A0A087XRI5_POEFO Loading...

Chloride channel 7

AlphaFold DB , UniProt , Accession A0A087XRI5, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 686 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	26.2	Very low	25.9	Very low	251 Å²	251	161.6 Å²	161.6	100%	1.236	86%	0.855	S	S	*	*				0	140.4	0	-64.1	171.9	-177.3	0	0	107.2
2	A	26	Very low	25.8	Very low	94 Å²	94	157.4 Å²	157.4	78%	0.777	85%	0.849	S	S	*	*			trans	-86.2	153.8	178.5	0	0	0	0	0	110.7
3	N	27.1	Very low	25.7	Very low	167 Å²	167	164.2 Å²	164.2	89%	0.893	86%	0.855	S	S	*	*			trans	-143.9	134.1	157.9	-144.3	-6.6	0	0	0	108.9
4	I	29.1	Very low	25.7	Very low	148 Å²	148	157.1 Å²	157.1	76%	0.759	84%	0.841	S	S	*	*			trans	-108.4	112.8	-163.8	-64.1	170.3	0	0	0	109.6	K6	I4-K6 PolarHBondContact O-N 2.89Å
5	T	31.1	Very low	25.7	Very low	136 Å²	136	157.6 Å²	157.6	83%	0.834	84%	0.844	S	S	*	*			trans	-79.5	101.4	173	49.6	0	0	0	0	111	K7	T5-K7 PolarHBondContact O-N 3.48Å
6	K	24.9	Very low	25.7	Very low	195 Å²	195	160.4 Å²	160.4	85%	0.848	85%	0.85	S	S	*	*			trans	-67	111.9	167	-74.6	-176	175.1	-178.2	0	109.9	I4	I4-K6 PolarHBondContact O-N 2.89Å
7	K	26.3	Very low	25.7	Very low	207 Å²	207	158 Å²	158	90%	0.9	85%	0.85	S	S	*	*	P	Polyproline II helix	trans	-78.3	134.9	155.3	-76.1	-174.1	175.4	-178.8	0	108.3	T5	T5-K7 PolarHBondContact O-N 3.48Å
8	V	24.5	Very low	25.6	Very low	123 Å²	123	153.7 Å²	153.7	75%	0.745	85%	0.848	S	S	*	*	P	Polyproline II helix	trans	-86.1	124.5	173.5	176.5	0	0	0	0	108.5
9	S	22.6	Very low	25.6	Very low	107 Å²	107	150.8 Å²	150.8	75%	0.748	85%	0.847	S	S	*	*	P	Polyproline II helix	trans	-92.9	126.4	172.2	-175.9	0	0	0	0	109.6
10	W	23.3	Very low	25.6	Very low	243 Å²	243	148.8 Å²	148.8	92%	0.92	85%	0.85	S	S	*	*			trans	-90	101.3	167.6	-82.1	72.5	0	0	0	108.8
11	S	23.7	Very low	25.5	Very low	107 Å²	107	145.1 Å²	145.1	75%	0.748	85%	0.845	S	S	*	*			trans	-86.1	128.3	167.9	-174.1	0	0	0	0	109.3
12	S	24.4	Very low	25.4	Very low	111 Å²	111	141.8 Å²	141.8	78%	0.776	83%	0.826	S	S	*	*			trans	-64.2	145.5	165.3	-177.6	0	0	0	0	110.6
13	R	24.8	Very low	25.3	Very low	245 Å²	245	146 Å²	146	93%	0.925	83%	0.83	S	S	*	*			trans	-159.5	126.5	156.2	-129.6	174.2	178	170.2	-2.1	108.7
14	G	25.2	Very low	25.1	Very low	65 Å²	65	144.5 Å²	144.5	67%	0.67	83%	0.827	S	S	*	*			trans	-90.1	168.1	178.2	0	0	0	0	0	113.1
15	D	26.1	Very low	25.2	Very low	165 Å²	165	143.5 Å²	143.5	88%	0.882	83%	0.83	S	S	*	*			trans	12.4	118.8	158.5	-50.7	-19	0	0	0	119.1
16	E	25.3	Very low	24.8	Very low	202 Å²	202	144.5 Å²	144.5	94%	0.944	83%	0.829	S	S	*	*				-151.4	158.9	128.6	-129.6	171.4	-157.1	0	0	111.1
17	S	26.1	Very low	24.9	Very low	120 Å²	120	143.8 Å²	143.8	84%	0.839	83%	0.834	S	S	*	*			trans	-96.3	148.1	-167.9	59.1	0	0	0	0	114.1
18	G	24.7	Very low	24.8	Very low	80 Å²	80	141.1 Å²	141.1	83%	0.825	83%	0.829	S	S	*	*			trans	176.7	134.6	165.4	0	0	0	0	0	114.3
19	A	24.9	Very low	24.9	Very low	100 Å²	100	139.1 Å²	139.1	83%	0.826	83%	0.834	S	S	*	*			trans	-93.9	151.7	-176.3	0	0	0	0	0	113.9
20	A	25	Very low	24.9	Very low	110 Å²	110	138.9 Å²	138.9	91%	0.909	83%	0.832	S	S	*	*			trans	50.3	132.7	147.7	0	0	0	0	0	121.2
21	G	24.1	Very low	25	Very low	71 Å²	71	134.4 Å²	134.4	73%	0.732	82%	0.821	S	S	*	*			trans	172.4	98.3	166.7	0	0	0	0	0	116.1
22	E	24.5	Very low	25	Very low	182 Å²	182	136.9 Å²	136.9	85%	0.85	82%	0.821	S	S	*	*			trans	45.2	109.3	145.4	-67.2	169.8	133.2	0	0	123
23	E	24.4	Very low	24.9	Very low	183 Å²	183	136.7 Å²	136.7	86%	0.855	82%	0.82	S	S	*	*				61.5	123.6	124.8	-56.8	-160.6	161.2	0	0	123.5
24	T	22.4	Very low	24.8	Very low	135 Å²	135	136.7 Å²	136.7	83%	0.828	82%	0.82	S	S	*	*			trans	-122.7	129.2	157.2	55.9	0	0	0	0	110.3	L26	T24-L26 PolarHBondContact O-N 2.71Å
25	P	30.1	Very low	25.3	Very low	127 Å²	127	139 Å²	139	83%	0.825	82%	0.823	S	S	*	*			trans	-82.5	120.8	-176.6	30.5	-33.9	0	0	0	114
26	L	24.1	Very low	25.1	Very low	156 Å²	156	138.8 Å²	138.8	82%	0.817	82%	0.821	S	S	*	*			trans	10.7	135.2	143.8	-63.6	166.4	0	0	0	120.1	T24	T24-L26 PolarHBondContact O-N 2.71Å
27	L	26.3	Very low	25	Very low	180 Å²	180	139 Å²	139	94%	0.942	81%	0.813	S	S	*	*			trans	-132.2	138.4	139.2	-109.3	172.6	0	0	0	110.2
28	N	24.8	Very low	24.8	Very low	151 Å²	151	139.9 Å²	139.9	81%	0.807	80%	0.804	S	S	*	*			trans	-84.4	147.8	-169.4	-103.7	-29.5	0	0	0	113.4
29	G	26.4	Very low	24.7	Very low	81 Å²	81	143.9 Å²	143.9	84%	0.835	80%	0.803	S	S	*	*			trans	-150.7	96.1	167.4	0	0	0	0	0	109.6
30	S	23.6	Very low	24.5	Very low	102 Å²	102	144 Å²	144	71%	0.713	80%	0.798	S	S	*	*			trans	-104.5	159.9	-167	55.1	0	0	0	0	113.9
31	E	24.9	Very low	24.5	Very low	149 Å²	149	144.4 Å²	144.4	70%	0.696	80%	0.795	S	S	*	*			trans	126.1	116.5	142.7	-66.8	-113.8	81.3	0	0	118
32	Q	23.5	Very low	24.5	Very low	160 Å²	160	144.2 Å²	144.2	75%	0.748	79%	0.792	S	S	*	*			trans	81.2	161	136.7	-67.4	-178	33.3	0	0	121.3
33	S	22.1	Very low	24.6	Very low	107 Å²	107	140.8 Å²	140.8	75%	0.748	79%	0.789	S	S	*	*			trans	-162.2	152.9	-154.5	59.5	0	0	0	0	111.9
34	R	23.3	Very low	24.6	Very low	244 Å²	244	138.4 Å²	138.4	92%	0.921	79%	0.787	S	S	*	*			trans	176.7	140.2	140.3	-99.1	159.2	-173.6	-160.2	1.9	112
35	P	35.3	Very low	24.7	Very low	115 Å²	115	138.5 Å²	138.5	75%	0.747	79%	0.787	S	S	*	*			trans	-103.6	162.2	170.7	38.6	-33	0	0	0	112.7
36	L	21.9	Very low	24.4	Very low	160 Å²	160	140.7 Å²	140.7	84%	0.838	78%	0.784	S	S	*	*			trans	-165.3	120.1	146	-132.1	82.1	0	0	0	116.2
37	R	22.8	Very low	24.4	Very low	205 Å²	205	140.8 Å²	140.8	77%	0.774	78%	0.78	S	S	*	*			trans	39.5	118.3	133.1	-71.9	-174.9	157.1	165.7	-2.7	125.5
38	Q	22.2	Very low	24.4	Very low	140 Å²	140	139.7 Å²	139.7	65%	0.654	77%	0.773	S	S	*	*				80.8	146.1	111.5	-73.5	-178.6	-82.5	0	0	125.3
39	M	22.2	Very low	24.4	Very low	163 Å²	163	136.2 Å²	136.2	80%	0.803	77%	0.773	S	S	*	*			trans	71.4	154.6	154	-73	164.3	79.8	0	0	117.5
40	S	21.6	Very low	24.3	Very low	103 Å²	103	144.1 Å²	144.1	72%	0.72	78%	0.777	S	S	*	*			cis	-174.4	171.2	-19	58.9	0	0	0	0	107.9
41	S	23.8	Very low	24.3	Very low	119 Å²	119	147.5 Å²	147.5	83%	0.832	79%	0.787	S	S	*	*			cis	-166.7	140.4	-15.2	149.1	0	0	0	0	110.1
42	G	24.5	Very low	24.3	Very low	66 Å²	66	145.5 Å²	145.5	68%	0.68	79%	0.789	S	S	*	*			trans	87.4	158	164.1	0	0	0	0	0	116.8
43	S	25.5	Very low	24.4	Very low	111 Å²	111	144 Å²	144	78%	0.776	79%	0.791	S	S	*	*			cis	176.9	151.7	-5.1	36.9	0	0	0	0	110.2
44	T	25.1	Very low	24.7	Very low	133 Å²	133	145.3 Å²	145.3	82%	0.816	79%	0.794	S	S	*	*			cis	-175.2	138.6	-15.8	28.1	0	0	0	0	107.4
