	80.9	55%	0.545	42%	0.42	S	S	.	.	S	Bend	trans	-79.3	-7.6	177.2	-56.1	-60.6	0	0	0	113.2	T714	T714-D725 WeakPolarHBondContact CG2-OD1 3.37Å
726	Q	69.8	Low	76.8	Confident	103 Å²	103	83.1 Å²	83.1	48%	0.481	43%	0.434	S	S	.	.	S	Bend	trans	-126.1	129.1	-176.8	-63	-177	2.9	0	0	111.1	F724 E728 Q729 F730	F724-Q726 PolarHBondContact O-N 3.21Å; Q726-E728 PolarHBondContact O-N 2.78Å; Q726-Q729 HydrophobicContact CB-CB 4.44Å; Q726-Q729 HydrophobicContact CB-CG 4.03Å; Q726-Q729 VanDerWaalsContact CD-NE2 3.28Å; Q726-Q729 PolarHBondContact O-N 2.88Å; Q726-F730 PolarHBondContact O-N 3.03Å; Q726-F730 VanDerWaalsContact O-N 3.08Å
727	I	75.4	Confident	76.8	Confident	74 Å²	74	81.6 Å²	81.6	38%	0.379	42%	0.422	S	S	.	.	H	α-helix	trans	-64.4	-23.7	-179.5	-159.8	170.8	0	0	0	112.8	Y715 N731	Y715-I727 HydrophobicContact CD1-CG1 4.33Å; Y715-I727 HydrophobicContact CD2-CB 4.23Å; Y715-I727 HydrophobicContact CE1-CB 4.18Å; Y715-I727 HydrophobicContact CE1-CD1 3.93Å; Y715-I727 HydrophobicContact CE1-CG1 3.94Å; Y715-I727 HydrophobicContact CE2-CB 3.7Å; Y715-I727 HydrophobicContact CE2-CG1 4.35Å; I727-N731 WeakPolarHBondContact O-CB 3.46Å; I727-N731 PolarHBondContact O-N 3.14Å; I727-N731 PolarHBondContact O-ND2 3.26Å
728	E	76	Confident	76.3	Confident	142 Å²	142	86.4 Å²	86.4	66%	0.664	45%	0.451	S	S	*	.	H	α-helix	trans	-71	-50.4	178.1	-65.9	176.1	176.6	0	0	110	Q726 F730 N731 D732	Q726-E728 PolarHBondContact O-N 2.78Å; E728-F730 VanDerWaalsContact C-N 3.31Å; E728-F730 PolarHBondContact O-N 2.92Å; E728-N731 PolarHBondContact O-N 3.01Å; E728-N731 VanDerWaalsContact O-N 3.1Å; E728-D732 PolarHBondContact O-N 3.42Å
729	Q	75.1	Confident	75.5	Confident	92 Å²	92	85.4 Å²	85.4	43%	0.43	44%	0.444	S	S	.	.	H	α-helix	trans	-58	-41.5	172.7	-58.2	176.7	17.4	0	0	112.2	F724 Q726 D732 H733	F724-Q729 HydrophobicContact CB-CB 4.36Å; F724-Q729 HydrophobicContact CD1-CB 3.89Å; F724-Q729 HydrophobicContact CG-CB 4.42Å; Q726-Q729 HydrophobicContact CB-CB 4.44Å; Q726-Q729 HydrophobicContact CB-CG 4.03Å; Q726-Q729 VanDerWaalsContact CD-NE2 3.28Å; Q726-Q729 PolarHBondContact O-N 2.88Å; Q729-D732 PolarHBondContact O-N 2.92Å; Q729-H733 VanDerWaalsContact O-CB 3.28Å; Q729-H733 WeakPolarHBondContact O-CB 3.4Å; Q729-H733 PolarHBondContact O-N 3.45Å
730	F	81.8	Confident	74.3	Confident	43 Å²	43	87.6 Å²	87.6	19%	0.189	45%	0.452	C	S	.	.	H	α-helix	trans	-61.2	-44.4	174	173.1	-94.6	0	0	0	112.5	Y715 V716 F724 Q726 E728 H733 M734	Y715-F730 HydrophobicContact CG-CB 4.28Å; Y715-F730 HydrophobicContact CG-CG 4.35Å; V716-F730 WeakPolarHBondContact O-CE2 3.31Å; F724-F730 HydrophobicContact CB-CB 4.21Å; F724-F730 HydrophobicContact CD2-CB 4.27Å; F724-F730 HydrophobicContact CD2-CD2 4.14Å; F724-F730 HydrophobicContact CG-CB 4.39Å; Q726-F730 PolarHBondContact O-N 3.03Å; Q726-F730 VanDerWaalsContact O-N 3.08Å; E728-F730 VanDerWaalsContact C-N 3.31Å; E728-F730 PolarHBondContact O-N 2.92Å; F730-H733 PolarHBondContact O-N 2.98Å; F730-M734 HydrophobicContact CD1-CG 4.25Å; F730-M734 HydrophobicContact CD2-CG 4.47Å; F730-M734 HydrophobicContact CE1-CG 3.79Å; F730-M734 HydrophobicContact CE2-CG 4.05Å; F730-M734 HydrophobicContact CE2-SD 4.33Å; F730-M734 HydrophobicContact CZ-CG 3.68Å; F730-M734 HydrophobicContact CZ-SD 4.15Å; F730-M734 WeakPolarHBondContact O-CB 3.38Å; F730-M734 VanDerWaalsContact O-CG 3.31Å; F730-M734 WeakPolarHBondContact O-CG 3.36Å; F730-M734 PolarHBondContact O-N 3.34Å
731	N	79.8	Confident	72.4	Confident	78 Å²	78	91.8 Å²	91.8	42%	0.417	50%	0.502	S	S	.	.	H	α-helix	trans	-65	-40.7	178.8	-80.8	-59.4	0	0	0	111.6	I727 E728 M734 R735	I727-N731 WeakPolarHBondContact O-CB 3.46Å; I727-N731 PolarHBondContact O-N 3.14Å; I727-N731 PolarHBondContact O-ND2 3.26Å; E728-N731 PolarHBondContact O-N 3.01Å; E728-N731 VanDerWaalsContact O-N 3.1Å; N731-M734 PolarHBondContact O-N 3.12Å; N731-R735 WeakPolarHBondContact O-CG 3.41Å; N731-R735 PolarHBondContact O-N 3.32Å
732	D	80.1	Confident	72.4	Confident	89 Å²	89	90.1 Å²	90.1	48%	0.476	49%	0.487	S	S	.	.	H	α-helix	trans	-72.9	-34.1	179.7	-65.8	-26	0	0	0	111.9	E728 Q729 R735 M736	E728-D732 PolarHBondContact O-N 3.42Å; Q729-D732 PolarHBondContact O-N 2.92Å; D732-R735 WeakPolarHBondContact O-CB 3.25Å; D732-R735 PolarHBondContact O-N 2.69Å; D732-R735 WeakPolarHBondContact OD1-CD 3.12Å; D732-R735 IonicContact OD1-CZ 2.8Å; D732-R735 IonicContact OD1-NE 3.68Å; D732-R735 PolarHBondContact OD1-NE 3.03Å; D732-M736 PolarHBondContact O-N 2.9Å
733	H	81.8	Confident	72.1	Confident	38 Å²	38	93.4 Å²	93.4	18%	0.176	50%	0.5	C	S	.	.	H	α-helix	trans	-61.8	-41.5	166.7	177.6	71.5	0	0	0	112.7	C717 C720 F724 Q729 F730 R735 M736 H737	C717-H733 WeakPolarHBondContact CB-NE2 3.49Å; C717-H733 PolarHBondContact SG-NE2 3.23Å; C720-H733 VanDerWaalsContact SG-CE1 3.56Å; C720-H733 PolarHBondContact SG-NE2 3.42Å; C720-H733 VanDerWaalsContact SG-NE2 3.38Å; F724-H733 HydrophobicContact CE1-CB 4.11Å; F724-H733 HydrophobicContact CE2-CB 3.94Å; F724-H733 AromaticContact CE2-CD2 3.3Å; F724-H733 WeakPolarHBondContact CE2-CD2 3.29Å; F724-H733 AromaticContact CE2-CG 3.58Å; F724-H733 AromaticContact CE2-NE2 3.8Å; F724-H733 HydrophobicContact CZ-CB 3.58Å; F724-H733 AromaticContact CZ-CD2 3.49Å; F724-H733 VanDerWaalsContact CZ-CD2 3.49Å; F724-H733 WeakPolarHBondContact CZ-CD2 3.44Å; F724-H733 AromaticContact CZ-CE1 3.93Å; F724-H733 AromaticContact