45	V	24.9	Very low	24.7	Very low	137 Å²	137	140.4 Å²	140.4	83%	0.83	79%	0.787	S	S	*	*			trans	-153.8	121.4	156.7	132.8	0	0	0	0	112.6
46	F	24.1	Very low	24.4	Very low	173 Å²	173	142 Å²	142	76%	0.759	79%	0.788	S	S	*	*			trans	38.7	118.4	153.2	-82.1	-106.9	0	0	0	124.8
47	Q	23.7	Very low	24.6	Very low	158 Å²	158	141.2 Å²	141.2	74%	0.738	79%	0.785	S	S	*	*				62.8	154.7	128.8	-73.9	-167.6	-34	0	0	122
48	I	25.8	Very low	24.8	Very low	157 Å²	157	140 Å²	140	81%	0.805	79%	0.787	S	S	*	*			cis	-164.5	159.3	-36.6	-124.5	176.6	0	0	0	107.2
49	G	25.6	Very low	25	Very low	77 Å²	77	141 Å²	141	79%	0.794	79%	0.793	S	S	*	*			trans	126.8	102.4	165.5	0	0	0	0	0	113.6
50	R	23.6	Very low	25.2	Very low	247 Å²	247	140.2 Å²	140.2	93%	0.932	79%	0.79	S	S	*	*			trans	-120.7	139.4	-175.7	-155	-175.9	-164.2	-172.4	3.3	110.3
51	L	23.4	Very low	25.3	Very low	173 Å²	173	141.3 Å²	141.3	91%	0.906	79%	0.792	S	S	*	*			trans	-66.7	146.4	167.9	-145.1	76	0	0	0	109.9
52	S	25.1	Very low	25.3	Very low	108 Å²	108	141.3 Å²	141.3	76%	0.755	79%	0.787	S	S	*	*			trans	-124.3	121.1	176.9	56.5	0	0	0	0	111.5
53	T	26.1	Very low	25.5	Very low	127 Å²	127	147 Å²	147	78%	0.779	80%	0.797	S	S	*	*			trans	-77.7	154.9	165.4	47.4	0	0	0	0	110.7
54	V	27.7	Very low	25.6	Very low	136 Å²	136	150 Å²	150	82%	0.824	80%	0.798	S	S	*	*			trans	-139.9	142.9	164.2	-178	0	0	0	0	107.4
55	D	24.7	Very low	25.8	Very low	141 Å²	141	153 Å²	153	75%	0.754	80%	0.803	S	S	*	*			trans	-92.4	179.8	-166.6	-51.7	-85.6	0	0	0	113.9
56	L	28.5	Very low	25.8	Very low	147 Å²	147	151.1 Å²	151.1	77%	0.77	79%	0.788	S	S	*	*			trans	-76.3	168.8	164.3	-68.7	75.1	0	0	0	108.9
57	D	25.1	Very low	26	Very low	145 Å²	145	149.1 Å²	149.1	78%	0.775	80%	0.796	S	S	*	*			cis	-162.8	-171	45.2	-102.2	-55.8	0	0	0	112.8
58	E	28.2	Very low	26.4	Very low	178 Å²	178	145.8 Å²	145.8	83%	0.832	80%	0.795	S	S	*	*			trans	92.8	101.7	160.9	-61.6	-169.6	155.3	0	0	121.6
59	E	26.7	Very low	26.5	Very low	163 Å²	163	148.2 Å²	148.2	76%	0.762	79%	0.794	S	S	*	*			trans	66.7	98.7	130.9	-54	-149.5	135.9	0	0	124.6
60	I	26.2	Very low	26.8	Very low	146 Å²	146	147.6 Å²	147.6	75%	0.749	79%	0.788	S	S	*	*				49.4	116.7	117.5	-57	161.7	0	0	0	119.8
61	T	23.8	Very low	27	Very low	126 Å²	126	145.7 Å²	145.7	77%	0.773	78%	0.781	S	S	*	*				-160.9	130.8	129.7	-1	0	0	0	0	114.2
62	T	24.1	Very low	27.3	Very low	118 Å²	118	143 Å²	143	72%	0.724	77%	0.774	S	S	*	*			trans	31.3	106.4	153.1	54.3	0	0	0	0	121.6
63	E	27.4	Very low	27.5	Very low	187 Å²	187	147.4 Å²	147.4	87%	0.874	78%	0.779	S	S	*	*				36.5	154.3	122.9	-57.1	-172.4	136.6	0	0	123.8
64	E	28.5	Very low	27.6	Very low	174 Å²	174	148.1 Å²	148.1	81%	0.813	77%	0.774	S	S	*	*			trans	66.3	64.3	167	-58.8	-155.1	142.1	0	0	120.4
65	Q	27.9	Very low	27.7	Very low	194 Å²	194	148.9 Å²	148.9	91%	0.907	77%	0.772	S	S	*	*			trans	175.6	96.3	132.1	-97.9	155.4	75.1	0	0	114.6
66	D	25.5	Very low	28	Very low	98 Å²	98	147.1 Å²	147.1	52%	0.524	77%	0.768	S	S	.	*			trans	-157.4	39.5	149.7	-152.1	-1.5	0	0	0	113.4	A68 R69	D66-A68 PolarHBondContact O-N 3.01Å; D66-R69 WeakPolarHBondContact OD2-CD 3.2Å; D66-R69 IonicContact OD2-CZ 3.6Å; D66-R69 IonicContact OD2-NE 3.11Å; D66-R69 IonicContact OD2-NH1 2.68Å; D66-R69 PolarHBondContact OD2-NH1 3Å
67	S	29.2	Very low	28.3	Very low	132 Å²	132	148.1 Å²	148.1	92%	0.923	77%	0.768	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.2	31.6	-178.2	52.1	0	0	0	0	114.4
68	A	31.4	Very low	28.9	Very low	88 Å²	88	145.8 Å²	145.8	73%	0.727	76%	0.756	S	S	*	*	T	Hydrogen-bonded Turn	trans	-140.6	5	-172	0	0	0	0	0	116	D66 G70	D66-A68 PolarHBondContact O-N 3.01Å; A68-G70 PolarHBondContact O-N 3.18Å
69	R	28.7	Very low	29.4	Very low	207 Å²	207	145.4 Å²	145.4	78%	0.781	75%	0.754	S	S	*	*			trans	-78.8	84.1	179.5	-96.7	-176.7	165.2	121.7	-5.8	113.7	D66	D66-R69 WeakPolarHBondContact OD2-CD 3.2Å; D66-R69 IonicContact OD2-CZ 3.6Å; D66-R69 IonicContact OD2-NE 3.11Å; D66-R69 IonicContact OD2-NH1 2.68Å; D66-R69 PolarHBondContact OD2-NH1 3Å
70	G	31	Very low	30.1	Very low	65 Å²	65	147 Å²	147	67%	0.67	76%	0.759	S	S	*	*			trans	17.2	103.6	159.4	0	0	0	0	0	118.4	A68	A68-G70 PolarHBondContact O-N 3.18Å
71	R	27.1	Very low	31.3	Very low	207 Å²	207	145.2 Å²	145.2	78%	0.781	75%	0.75	S	S	*	*	P	Polyproline II helix	trans	-49.9	135.7	150.6	-62.6	-175.4	-174.1	-170	2.2	108.2	K73 E74	R71-K73 PolarHBondContact O-N 2.85Å; R71-E74 IonicContact NH1-OE1 3.98Å; R71-E74 PolarHBondContact NH1-OE1 3.08Å
72	P	30.3	Very low	33.2	Very low	116 Å²	116	144.2 Å²	144.2	75%	0.753	74%	0.739	S	S	*	*	P	Polyproline II helix	trans	-55.5	134.1	162.4	26.5	-32.8	0	0	0	107.1	E74	P72-E74 PolarHBondContact O-N 3.48Å
73	K	28.6	Very low	35.5	Very low	201 Å²	201	140.7 Å²	140.7	87%	0.874	72%	0.719	S	S	*	*	P	Polyproline II helix	trans	-56.3	116.5	178	-76.6	-178.9	177.3	176.8	0	107.9	R71 I75	R71-K73 PolarHBondContact O-N 2.85Å; K73-I75 PolarHBondContact O-N 3.41Å
74	E	30	Very low	38	Very low	141 Å²	141	140 Å²	140	66%	0.659	72%	0.721	S	S	*	*			trans	-49.2	114.4	172	-71.1	157.3	-153.3	0	0	107.3	R71 P72 P76	R71-E74 IonicContact NH1-OE1 3.98Å; R71-E74 PolarHBondContact NH1-OE1 3.08Å; P72-E74 PolarHBondContact O-N 3.48Å; E74-P76 WeakPolarHBondContact O-CD 3.34Å; E74-P76 VanDerWaalsContact O-N 3.09Å
75	I	29.8	Very low	40.6	Very low	153 Å²	153	138.9 Å²	138.9	79%	0.785	71%	0.713	S	S	*	*			trans	-58.8	117.3	168	-61.1	172.5	0	0	0	103.8	K73 H77	K73-I75 PolarHBondContact O-N 3.41Å; I75-H77 PolarHBondContact O-N 2.97Å
76	P	29.3	Very low	43.4	Very low	104 Å²	104	131.7 Å²	131.7	68%	0.675	68%	0.679	S	S	*	*			trans	-60.9	105.7	-169.8	22.5	-32.9	0	0	0	108.3	E74 N78	E74-P76 WeakPolarHBondContact O-CD 3.34Å; E74-P76 VanDerWaalsContact O-N 3.09Å; P76-N78 PolarHBondContact O-N 3.19Å
77	H	36.5	Very low	46.4	Very low	167 Å²	167	131.1 Å²	131.1	77%	0.773	67%	0.673	S	S	*	*			trans	-69.1	101	-173.2	-164.1	83.5	0	0	0	106.8	I75 E79	I75-H77 PolarHBondContact O-N 2.97Å; H77-E79 PolarHBondContact O-N 3.39Å
78	N	36	Very low	49.3	Very low	97 Å²	97	129 Å²	129	52%	0.519	66%	0.658	S	S	.	*			trans	-74.3	81.6	-176	-99	-41.3	0	0	0	108.8	P76 K80 L81	P76-N78 PolarHBondContact O-N 3.19Å; N78-K80 PolarHBondContact O-N 2.91Å; N78-L81 HydrophobicContact CB-CB 4.39Å; N78-L81 HydrophobicContact CB-CD1 3.75Å; N78-L81 HydrophobicContact CB-CG 3.88Å; N78-L81 WeakPolarHBondContact O-CB 3.48Å; N78-L81 PolarHBondContact O-N 3.41Å
79	E	39.2	Very low	52	Low	169 Å²	169	125.5 Å²	125.5	79%	0.79	63%	0.627	S	S	*	*	G	3₁₀ helix	trans	-52.8	-19.6	168.5	-61.6	176.5	137.6	0	0	111.8	H77 L81	H77-E79 PolarHBondContact O-N 3.39Å; E79-L81 VanDerWaalsContact C-N 3.33Å; E79-L81 PolarHBondContact O-N 3.29Å