CZ-CG 3.28Å; F724-H733 AromaticContact CZ-ND1 3.6Å; F724-H733 AromaticContact CZ-NE2 3.88Å; Q729-H733 VanDerWaalsContact O-CB 3.28Å; Q729-H733 WeakPolarHBondContact O-CB 3.4Å; Q729-H733 PolarHBondContact O-N 3.45Å; F730-H733 PolarHBondContact O-N 2.98Å; H733-R735 VanDerWaalsContact C-N 3.26Å; H733-R735 PolarHBondContact O-N 2.93Å; H733-M736 WeakPolarHBondContact O-CB 3.33Å; H733-M736 PolarHBondContact O-N 3.45Å; H733-M736 VanDerWaalsContact O-N 3.15Å; H733-H737 AromaticContact CD2-CD2 3.91Å; H733-H737 AromaticContact CD2-NE2 3.65Å; H733-H737 AromaticContact CE1-NE2 3.23Å; H733-H737 PolarHBondContact CE1-NE2 2.95Å; H733-H737 AromaticContact ND1-NE2 4Å; H733-H737 AromaticContact NE2-CD2 3.68Å; H733-H737 AromaticContact NE2-NE2 2.95Å; H733-H737 PolarHBondContact NE2-NE2 3.19Å; H733-H737 PolarHBondContact O-CD2 2.7Å; H733-H737 VanDerWaalsContact O-CD2 3.3Å; H733-H737 PolarHBondContact O-N 3.25Å
734	M	77.9	Confident	71.8	Confident	46 Å²	46	90.8 Å²	90.8	23%	0.227	49%	0.494	C	S	.	.	H	α-helix	trans	-66.5	-24.1	174.1	-72.7	-59.2	-56	0	0	113.1	C717 V719 F730 N731 V738	C717-M734 VanDerWaalsContact SG-SD 3.63Å; V719-M734 HydrophobicContact CG2-CE 4.46Å; F730-M734 HydrophobicContact CD1-CG 4.25Å; F730-M734 HydrophobicContact CD2-CG 4.47Å; F730-M734 HydrophobicContact CE1-CG 3.79Å; F730-M734 HydrophobicContact CE2-CG 4.05Å; F730-M734 HydrophobicContact CE2-SD 4.33Å; F730-M734 HydrophobicContact CZ-CG 3.68Å; F730-M734 HydrophobicContact CZ-SD 4.15Å; F730-M734 WeakPolarHBondContact O-CB 3.38Å; F730-M734 VanDerWaalsContact O-CG 3.31Å; F730-M734 WeakPolarHBondContact O-CG 3.36Å; F730-M734 PolarHBondContact O-N 3.34Å; N731-M734 PolarHBondContact O-N 3.12Å; M734-V738 WeakPolarHBondContact O-CG2 3.39Å; M734-V738 PolarHBondContact O-N 3.27Å
735	R	80.2	Confident	71.3	Confident	164 Å²	164	94.1 Å²	94.1	62%	0.619	51%	0.514	S	S	*	.	H	α-helix	trans	-70.1	-34.4	170.4	-65.8	168	-167.5	-95	-0.4	112.4	N731 D732 H733 V738 S739	N731-R735 WeakPolarHBondContact O-CG 3.41Å; N731-R735 PolarHBondContact O-N 3.32Å; D732-R735 WeakPolarHBondContact O-CB 3.25Å; D732-R735 PolarHBondContact O-N 2.69Å; D732-R735 WeakPolarHBondContact OD1-CD 3.12Å; D732-R735 IonicContact OD1-CZ 2.8Å; D732-R735 IonicContact OD1-NE 3.68Å; D732-R735 PolarHBondContact OD1-NE 3.03Å; H733-R735 VanDerWaalsContact C-N 3.26Å; H733-R735 PolarHBondContact O-N 2.93Å; R735-V738 CarbonylContact O-C 3.59Å; R735-V738 PolarHBondContact O-N 2.98Å; R735-S739 PolarHBondContact O-N 3.48Å; R735-S739 VanDerWaalsContact O-N 3.09Å; R735-S739 PolarHBondContact O-OG 3.38Å