80	K	41.6	Very low	54.9	Low	198 Å²	198	119 Å²	119	86%	0.861	61%	0.608	S	S	*	*	G	3₁₀ helix	trans	-78.6	-1.2	173.8	-62.1	176.9	-178.5	172.3	0	115.1	N78	N78-K80 PolarHBondContact O-N 2.91Å
81	L	50.6	Low	57.5	Low	107 Å²	107	118.2 Å²	118.2	56%	0.56	59%	0.585	S	S	*	*	G	3₁₀ helix	trans	-85.8	-23.8	178.5	-89.8	169.8	0	0	0	114.4	N78 E79 S604	N78-L81 HydrophobicContact CB-CB 4.39Å; N78-L81 HydrophobicContact CB-CD1 3.75Å; N78-L81 HydrophobicContact CB-CG 3.88Å; N78-L81 WeakPolarHBondContact O-CB 3.48Å; N78-L81 PolarHBondContact O-N 3.41Å; E79-L81 VanDerWaalsContact C-N 3.33Å; E79-L81 PolarHBondContact O-N 3.29Å; L81-S604 WeakPolarHBondContact O-CB 3.37Å; L81-S604 PolarHBondContact O-OG 2.87Å
82	L	64.6	Low	60.3	Low	105 Å²	105	115.3 Å²	115.3	55%	0.55	59%	0.585	S	S	.	*	S	Bend	trans	-98.1	136.2	-178.8	-65.2	179.4	0	0	0	111.1	P606	L82-P606 HydrophobicContact CD1-CB 4.41Å; L82-P606 HydrophobicContact CD2-CB 4.29Å
83	S	73.2	Confident	62.9	Low	44 Å²	44	113.1 Å²	113.1	31%	0.308	57%	0.567	S	S	.	*			trans	-92.2	114.2	-177.1	-162.8	0	0	0	0	112.2	K85 F86 S604	S83-K85 PolarHBondContact O-N 3.38Å; S83-K85 WeakPolarHBondContact OG-CB 3.39Å; S83-F86 WeakPolarHBondContact O-CD2 3.24Å; S83-F86 PolarHBondContact O-N 2.73Å; S83-S604 PolarHBondContact N-O 3.36Å
84	L	78.9	Confident	65.6	Low	173 Å²	173	106.4 Å²	106.4	91%	0.906	54%	0.54	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.2	0.8	171	-65.8	169.7	0	0	0	114.9
85	K	82.6	Confident	68.2	Low	151 Å²	151	106.8 Å²	106.8	66%	0.657	54%	0.542	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.2	-16.4	176.6	-177.4	-179.7	171	-170.8	0	113.3	S83	S83-K85 PolarHBondContact O-N 3.38Å; S83-K85 WeakPolarHBondContact OG-CB 3.39Å
86	F	87.6	Confident	70.9	Confident	42 Å²	42	101.7 Å²	101.7	18%	0.184	52%	0.516	C	S	.	.	P	Polyproline II helix	trans	-95.9	117.6	-178.2	-64.5	-69.4	0	0	0	110.9	S83 V208 V605 P606	S83-F86 WeakPolarHBondContact O-CD2 3.24Å; S83-F86 PolarHBondContact O-N 2.73Å; F86-V208 HydrophobicContact CB-CG1 3.78Å; F86-V208 HydrophobicContact CD1-CG1 4.24Å; F86-V208 HydrophobicContact CG-CG1 4.23Å; F86-V605 HydrophobicContact CD2-CG1 4.35Å; F86-V605 HydrophobicContact CE1-CG2 4.39Å; F86-V605 HydrophobicContact CE2-CB 4.26Å; F86-V605 HydrophobicContact CE2-CG1 4.45Å; F86-V605 HydrophobicContact CE2-CG2 3.88Å; F86-V605 HydrophobicContact CG-CG1 4.41Å; F86-V605 HydrophobicContact CZ-CG2 3.78Å; F86-P606 HydrophobicContact CB-CG 4.35Å
87	E	88.8	Confident	73.6	Confident	87 Å²	87	104 Å²	104	41%	0.407	52%	0.518	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	157	168.5	-71.6	172.7	-121.6	0	0	111.1	K209 K675	E87-K209 HydrophobicContact CB-CB 4.01Å; E87-K209 HydrophobicContact CB-CD 3.83Å; E87-K209 HydrophobicContact CB-CG 4.41Å; E87-K209 WeakPolarHBondContact O-CB 3.26Å; E87-K209 PolarHBondContact O-N 3.34Å; E87-K675 IonicContact OE2-NZ 2.75Å; E87-K675 PolarHBondContact OE2-NZ 2.82Å
88	S	90	Very high	76	Confident	87 Å²	87	100.1 Å²	100.1	61%	0.608	50%	0.503	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83.7	155.5	167.9	-54.8	0	0	0	0	112	G207 K209	S88-G207 CarbonylContact C-O 3.55Å; S88-G207 WeakPolarHBondContact CA-O 3.19Å; S88-K209 WeakPolarHBondContact O-CD 3.42Å; S88-K209 WeakPolarHBondContact O-CG 3.44Å; S88-K209 PolarHBondContact O-NZ 2.99Å
89	L	88.1	Confident	78.4	Confident	14 Å²	14	96.8 Å²	96.8	7%	0.073	48%	0.484	C	S	.	.	P	Polyproline II helix	trans	-81.2	133.7	172.7	-159.7	82.3	0	0	0	109.4	Y91 F204 G207 K209 D274 R278	L89-Y91 VanDerWaalsContact C-N 3.26Å; L89-Y91 PolarHBondContact O-N 3.19Å; L89-F204 HydrophobicContact CD1-CE2 3.84Å; L89-F204 HydrophobicContact CD1-CZ 3.81Å; L89-F204 HydrophobicContact CD2-CE1 4.46Å; L89-F204 HydrophobicContact CD2-CZ 4.4Å; L89-G207 PolarHBondContact N-O 3.12Å; L89-K209 HydrophobicContact CB-CG 4.42Å; L89-K209 HydrophobicContact CD1-CG 3.83Å; L89-D274 HydrophobicContact CD1-CB 4.23Å; L89-D274 VanDerWaalsContact CD1-CG 3.4Å; L89-D274 VanDerWaalsContact CD1-OD2 3.23Å; L89-D274 WeakPolarHBondContact CD1-OD2 3.47Å; L89-D274 HydrophobicContact CD2-CB 4.49Å; L89-D274 HydrophobicContact CG-CB 3.96Å; L89-D274 WeakPolarHBondContact CG-OD2 3.47Å; L89-R278 HydrophobicContact CD2-CB 3.82Å; L89-R278 HydrophobicContact CD2-CG 4.05Å
90	D	88.7	Confident	80.7	Confident	71 Å²	71	92.2 Å²	92.2	38%	0.38	46%	0.464	S	S	.	.			trans	-86.2	72.3	-174	-58.4	-61.3	0	0	0	108.6	K209 D274	D90-K209 IonicContact OD2-NZ 3.26Å; D90-K209 PolarHBondContact OD2-NZ 3.47Å; D90-D274 HydrophobicContact CB-CB 4.37Å; D90-D274 PolarHBondContact N-OD2 3.07Å; D90-D274 VanDerWaalsContact N-OD2 3.13Å; D90-D274 WeakPolarHBondContact O-CB 3.36Å
91	Y	85.6	Confident	82.9	Confident	48 Å²	48	86.4 Å²	86.4	19%	0.188	44%	0.44	C	S	.	.			trans	-88.6	-16.9	-171.6	-171.6	-90.4	0	0	0	114.4	L89 T275 R278 D279 F310	L89-Y91 VanDerWaalsContact C-N 3.26Å; L89-Y91 PolarHBondContact O-N 3.19Å; Y91-T275 HydrophobicContact CD2-CG2 3.95Å; Y91-T275 HydrophobicContact CE2-CG2 4.05Å; Y91-T275 HydrophobicContact CG-CG2 4.22Å; Y91-T275 WeakPolarHBondContact O-CG2 3.42Å; Y91-R278 HydrophobicContact CD2-CB 3.88Å; Y91-R278 HydrophobicContact CD2-CG 4.4Å; Y91-R278 HydrophobicContact CE2-CB 3.95Å; Y91-R278 HydrophobicContact CE2-CG 4.49Å; Y91-D279 PolarHBondContact OH-OD1 2.78Å; Y91-F310 AromaticContact CE1-CE1 3.8Å; Y91-F310 HydrophobicContact CE1-CE1 3.8Å; Y91-F310 AromaticContact CE1-CZ 3.85Å; Y91-F310 HydrophobicContact CE1-CZ 3.85Å
92	D	86.4	Confident	84.6	Confident	147 Å²	147	84.8 Å²	84.8	79%	0.786	43%	0.43	S	S	*	.	S	Bend	trans	-79.1	133.4	168.6	-161	11	0	0	0	110	I94	D92-I94 PolarHBondContact O-N 3.46Å
93	N	85.6	Confident	85.5	Confident	69 Å²	69	84 Å²	84	37%	0.369	42%	0.423	S	S	.	.			trans	-82.3	116.3	179.8	-80.1	-38.4	0	0	0	108.6	E95 T275	N93-E95 PolarHBondContact O-N 3.32Å; N93-T275 VanDerWaalsContact OD1-CG2 3.31Å; N93-T275 WeakPolarHBondContact OD1-CG2 3.48Å; N93-T275 PolarHBondContact OD1-OG1 3.08Å
94	I	84.2	Confident	86.1	Confident	61 Å²	61	91.5 Å²	91.5	31%	0.313	45%	0.445	S	S	.	.			trans	-71.7	98.7	177.9	-58.3	168.6	0	0	0	109	D92 N96 T673 N676	D92-I94 PolarHBondContact O-N 3.46Å; I94-N96 HydrophobicContact CG2-CB 4.21Å; I94-N96 PolarHBondContact O-N 3.45Å; I94-T673 HydrophobicContact CD1-CG2 4.35Å; I94-N676 WeakPolarHBondContact CD1-ND2 3.4Å
95	E	85.2	Confident	86.5	Confident	149 Å²	149	92.6 Å²	92.6	70%	0.696	44%	0.437	S	S	*	.			trans	-68.7	55.5	177.3	-63.4	-172.3	172.9	0	0	112.7	N93	N93-E95 PolarHBondContact O-N 3.32Å
96	N	87.1	Confident	86.6	Confident	45 Å²	45	87.5 Å²	87.5	24%	0.241	42%	0.416	C	S	.	.			trans	-76.6	169.7	176.3	68.4	32.2	0	0	0	111.9	I94 L98 F99 L100	I94-N96 HydrophobicContact CG2-CB 4.21Å; I94-N96 PolarHBondContact O-N 3.45Å; N96-L98 PolarHBondContact O-N 3.45Å; N96-L98 WeakPolarHBondContact OD1-CA 3.3Å; N96-L98 WeakPolarHBondContact OD1-CB 3.21Å; N96-L98 PolarHBondContact OD1-N 2.92Å; N96-L98 VanDerWaalsContact OD1-N 3.08Å; N96-F99 WeakPolarHBondContact O-CB 3.27Å; N96-F99 PolarHBondContact O-N 2.99Å; N96-F99 VanDerWaalsContact O-N 3.15Å; N96-F99 PolarHBondContact OD1-N 3.42Å; N96-L100 WeakPolarHBondContact O-CG 3.33Å; N96-L100 PolarHBondContact O-N 2.97Å
97	Q	86.3	Confident	86.5	Confident	153 Å²	153	88.6 Å²	88.6	72%	0.715	43%	0.429	S	S	*	.	H	α-helix	trans	-58.7	-31.5	-179.7	-66.5	-179.2	-7.5	0	0	113.2	L100 E101	Q97-L100 PolarHBondContact O-N 2.94Å; Q97-E101 WeakPolarHBondContact O-CB 3.38Å; Q97-E101 WeakPolarHBondContact O-CG 3.43Å; Q97-E101 PolarHBondContact O-N 2.88Å
98	L	86.6	Confident	86.2	Confident	85 Å²	85	91.1 Å²	91.1	45%	0.445	44%	0.439	S	S	.	.	H	α-helix	trans	-69.8	-40.8	177.8	-60.6	172.9	0	0	0	112.1	N96 E101 E102	N96-L98 PolarHBondContact O-N 3.45Å; N96-L98 WeakPolarHBondContact OD1-CA 3.3Å; N96-L98 WeakPolarHBondContact OD1-CB 3.21Å; N96-L98 PolarHBondContact OD1-N 2.92Å; N96-L98 VanDerWaalsContact OD1-N 3.08Å; L98-E101 PolarHBondContact O-N 3.15Å; L98-E102 WeakPolarHBondContact O-CB 3.31Å; L98-E102 PolarHBondContact O-N 3.12Å
99	F	85.5	Confident	86	Confident	27 Å²	27	92.3 Å²	92.3	12%	0.118	44%	0.442	C	S	.	.	H	α-helix	trans	-62.1	-48.4	172.9	177.3	-82.2	0	0	0	110.5	N96 E101 E102 E103	N96-F99 WeakPolarHBondContact O-CB 3.27Å; N96-F99 PolarHBondContact O-N 2.99Å; N96-F99 VanDerWaalsContact O-N 3.15Å; N96-F99 PolarHBondContact OD1-N 3.42Å; F99-E101 VanDerWaalsContact C-N 3.28Å; F99-E101 PolarHBondContact O-N 3.41Å; F99-E102 PolarHBondContact O-N 2.83Å; F99-E103 HydrophobicContact CD1-CG 4.39Å; F99-E103 VanDerWaalsContact CE1-CD 3.43Å; F99-E103 HydrophobicContact CE1-CG 4Å; F99-E103 WeakPolarHBondContact CE1-OE2 3.39Å; F99-E103 HydrophobicContact CZ-CG 4.28Å; F99-E103 PolarHBondContact O-N 3.15Å
100	L	87.1	Confident	85.8	Confident	74 Å²	74	93.3 Å²	93.3	39%	0.387	45%	0.453	S	S	.	.	H	α-helix	trans	-65.7	-29.3	178.2	-64.7	172.8	0	0	0	112.7	N96 Q97 R104	N96-L100 WeakPolarHBondContact O-CG 3.33Å; N96-L100 PolarHBondContact O-N 2.97Å; Q97-L100 PolarHBondContact O-N 2.94Å; L100-R104 WeakPolarHBondContact O-CB 3.45Å; L100-R104 PolarHBondContact O-N 3Å; L100-R104 VanDerWaalsContact O-N 3.12Å
101	E	88.1	Confident	85.7	Confident	76 Å²	76	94.8 Å²	94.8	36%	0.355	46%	0.456	S	S	.	.	H	α-helix	trans	-74.6	-40.2	170.3	-86	-153.9	-136.8	0	0	113	Q97 L98 F99 R104 R105	Q97-E101 WeakPolarHBondContact O-CB 3.38Å; Q97-E101 WeakPolarHBondContact O-CG 3.43Å; Q97-E101 PolarHBondContact O-N 2.88Å; L98-E101 PolarHBondContact O-N 3.15Å; F99-E101 VanDerWaalsContact C-N 3.28Å; F99-E101 PolarHBondContact O-N 3.41Å; E101-R104 PolarHBondContact O-N 3.48Å; E101-R105 VanDerWaalsContact O-CB 3.29Å; E101-R105 WeakPolarHBondContact O-CB 3.47Å; E101-R105 WeakPolarHBondContact O-CD 3.48Å; E101-R105 WeakPolarHBondContact O-CG 3.35Å; E101-R105 PolarHBondContact O-N 3.1Å; E101-R105 IonicContact OE2-CZ 3.23Å; E101-R105 VanDerWaalsContact OE2-CZ 3.29Å; E101-R105 IonicContact OE2-NE 2.75Å; E101-R105 PolarHBondContact OE2-NE 3.08Å; E101-R105 VanDerWaalsContact OE2-NE 3.12Å; E101-R105 IonicContact OE2-NH2 3.39Å; E101-R105 PolarHBondContact OE2-NH2 3.23Å
102	E	85.8	Confident	85.7	Confident	73 Å²	73	99.6 Å²	99.6	34%	0.341	47%	0.474	S	S	.	.	H	α-helix	trans	-59.9	-49.5	175	-172.3	-175.1	-162	0	0	110.5	L98 F99 R104 R105 M106 R273	L98-E102 WeakPolarHBondContact O-CB 3.31Å; L98-E102 PolarHBondContact O-N 3.12Å; F99-E102 PolarHBondContact O-N 2.83Å; E102-R104 PolarHBondContact O-N 2.64Å; E102-R105 PolarHBondContact O-N 3.04Å; E102-M106 WeakPolarHBondContact O-CG 3.39Å; E102-M106 PolarHBondContact O-N 2.75Å; E102-R273 VanDerWaalsContact CD-NH2 3.27Å; E102-R273 IonicContact OE1-NH2 3.67Å; E102-R273 PolarHBondContact OE1-NH2 3.45Å; E102-R273 VanDerWaalsContact OE1-NH2 3.11Å; E102-R273 IonicContact OE2-CZ 3.12Å; E102-R273 IonicContact OE2-NH1 2.83Å; E102-R273 IonicContact OE2-NH2 2.74Å; E102-R273 PolarHBondContact OE2-NH2 3.05Å
103	E	84.8	Confident	85.9	Confident	88 Å²	88	96 Å²	96	41%	0.411	46%	0.459	S	S	.	.	H	α-helix	trans	-63.6	-37.3	176	-69.4	-159	140.9	0	0	112.6	F99 M106	F99-E103 HydrophobicContact CD1-CG 4.39Å; F99-E103 VanDerWaalsContact CE1-CD 3.43Å; F99-E103 HydrophobicContact CE1-CG 4Å; F99-E103 WeakPolarHBondContact CE1-OE2 3.39Å; F99-E103 HydrophobicContact CZ-CG 4.28Å; F99-E103 PolarHBondContact O-N 3.15Å; E103-M106 PolarHBondContact O-N 3.26Å
104	R	86.1	Confident	86	Confident	201 Å²	201	94 Å²	94	76%	0.758	45%	0.448	S	S	*	.	H	α-helix	trans	-70.9	-29.7	176.2	-168.9	-174.3	-56.4	170.3	4.5	113.1	L100 E101 E102	L100-R104 WeakPolarHBondContact O-CB 3.45Å; L100-R104 PolarHBondContact O-N 3Å; L100-R104 VanDerWaalsContact O-N 3.12Å; E101-R104 PolarHBondContact O-N 3.48Å; E102-R104 PolarHBondContact O-N 2.64Å
105	R	87.2	Confident	86.3	Confident	196 Å²	196	93.6 Å²	93.6	74%	0.74	45%	0.445	S	S	*	.	H	α-helix	trans	-79.2	-21.6	174.4	-69.8	164.3	-174.7	-135.9	9.2	111.9	E101 E102 S107	E101-R105 VanDerWaalsContact O-CB 3.29Å; E101-R105 WeakPolarHBondContact O-CB 3.47Å; E101-R105 WeakPolarHBondContact O-CD 3.48Å; E101-R105 WeakPolarHBondContact O-CG 3.35Å; E101-R105 PolarHBondContact O-N 3.1Å; E101-R105 IonicContact OE2-CZ 3.23Å; E101-R105 VanDerWaalsContact OE2-CZ 3.29Å; E101-R105 IonicContact OE2-NE 2.75Å; E101-R105 PolarHBondContact OE2-NE 3.08Å; E101-R105 VanDerWaalsContact OE2-NE 3.12Å; E101-R105 IonicContact OE2-NH2 3.39Å; E101-R105 PolarHBondContact OE2-NH2 3.23Å; E102-R105 PolarHBondContact O-N 3.04Å; R105-S107 PolarHBondContact O-N 3.22Å
106	M	84.6	Confident	86.6	Confident	44 Å²	44	91.6 Å²	91.6	22%	0.217	44%	0.438	C	S	.	.			trans	-69.1	122.1	176.7	-85.4	175.6	34.5	0	0	112.2	E102 E103 F111 L114 Y270	E102-M106 WeakPolarHBondContact O-CG 3.39Å; E102-M106 PolarHBondContact O-N 2.75Å; E103-M106 PolarHBondContact O-N 3.26Å; M106-F111 HydrophobicContact CE-CB 4.18Å; M106-F111 HydrophobicContact CE-CD2 3.93Å; M106-L114 HydrophobicContact CE-CD1 3.63Å; M106-L114 HydrophobicContact SD-CD1 3.79Å; M106-Y270 HydrophobicContact SD-CE2 4.05Å