736	M	70.6	Confident	71.1	Confident	117 Å²	117	93.6 Å²	93.6	58%	0.576	51%	0.512	S	S	*	.	H	α-helix	trans	-60.8	-48.3	175	-62.3	-61.5	-60.3	0	0	110.5	D732 H733 V738 S739 D740	D732-M736 PolarHBondContact O-N 2.9Å; H733-M736 WeakPolarHBondContact O-CB 3.33Å; H733-M736 PolarHBondContact O-N 3.45Å; H733-M736 VanDerWaalsContact O-N 3.15Å; M736-V738 PolarHBondContact O-N 2.95Å; M736-V738 VanDerWaalsContact O-N 3.16Å; M736-S739 WeakPolarHBondContact O-CA 3.4Å; M736-S739 VanDerWaalsContact O-CB 3.27Å; M736-S739 WeakPolarHBondContact O-CB 3.49Å; M736-S739 PolarHBondContact O-N 3.02Å; M736-D740 PolarHBondContact O-N 3.47Å
737	H	75.8	Confident	71.2	Confident	46 Å²	46	92.9 Å²	92.9	21%	0.213	51%	0.514	C	S	.	.	H	α-helix	trans	-61.2	-24.6	175.4	-65.9	-68.1	0	0	0	114.3	C717 V719 H733 S739	C717-H737 PolarHBondContact SG-NE2 3.43Å; V719-H737 WeakPolarHBondContact CG1-ND1 3.39Å; V719-H737 HydrophobicContact CG2-CB 4.33Å; H733-H737 AromaticContact CD2-CD2 3.91Å; H733-H737 AromaticContact CD2-NE2 3.65Å; H733-H737 AromaticContact CE1-NE2 3.23Å; H733-H737 PolarHBondContact CE1-NE2 2.95Å; H733-H737 AromaticContact ND1-NE2 4Å; H733-H737 AromaticContact NE2-CD2 3.68Å; H733-H737 AromaticContact NE2-NE2 2.95Å; H733-H737 PolarHBondContact NE2-NE2 3.19Å; H733-H737 PolarHBondContact O-CD2 2.7Å; H733-H737 VanDerWaalsContact O-CD2 3.3Å; H733-H737 PolarHBondContact O-N 3.25Å; H737-S739 VanDerWaalsContact C-N 3.34Å
738	V	67.1	Low	70.9	Confident	110 Å²	110	94.3 Å²	94.3	67%	0.667	52%	0.524	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.8	-2.7	174.4	174.5	0	0	0	0	112.1	M734 R735 M736	M734-V738 WeakPolarHBondContact O-CG2 3.39Å; M734-V738 PolarHBondContact O-N 3.27Å; R735-V738 CarbonylContact O-C 3.59Å; R735-V738 PolarHBondContact O-N 2.98Å; M736-V738 PolarHBondContact O-N 2.95Å; M736-V738 VanDerWaalsContact O-N 3.16Å
739	S	57	Low	70.5	Confident	88 Å²	88	90.6 Å²	90.6	62%	0.615	51%	0.513	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.7	-22.3	172.8	-52.1	0	0	0	0	112.4	R735 M736 H737	R735-S739 PolarHBondContact O-N 3.48Å; R735-S739 VanDerWaalsContact O-N 3.09Å; R735-S739 PolarHBondContact O-OG 3.38Å; M736-S739 WeakPolarHBondContact O-CA 3.4Å; M736-S739 VanDerWaalsContact O-CB 3.27Å; M736-S739 WeakPolarHBondContact O-CB 3.49Å; M736-S739 PolarHBondContact O-N 3.02Å; H737-S739 VanDerWaalsContact C-N 3.34Å
740	D	51.4	Low	70.2	Confident	138 Å²	138	90.5 Å²	90.5	74%	0.738	52%	0.52	S	S	*	.			trans	-98.1	9.7	-176.6	-64.9	-33.7	0	0	0	113.8	M736	M736-D740 PolarHBondContact O-N 3.47Å
741	G	38.4	Very low	69.1	Low	129 Å²	129	94.8 Å²	94.8	100%	1.33	55%	0.55	S	S	*	*			trans	-178.1	0	179.6	0	0	0	0	0	115.5

Retrieved 741 of 741 residues in 681.5 ms (Link to these results)

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