107	S	84.8	Confident	86.9	Confident	66 Å²	66	90.6 Å²	90.6	46%	0.462	44%	0.435	S	S	.	.			trans	-73.2	156.9	170.5	73.1	0	0	0	0	111.7	R105 V109 A110 F111	R105-S107 PolarHBondContact O-N 3.22Å; S107-V109 PolarHBondContact O-N 2.98Å; S107-V109 VanDerWaalsContact O-N 3.12Å; S107-A110 WeakPolarHBondContact O-CA 3.45Å; S107-A110 WeakPolarHBondContact O-CB 3.27Å; S107-A110 PolarHBondContact O-N 3.39Å; S107-A110 PolarHBondContact OG-N 2.88Å; S107-F111 PolarHBondContact O-N 2.97Å
108	F	83.8	Confident	87.3	Confident	140 Å²	140	84.6 Å²	84.6	61%	0.614	41%	0.406	S	S	*	.	H	α-helix	trans	-54.2	-31.3	172.8	179.8	-103.7	0	0	0	113.2	R112	F108-R112 HydrophobicContact CE1-CG 4.48Å; F108-R112 VanDerWaalsContact CZ-NE 3.33Å; F108-R112 PolarHBondContact O-N 2.83Å; F108-R112 VanDerWaalsContact O-N 3.1Å
109	V	84.1	Confident	87.8	Confident	111 Å²	111	84.1 Å²	84.1	67%	0.673	40%	0.398	S	S	*	.	H	α-helix	trans	-70.4	-42.2	175.1	-177.3	0	0	0	0	111	S107 R112 C113	S107-V109 PolarHBondContact O-N 2.98Å; S107-V109 VanDerWaalsContact O-N 3.12Å; V109-R112 PolarHBondContact O-N 3Å; V109-C113 WeakPolarHBondContact O-CB 3.26Å; V109-C113 PolarHBondContact O-N 3.22Å
110	A	85.3	Confident	88.3	Confident	36 Å²	36	86.9 Å²	86.9	30%	0.298	42%	0.417	S	S	.	.	H	α-helix	trans	-63.5	-43	174.5	0	0	0	0	0	111.6	S107 R112 C113 L114	S107-A110 WeakPolarHBondContact O-CA 3.45Å; S107-A110 WeakPolarHBondContact O-CB 3.27Å; S107-A110 PolarHBondContact O-N 3.39Å; S107-A110 PolarHBondContact OG-N 2.88Å; A110-R112 PolarHBondContact O-N 2.91Å; A110-C113 WeakPolarHBondContact O-CB 3.5Å; A110-C113 PolarHBondContact O-N 3.18Å; A110-C113 VanDerWaalsContact O-N 3.15Å; A110-L114 PolarHBondContact O-N 3.26Å
111	F	85.4	Confident	88.7	Confident	102 Å²	102	83.4 Å²	83.4	45%	0.447	40%	0.398	S	S	.	.	H	α-helix	trans	-58.3	-48.3	175.2	-175.9	-86.9	0	0	0	112.1	M106 S107 C113 L114 E115	M106-F111 HydrophobicContact CE-CB 4.18Å; M106-F111 HydrophobicContact CE-CD2 3.93Å; S107-F111 PolarHBondContact O-N 2.97Å; F111-C113 VanDerWaalsContact C-N 3.31Å; F111-C113 PolarHBondContact O-N 2.95Å; F111-L114 PolarHBondContact O-N 2.91Å; F111-E115 PolarHBondContact O-N 2.88Å
112	R	87.2	Confident	89.1	Confident	148 Å²	148	79.9 Å²	79.9	56%	0.558	38%	0.382	S	S	*	.	H	α-helix	trans	-61.2	-38.1	174.2	-79.5	-172	166.3	-157.1	-3.9	112.6	F108 V109 A110 E115 I116	F108-R112 HydrophobicContact CE1-CG 4.48Å; F108-R112 VanDerWaalsContact CZ-NE 3.33Å; F108-R112 PolarHBondContact O-N 2.83Å; F108-R112 VanDerWaalsContact O-N 3.1Å; V109-R112 PolarHBondContact O-N 3Å; A110-R112 PolarHBondContact O-N 2.91Å; R112-E115 PolarHBondContact O-N 3.27Å; R112-I116 VanDerWaalsContact O-CG1 3.3Å; R112-I116 WeakPolarHBondContact O-CG1 3.11Å; R112-I116 PolarHBondContact O-N 2.95Å
113	C	89.1	Confident	89.7	Confident	72 Å²	72	77 Å²	77	49%	0.486	37%	0.373	S	S	.	.	H	α-helix	trans	-64.7	-39.9	176.3	-169.2	0	0	0	0	112.1	V109 A110 F111 I116 S117	V109-C113 WeakPolarHBondContact O-CB 3.26Å; V109-C113 PolarHBondContact O-N 3.22Å; A110-C113 WeakPolarHBondContact O-CB 3.5Å; A110-C113 PolarHBondContact O-N 3.18Å; A110-C113 VanDerWaalsContact O-N 3.15Å; F111-C113 VanDerWaalsContact C-N 3.31Å; F111-C113 PolarHBondContact O-N 2.95Å; C113-I116 PolarHBondContact O-N 2.95Å; C113-S117 WeakPolarHBondContact O-CB 3.45Å; C113-S117 PolarHBondContact O-N 3.41Å; C113-S117 PolarHBondContact O-OG 2.88Å
114	L	88.7	Confident	90.2	Very high	27 Å²	27	76.2 Å²	76.2	14%	0.141	37%	0.371	C	S	.	.	H	α-helix	trans	-65.8	-39.8	173.1	-71.3	173.7	0	0	0	112.2	M106 A110 F111 S117 R118 Y270 F271	M106-L114 HydrophobicContact CE-CD1 3.63Å; M106-L114 HydrophobicContact SD-CD1 3.79Å; A110-L114 PolarHBondContact O-N 3.26Å; F111-L114 PolarHBondContact O-N 2.91Å; L114-S117 WeakPolarHBondContact O-CB 3.42Å; L114-S117 PolarHBondContact O-N 3.28Å; L114-R118 WeakPolarHBondContact O-CG 3.42Å; L114-R118 PolarHBondContact O-N 3.13Å; L114-R118 VanDerWaalsContact O-N 3.07Å; L114-R118 PolarHBondContact O-NH1 2.81Å; L114-Y270 HydrophobicContact CD1-CD1 4.22Å; L114-Y270 HydrophobicContact CD1-CD2 3.91Å; L114-Y270 HydrophobicContact CD1-CE1 4.28Å; L114-Y270 HydrophobicContact CD1-CE2 3.93Å; L114-Y270 HydrophobicContact CD1-CG 4.06Å; L114-Y270 HydrophobicContact CD2-CD1 4.04Å; L114-Y270 HydrophobicContact CD2-CD2 4.42Å; L114-Y270 HydrophobicContact CD2-CG 3.84Å; L114-F271 HydrophobicContact CB-CZ 4.48Å; L114-F271 HydrophobicContact CD2-CE2 4.21Å; L114-F271 HydrophobicContact CD2-CZ 3.89Å
115	E	89.8	Confident	90.8	Very high	52 Å²	52	66.7 Å²	66.7	24%	0.243	34%	0.335	C	S	.	.	H	α-helix	trans	-61.6	-51.2	173.1	172.6	145.3	-124	0	0	111.9	F111 R112 S117 R118 W119 M314 R318	F111-E115 PolarHBondContact O-N 2.88Å; R112-E115 PolarHBondContact O-N 3.27Å; E115-S117 PolarHBondContact O-N 2.8Å; E115-R118 WeakPolarHBondContact O-CB 3.43Å; E115-R118 PolarHBondContact O-N 2.75Å; E115-W119 VanDerWaalsContact O-CD1 3.26Å; E115-W119 PolarHBondContact O-N 2.66Å; E115-M314 WeakPolarHBondContact OE1-CE 3.35Å; E115-R318 IonicContact OE1-CZ 2.73Å; E115-R318 IonicContact OE1-NH2 3.1Å; E115-R318 PolarHBondContact OE1-NH2 2.93Å
116	I	92.8	Very high	91.3	Very high	107 Å²	107	57.3 Å²	57.3	55%	0.549	30%	0.299	S	S	.	.	H	α-helix	trans	-56.6	-40.1	175.9	-67.5	163.9	0	0	0	110.5	R112 C113 R118 W119 V120	R112-I116 VanDerWaalsContact O-CG1 3.3Å; R112-I116 WeakPolarHBondContact O-CG1 3.11Å; R112-I116 PolarHBondContact O-N 2.95Å; C113-I116 PolarHBondContact O-N 2.95Å; I116-R118 VanDerWaalsContact C-N 3.34Å; I116-R118 PolarHBondContact O-N 3.41Å; I116-W119 PolarHBondContact O-N 3.19Å; I116-V120 HydrophobicContact CG2-CG2 4.3Å; I116-V120 WeakPolarHBondContact O-CG2 3.47Å; I116-V120 PolarHBondContact O-N 3.39Å
117	S	92.9	Very high	91.9	Very high	24 Å²	24	59.4 Å²	59.4	17%	0.168	31%	0.307	C	S	.	.	H	α-helix	trans	-60.9	-39.2	176.8	-61.6	0	0	0	0	112.6	C113 L114 E115 V120 I121	C113-S117 WeakPolarHBondContact O-CB 3.45Å; C113-S117 PolarHBondContact O-N 3.41Å; C113-S117 PolarHBondContact O-OG 2.88Å; L114-S117 WeakPolarHBondContact O-CB 3.42Å; L114-S117 PolarHBondContact O-N 3.28Å; E115-S117 PolarHBondContact O-N 2.8Å; S117-V120 PolarHBondContact O-N 3.12Å; S117-I121 WeakPolarHBondContact O-CB 3.35Å; S117-I121 WeakPolarHBondContact O-CD1 3.42Å; S117-I121 VanDerWaalsContact O-CG1 3.23Å; S117-I121 WeakPolarHBondContact O-CG1 3.49Å; S117-I121 PolarHBondContact O-N 3.1Å
118	R	94.7	Very high	92.5	Very high	28 Å²	28	58.7 Å²	58.7	11%	0.106	30%	0.298	C	S	.	.	H	α-helix	trans	-62.8	-42.5	174.4	-66.4	-179.8	-174.8	94.5	-12.9	111.8	L114 E115 I116 I121 C122 F271 E276 F280 R318	L114-R118 WeakPolarHBondContact O-CG 3.42Å; L114-R118 PolarHBondContact O-N 3.13Å; L114-R118 VanDerWaalsContact O-N 3.07Å; L114-R118 PolarHBondContact O-NH1 2.81Å; E115-R118 WeakPolarHBondContact O-CB 3.43Å; E115-R118 PolarHBondContact O-N 2.75Å; I116-R118 VanDerWaalsContact C-N 3.34Å; I116-R118 PolarHBondContact O-N 3.41Å; R118-I121 PolarHBondContact O-N 2.91Å; R118-C122 PolarHBondContact O-N 3.39Å; R118-C122 PolarHBondContact O-SG 3.16Å; R118-F271 HydrophobicContact CG-CD1 4.36Å; R118-F271 HydrophobicContact CG-CE1 3.44Å; R118-F271 VanDerWaalsContact CG-CE1 3.44Å; R118-F271 HydrophobicContact CG-CZ 3.8Å; R118-E276 IonicContact CZ-OE1 2.7Å; R118-E276 VanDerWaalsContact CZ-OE1 3.27Å; R118-E276 IonicContact CZ-OE2 2.9Å; R118-E276 IonicContact NE-OE1 3.59Å; R118-E276 PolarHBondContact NE-OE1 3.26Å; R118-E276 IonicContact NE-OE2 2.74Å; R118-E276 PolarHBondContact NE-OE2 2.89Å; R118-E276 IonicContact NH2-OE1 3.95Å; R118-E276 PolarHBondContact NH2-OE1 3.17Å; R118-E276 IonicContact NH2-OE2 3.73Å; R118-F280 HydrophobicContact CB-CE1 4.42Å; R118-F280 HydrophobicContact CB-CZ 4.23Å; R118-F280 HydrophobicContact CG-CZ 4.03Å; R118-R318 VanDerWaalsContact CD-NH1 3.35Å
119	W	96.2	Very high	93.2	Very high	75 Å²	75	52 Å²	52	28%	0.284	27%	0.269	S	S	.	.	H	α-helix	trans	-63.1	-42.9	174.7	-72.7	100.1	0	0	0	112.2	E115 I116 C122 G123 W317 R318 F321	E115-W119 VanDerWaalsContact O-CD1 3.26Å; E115-W119 PolarHBondContact O-N 2.66Å; I116-W119 PolarHBondContact O-N 3.19Å; W119-C122 PolarHBondContact O-N 3.08Å; W119-G123 PolarHBondContact O-N 3.19Å; W119-W317 HydrophobicContact CH2-CB 3.95Å; W119-R318 HydrophobicContact CD2-CG 3.94Å; W119-R318 HydrophobicContact CE3-CG 4.1Å; W119-R318 HydrophobicContact CH2-CG 4.15Å; W119-R318 HydrophobicContact CZ2-CG 3.97Å; W119-R318 HydrophobicContact CZ3-CG 4.2Å; W119-F321 HydrophobicContact CE3-CB 4.23Å; W119-F321 AromaticContact CE3-CD1 3.75Å; W119-F321 HydrophobicContact CE3-CD1 3.75Å; W119-F321 HydrophobicContact CE3-CD2 4.43Å; W119-F321 HydrophobicContact CE3-CE1 4.13Å; W119-F321 AromaticContact CE3-CG 3.91Å; W119-F321 HydrophobicContact CE3-CG 3.91Å; W119-F321 HydrophobicContact CZ3-CB 3.74Å; W119-F321 HydrophobicContact CZ3-CD1 4.14Å; W119-F321 HydrophobicContact CZ3-CD2 4.27Å; W119-F321 AromaticContact CZ3-CG 3.82Å; W119-F321 HydrophobicContact CZ3-CG 3.82Å
120	V	95.9	Very high	93.8	Very high	85 Å²	85	46.8 Å²	46.8	52%	0.515	24%	0.237	S	C	.	.	H	α-helix	trans	-63	-42.8	175.9	171.1	0	0	0	0	111.7	I116 S117 G123 L124	I116-V120 HydrophobicContact CG2-CG2 4.3Å; I116-V120 WeakPolarHBondContact O-CG2 3.47Å; I116-V120 PolarHBondContact O-N 3.39Å; S117-V120 PolarHBondContact O-N 3.12Å; V120-G123 PolarHBondContact O-N 3.34Å; V120-L124 WeakPolarHBondContact O-CB 3.47Å; V120-L124 PolarHBondContact O-N 2.86Å
121	I	95.9	Very high	94.4	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-61.9	-46.5	175.3	-68.4	161.7	0	0	0	110.4	S117 R118 G123 L124 I125 V253 F268 F271 F280	S117-I121 WeakPolarHBondContact O-CB 3.35Å; S117-I121 WeakPolarHBondContact O-CD1 3.42Å; S117-I121 VanDerWaalsContact O-CG1 3.23Å; S117-I121 WeakPolarHBondContact O-CG1 3.49Å; S117-I121 PolarHBondContact O-N 3.1Å; R118-I121 PolarHBondContact O-N 2.91Å; I121-G123 PolarHBondContact O-N 2.87Å; I121-L124 PolarHBondContact O-N 3.49Å; I121-I125 HydrophobicContact CG2-CD1 3.66Å; I121-I125 HydrophobicContact CG2-CG1 4.33Å; I121-I125 VanDerWaalsContact O-CG1 3.23Å; I121-I125 WeakPolarHBondContact O-CG1 3.38Å; I121-I125 PolarHBondContact O-N 3.01Å; I121-V253 HydrophobicContact CG2-CG1 4.43Å; I121-F268 HydrophobicContact CD1-CD1 3.81Å; I121-F268 HydrophobicContact CD1-CD2 4.04Å; I121-F268 HydrophobicContact CD1-CE1 3.93Å; I121-F268 HydrophobicContact CD1-CE2 4.15Å; I121-F268 HydrophobicContact CD1-CG 3.88Å; I121-F268 HydrophobicContact CD1-CZ 4.11Å; I121-F268 HydrophobicContact CG1-CD1 4.33Å; I121-F268 HydrophobicContact CG1-CD2 4.09Å; I121-F268 HydrophobicContact CG1-CE1 4Å; I121-F268 HydrophobicContact CG1-CE2 3.74Å; I121-F268 HydrophobicContact CG1-CG 4.4Å; I121-F268 HydrophobicContact CG1-CZ 3.7Å; I121-F271 HydrophobicContact CD1-CD2 3.72Å; I121-F271 HydrophobicContact CD1-CE2 3.83Å; I121-F271 HydrophobicContact CD1-CG 4.27Å; I121-F271 HydrophobicContact CD1-CZ 4.48Å; I121-F280 HydrophobicContact CB-CD1 4.38Å; I121-F280 HydrophobicContact CB-CE1 3.68Å; I121-F280 HydrophobicContact CB-CZ 3.93Å; I121-F280 HydrophobicContact CD1-CE1 4.35Å; I121-F280 HydrophobicContact CD1-CE2 4.18Å; I121-F280 HydrophobicContact CD1-CZ 3.7Å; I121-F280 HydrophobicContact CG1-CZ 4.44Å; I121-F280 HydrophobicContact CG2-CD1 3.56Å; I121-F280 HydrophobicContact CG2-CD2 4.43Å; I121-F280 HydrophobicContact CG2-CE1 3.34Å; I121-F280 HydrophobicContact CG2-CE2 4.25Å; I121-F280 HydrophobicContact CG2-CG 4.12Å; I121-F280 HydrophobicContact CG2-CZ 3.71Å
122	C	96.5	Very high	94.9	Very high	3 Å²	3	44.5 Å²	44.5	2%	0.02	22%	0.224	C	C	.	.	H	α-helix	trans	-61.8	-40.7	177	-74.6	0	0	0	0	113.2	R118 W119 I125 G126 F321 A322	R118-C122 PolarHBondContact O-N 3.39Å; R118-C122 PolarHBondContact O-SG 3.16Å; W119-C122 PolarHBondContact O-N 3.08Å; C122-I125 PolarHBondContact O-N 3.42Å; C122-G126 PolarHBondContact O-N 3.37Å; C122-F321 HydrophobicContact CB-CD1 4.39Å; C122-A322 HydrophobicContact CB-CB 4.17Å; C122-A322 WeakPolarHBondContact O-CB 3.18Å
123	G	97.5	Very high	95.4	Very high	13 Å²	13	37.4 Å²	37.4	13%	0.134	20%	0.197	C	C	.	.	H	α-helix	trans	-63.7	-42	174.1	0	0	0	0	0	112.7	W119 V120 I121 G126 F127	W119-G123 PolarHBondContact O-N 3.19Å; V120-G123 PolarHBondContact O-N 3.34Å; I121-G123 PolarHBondContact O-N 2.87Å; G123-G126 PolarHBondContact O-N 3.13Å; G123-F127 WeakPolarHBondContact O-CB 3.49Å; G123-F127 PolarHBondContact O-N 2.68Å
124	L	97.1	Very high	95.7	Very high	71 Å²	71	34.5 Å²	34.5	37%	0.372	18%	0.177	S	C	.	.	H	α-helix	trans	-66.5	-36.3	176.1	-177.3	59	0	0	0	112.4	V120 I121 L128 V253	V120-L124 WeakPolarHBondContact O-CB 3.47Å; V120-L124 PolarHBondContact O-N 2.86Å; I121-L124 PolarHBondContact O-N 3.49Å; L124-L128 HydrophobicContact CD1-CD1 3.84Å; L124-L128 HydrophobicContact CD1-CG 3.97Å; L124-L128 HydrophobicContact CG-CD1 3.88Å; L124-L128 HydrophobicContact CG-CG 4.42Å; L124-L128 WeakPolarHBondContact O-CB 3.42Å; L124-L128 VanDerWaalsContact O-CG 3.26Å; L124-L128 WeakPolarHBondContact O-CG 3.5Å; L124-L128 PolarHBondContact O-N 2.74Å; L124-V253 HydrophobicContact CD2-CG1 3.7Å; L124-V253 HydrophobicContact CG-CG1 4.13Å
125	I	97.3	Very high	96	Very high	0 Å²	0	39 Å²	39	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-62.4	-48.3	173.2	-72.1	164.4	0	0	0	110.7	I121 C122 T129 A250 F280	I121-I125 HydrophobicContact CG2-CD1 3.66Å; I121-I125 HydrophobicContact CG2-CG1 4.33Å; I121-I125 VanDerWaalsContact O-CG1 3.23Å; I121-I125 WeakPolarHBondContact O-CG1 3.38Å; I121-I125 PolarHBondContact O-N 3.01Å; C122-I125 PolarHBondContact O-N 3.42Å; I125-T129 VanDerWaalsContact O-CB 3.31Å; I125-T129 WeakPolarHBondContact O-CB 3.4Å; I125-T129 PolarHBondContact O-N 2.77Å; I125-T129 PolarHBondContact O-OG1 2.67Å; I125-A250 HydrophobicContact CD1-CB 3.61Å; I125-A250 HydrophobicContact CG1-CB 4.04Å; I125-A250 HydrophobicContact CG2-CB 4.06Å; I125-F280 HydrophobicContact CD1-CB 4.11Å; I125-F280 HydrophobicContact CD1-CD1 3.96Å; I125-F280 HydrophobicContact CD1-CG 4.34Å
126	G	97.6	Very high	96.3	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-57.7	-52.9	176	0	0	0	0	0	111.7	C122 G123 L128 T129 G130 A322 S326	C122-G126 PolarHBondContact O-N 3.37Å; G123-G126 PolarHBondContact O-N 3.13Å; G126-L128 PolarHBondContact O-N 2.99Å; G126-T129 PolarHBondContact O-N 2.74Å; G126-T129 VanDerWaalsContact O-N 3.13Å; G126-G130 PolarHBondContact O-N 2.92Å; G126-A322 VanDerWaalsContact CA-O 3.28Å; G126-A322 WeakPolarHBondContact CA-O 3.31Å; G126-S326 WeakPolarHBondContact O-CA 3.36Å
127	F	98.1	Very high	96.4	Very high	87 Å²	87	32.7 Å²	32.7	38%	0.382	17%	0.165	S	C	.	.	H	α-helix	trans	-58	-47.6	-179.1	-179.9	-103.5	0	0	0	112.8	G123 T129 G130 L131 I325 T329 F333	G123-F127 WeakPolarHBondContact O-CB 3.49Å; G123-F127 PolarHBondContact O-N 2.68Å; F127-T129 VanDerWaalsContact C-N 3.32Å; F127-T129 PolarHBondContact O-N 3.05Å; F127-G130 PolarHBondContact O-N 2.95Å; F127-L131 HydrophobicContact CD1-CD1 3.93Å; F127-L131 HydrophobicContact CE1-CD1 3.45Å; F127-L131 VanDerWaalsContact CE1-CD1 3.45Å; F127-L131 HydrophobicContact CE1-CG 4.45Å; F127-L131 HydrophobicContact CE2-CD1 4.47Å; F127-L131 HydrophobicContact CZ-CD1 3.76Å; F127-L131 HydrophobicContact CZ-CG 4.46Å; F127-L131 WeakPolarHBondContact O-CG 3.25Å; F127-L131 PolarHBondContact O-N 2.71Å; F127-I325 HydrophobicContact CB-CG2 4.21Å; F127-T329 HydrophobicContact CD2-CG2 3.59Å; F127-T329 HydrophobicContact CE2-CG2 3.93Å; F127-T329 HydrophobicContact CG-CG2 4.35Å; F127-F333 HydrophobicContact CE2-CE2 4.05Å; F127-F333 HydrophobicContact CZ-CE2 4.43Å
128	L	97.7	Very high	96.5	Very high	51 Å²	51	33.8 Å²	33.8	27%	0.267	17%	0.168	S	C	.	.	H	α-helix	trans	-68	-30.6	178	-68.3	172.4	0	0	0	112.7	L124 G126 I132 L249 V253	L124-L128 HydrophobicContact CD1-CD1 3.84Å; L124-L128 HydrophobicContact CD1-CG 3.97Å; L124-L128 HydrophobicContact CG-CD1 3.88Å; L124-L128 HydrophobicContact CG-CG 4.42Å; L124-L128 WeakPolarHBondContact O-CB 3.42Å; L124-L128 VanDerWaalsContact O-CG 3.26Å; L124-L128 WeakPolarHBondContact O-CG 3.5Å; L124-L128 PolarHBondContact O-N 2.74Å; G126-L128 PolarHBondContact O-N 2.99Å; L128-I132 PolarHBondContact O-N 3.34Å; L128-I132 VanDerWaalsContact O-N 3.09Å; L128-L249 HydrophobicContact CB-CD1 3.83Å; L128-L249 HydrophobicContact CB-CD2 4.37Å; L128-V253 HydrophobicContact CD1-CG2 3.84Å
129	T	97.4	Very high	96.5	Very high	1 Å²	1	33.4 Å²	33.4	1%	0.006	17%	0.172	C	C	.	.	H	α-helix	trans	-71.7	-44	177.4	-55.8	0	0	0	0	111.2	I125 G126 F127 L131 I132 A133 M242 A287	I125-T129 VanDerWaalsContact O-CB 3.31Å; I125-T129 WeakPolarHBondContact O-CB 3.4Å; I125-T129 PolarHBondContact O-N 2.77Å; I125-T129 PolarHBondContact O-OG1 2.67Å; G126-T129 PolarHBondContact O-N 2.74Å; G126-T129 VanDerWaalsContact O-N 3.13Å; F127-T129 VanDerWaalsContact C-N 3.32Å; F127-T129 PolarHBondContact O-N 3.05Å; T129-L131 VanDerWaalsContact C-N 3.33Å; T129-L131 PolarHBondContact O-N 3.22Å; T129-I132 PolarHBondContact O-N 3.05Å; T129-A133 PolarHBondContact O-N 2.83Å; T129-M242 HydrophobicContact CG2-CE 4.05Å; T129-A287 HydrophobicContact CG2-CB 4.33Å
130	G	96.9	Very high	96.4	Very high	0 Å²	0	30 Å²	30	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-61.9	-36.7	173.1	0	0	0	0	0	113.2	G126 F127 A133 C134	G126-G130 PolarHBondContact O-N 2.92Å; F127-G130 PolarHBondContact O-N 2.95Å; G130-A133 PolarHBondContact O-N 3Å; G130-C134 WeakPolarHBondContact O-CB 3.43Å; G130-C134 PolarHBondContact O-N 2.87Å
131	L	97.1	Very high	96.2	Very high	58 Å²	58	28.9 Å²	28.9	30%	0.304	15%	0.148	S	C	.	.	H	α-helix	trans	-65.5	-41.2	172.8	-78.6	175.5	0	0	0	113.3	F127 T129 C134 F135 T329 F333	F127-L131 HydrophobicContact CD1-CD1 3.93Å; F127-L131 HydrophobicContact CE1-CD1 3.45Å; F127-L131 VanDerWaalsContact CE1-CD1 3.45Å; F127-L131 HydrophobicContact CE1-CG 4.45Å; F127-L131 HydrophobicContact CE2-CD1 4.47Å; F127-L131 HydrophobicContact CZ-CD1 3.76Å; F127-L131 HydrophobicContact CZ-CG 4.46Å; F127-L131 WeakPolarHBondContact O-CG 3.25Å; F127-L131 PolarHBondContact O-N 2.71Å; T129-L131 VanDerWaalsContact C-N 3.33Å; T129-L131 PolarHBondContact O-N 3.22Å; L131-C134 PolarHBondContact O-N 3.05Å; L131-F135 WeakPolarHBondContact O-CB 3.36Å; L131-F135 PolarHBondContact O-N 2.8Å; L131-T329 HydrophobicContact CG-CG2 4.23Å; L131-F333 HydrophobicContact CD2-CD2 3.65Å; L131-F333 HydrophobicContact CD2-CE2 3.52Å; L131-F333 HydrophobicContact CD2-CG 4.24Å; L131-F333 HydrophobicContact CD2-CZ 3.99Å; L131-F333 HydrophobicContact CG-CE2 4.34Å
132	I	97	Very high	96.1	Very high	32 Å²	32	34.4 Å²	34.4	16%	0.164	17%	0.174	C	C	.	.	H	α-helix	trans	-66.9	-38.9	175.2	-71.8	-170.7	0	0	0	111.2	L128 T129 F135 I136 L219 V223 M242 L249	L128-I132 PolarHBondContact O-N 3.34Å; L128-I132 VanDerWaalsContact O-N 3.09Å; T129-I132 PolarHBondContact O-N 3.05Å; I132-F135 PolarHBondContact O-N 3.31Å; I132-I136 HydrophobicContact CG2-CD1 3.79Å; I132-I136 HydrophobicContact CG2-CG1 4.49Å; I132-I136 WeakPolarHBondContact O-CG1 3.47Å; I132-I136 PolarHBondContact O-N 3.46Å; I132-L219 HydrophobicContact CD1-CD1 4.12Å; I132-L219 HydrophobicContact CD1-CD2 4.02Å; I132-L219 HydrophobicContact CD1-CG 4.42Å; I132-V223 HydrophobicContact CG2-CG2 3.95Å; I132-M242 HydrophobicContact CG2-CE 4.18Å; I132-M242 HydrophobicContact CG2-SD 4.32Å; I132-L249 HydrophobicContact CD1-CD1 3.78Å; I132-L249 HydrophobicContact CD1-CD2 4.08Å; I132-L249 HydrophobicContact CD1-CG 4.08Å; I132-L249 HydrophobicContact CG1-CD1 4.39Å
133	A	96.4	Very high	96	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-58	-53	173.5	0	0	0	0	0	111.1	T129 G130 F135 I136 D137 M242 A291 L330 L349	T129-A133 PolarHBondContact O-N 2.83Å; G130-A133 PolarHBondContact O-N 3Å; A133-F135 VanDerWaalsContact C-N 3.33Å; A133-F135 PolarHBondContact O-N 2.82Å; A133-I136 PolarHBondContact O-N 2.83Å; A133-D137 PolarHBondContact O-N 2.86Å; A133-M242 HydrophobicContact CB-CE 3.72Å; A133-M242 HydrophobicContact CB-SD 4.18Å; A133-A291 HydrophobicContact CB-CB 3.94Å; A133-L330 HydrophobicContact CB-CD1 3.84Å; A133-L330 HydrophobicContact CB-CD2 4.16Å; A133-L349 HydrophobicContact CB-CD1 4Å; A133-L349 HydrophobicContact CB-CD2 4.15Å; A133-L349 HydrophobicContact CB-CG 4.16Å
134	C	95.8	Very high	95.7	Very high	10 Å²	10	37.4 Å²	37.4	7%	0.068	19%	0.187	C	C	.	.	H	α-helix	trans	-59	-41	179.1	-175.4	0	0	0	0	112.4	G130 L131 D137 I138 L330 F333	G130-C134 WeakPolarHBondContact O-CB 3.43Å; G130-C134 PolarHBondContact O-N 2.87Å; L131-C134 PolarHBondContact O-N 3.05Å; C134-D137 PolarHBondContact O-N 3.5Å; C134-I138 WeakPolarHBondContact O-CG1 3.35Å; C134-I138 PolarHBondContact O-N 3.12Å; C134-L330 HydrophobicContact CB-CD1 3.83Å; C134-F333 HydrophobicContact CB-CB 4.43Å
135	F	96.6	Very high	95.4	Very high	122 Å²	122	34.6 Å²	34.6	54%	0.535	18%	0.176	S	C	.	.	H	α-helix	trans	-63.2	-43.8	175.3	173.4	-100.9	0	0	0	113	L131 I132 A133 D137 A139 V223 I227	L131-F135 WeakPolarHBondContact O-CB 3.36Å; L131-F135 PolarHBondContact O-N 2.8Å; I132-F135 PolarHBondContact O-N 3.31Å; A133-F135 VanDerWaalsContact C-N 3.33Å; A133-F135 PolarHBondContact O-N 2.82Å; F135-D137 VanDerWaalsContact C-N 3.33Å; F135-A139 WeakPolarHBondContact O-CB 3.48Å; F135-A139 PolarHBondContact O-N 2.96Å; F135-A139 VanDerWaalsContact O-N 3.09Å; F135-V223 HydrophobicContact CD1-CG1 4.12Å; F135-V223 HydrophobicContact CE1-CG1 4.01Å; F135-I227 HydrophobicContact CE1-CD1 3.98Å
136	I	96.1	Very high	95.1	Very high	1 Å²	1	40.2 Å²	40.2	1%	0.005	21%	0.205	C	C	.	.	H	α-helix	trans	-63.6	-42	176.4	-72.4	164.2	0	0	0	110.4	I132 A133 A139 V140 V223 V226 I227 K238 M242	I132-I136 HydrophobicContact CG2-CD1 3.79Å; I132-I136 HydrophobicContact CG2-CG1 4.49Å; I132-I136 WeakPolarHBondContact O-CG1 3.47Å; I132-I136 PolarHBondContact O-N 3.46Å; A133-I136 PolarHBondContact O-N 2.83Å; I136-A139 PolarHBondContact O-N 3.33Å; I136-V140 HydrophobicContact CG2-CG2 4.29Å; I136-V140 WeakPolarHBondContact O-CB 3.47Å; I136-V140 VanDerWaalsContact O-CG2 3.28Å; I136-V140 WeakPolarHBondContact O-CG2 3.44Å; I136-V140 PolarHBondContact O-N 3.24Å; I136-V223 HydrophobicContact CD1-CG1 4.14Å; I136-V223 HydrophobicContact CD1-CG2 4.28Å; I136-V223 HydrophobicContact CG1-CG1 3.89Å; I136-V226 HydrophobicContact CD1-CG1 4.23Å; I136-V226 HydrophobicContact CG2-CG1 4.37Å; I136-I227 HydrophobicContact CG1-CD1 4.31Å; I136-I227 HydrophobicContact CG1-CG1 4.33Å; I136-I227 HydrophobicContact CG2-CG1 4.24Å; I136-K238 HydrophobicContact CG2-CB 4.26Å; I136-K238 HydrophobicContact CG2-CD 4.49Å; I136-M242 HydrophobicContact CD1-SD 3.61Å
137	D	94.2	Very high	94.9	Very high	25 Å²	25	40.9 Å²	40.9	13%	0.134	21%	0.208	C	C	.	.	H	α-helix	trans	-64.2	-53.7	-176.7	-153	40.9	0	0	0	112	A133 C134 F135 A139 V140 E141 K238 L349	A133-D137 PolarHBondContact O-N 2.86Å; C134-D137 PolarHBondContact O-N 3.5Å; F135-D137 VanDerWaalsContact C-N 3.33Å; D137-A139 VanDerWaalsContact C-N 3.29Å; D137-A139 PolarHBondContact O-N 3.44Å; D137-V140 PolarHBondContact O-N 2.85Å; D137-V140 VanDerWaalsContact O-N 3.17Å; D137-E141 WeakPolarHBondContact O-CB 3.29Å; D137-E141 PolarHBondContact O-N 3.38Å; D137-K238 IonicContact OD1-NZ 3.38Å; D137-K238 PolarHBondContact OD1-NZ 2.93Å; D137-L349 HydrophobicContact CB-CD2 3.57Å
138	I	94.6	Very high	94.5	Very high	47 Å²	47	37.6 Å²	37.6	24%	0.241	19%	0.193	C	C	.	.	H	α-helix	trans	-60.2	-40.3	177.9	-66	170.2	0	0	0	110.8	C134 Q142 L334 Y337	C134-I138 WeakPolarHBondContact O-CG1 3.35Å; C134-I138 PolarHBondContact O-N 3.12Å; I138-Q142 HydrophobicContact CG2-CG 4.4Å; I138-Q142 WeakPolarHBondContact O-CB 3.21Å; I138-Q142 VanDerWaalsContact O-CG 3.29Å; I138-Q142 WeakPolarHBondContact O-CG 3.28Å; I138-Q142 PolarHBondContact O-N 3.26Å; I138-Q142 VanDerWaalsContact O-N 3.07Å; I138-L334 HydrophobicContact CG1-CD2 4.38Å; I138-Y337 HydrophobicContact CB-CE2 4.45Å; I138-Y337 HydrophobicContact CD1-CD1 4.19Å; I138-Y337 HydrophobicContact CD1-CD2 3.7Å; I138-Y337 HydrophobicContact CD1-CE2 4.1Å; I138-Y337 HydrophobicContact CD1-CG 3.74Å; I138-Y337 HydrophobicContact CG1-CD1 3.97Å; I138-Y337 HydrophobicContact CG1-CD2 4.03Å; I138-Y337 HydrophobicContact CG1-CE1 3.92Å; I138-Y337 HydrophobicContact CG1-CE2 3.98Å; I138-Y337 HydrophobicContact CG1-CG 4.02Å; I138-Y337 HydrophobicContact CG2-CD2 4.35Å; I138-Y337 HydrophobicContact CG2-CE2 3.69Å
139	A	95.8	Very high	94.1	Very high	21 Å²	21	40.8 Å²	40.8	17%	0.174	21%	0.205	C	C	.	.	H	α-helix	trans	-67.1	-39.4	177.7	0	0	0	0	0	112.6	F135 I136 D137 L143 I227	F135-A139 WeakPolarHBondContact O-CB 3.48Å; F135-A139 PolarHBondContact O-N 2.96Å; F135-A139 VanDerWaalsContact O-N 3.09Å; I136-A139 PolarHBondContact O-N 3.33Å; D137-A139 VanDerWaalsContact C-N 3.29Å; D137-A139 PolarHBondContact O-N 3.44Å; A139-L143 VanDerWaalsContact O-CB 3.29Å; A139-L143 WeakPolarHBondContact O-CB 3.31Å; A139-L143 WeakPolarHBondContact O-CD1 3.37Å; A139-L143 WeakPolarHBondContact O-CG 3.17Å; A139-L143 PolarHBondContact O-N 3.24Å; A139-I227 HydrophobicContact CB-CD1 3.86Å; A139-I227 HydrophobicContact CB-CG1 4.3Å; A139-I227 HydrophobicContact CB-CG2 4.2Å
140	V	94.1	Very high	93.8	Very high	4 Å²	4	44.5 Å²	44.5	2%	0.024	22%	0.224	C	C	.	.	H	α-helix	trans	-69.1	-46.9	175.8	166.7	0	0	0	0	110.9	I136 D137 L143 A144 I227 V230	I136-V140 HydrophobicContact CG2-CG2 4.29Å; I136-V140 WeakPolarHBondContact O-CB 3.47Å; I136-V140 VanDerWaalsContact O-CG2 3.28Å; I136-V140 WeakPolarHBondContact O-CG2 3.44Å; I136-V140 PolarHBondContact O-N 3.24Å; D137-V140 PolarHBondContact O-N 2.85Å; D137-V140 VanDerWaalsContact O-N 3.17Å; V140-L143 PolarHBondContact O-N 3Å; V140-A144 WeakPolarHBondContact O-CB 3.44Å; V140-A144 PolarHBondContact O-N 3.36Å; V140-I227 HydrophobicContact CG2-CB 4.35Å; V140-I227 HydrophobicContact CG2-CG1 4.21Å; V140-I227 HydrophobicContact CG2-CG2 4.23Å; V140-V230 HydrophobicContact CG1-CB 4.41Å; V140-V230 HydrophobicContact CG1-CG1 3.65Å; V140-V230 HydrophobicContact CG2-CB 4.38Å; V140-V230 HydrophobicContact CG2-CG1 4.45Å
141	E	91.1	Very high	93.5	Very high	61 Å²	61	44.5 Å²	44.5	29%	0.285	22%	0.224	S	C	.	.	H	α-helix	trans	-58.6	-52.3	-179.4	-173	-167.8	-126.4	0	0	111.3	D137 L143 G145 Y337 H338	D137-E141 WeakPolarHBondContact O-CB 3.29Å; D137-E141 PolarHBondContact O-N 3.38Å; E141-L143 PolarHBondContact O-N 2.92Å; E141-G145 PolarHBondContact O-N 3.12Å; E141-Y337 WeakPolarHBondContact OE2-CE1 3.27Å; E141-Y337 VanDerWaalsContact OE2-CZ 3.27Å; E141-Y337 PolarHBondContact OE2-OH 2.55Å; E141-H338 IonicContact OE1-CE1 2.92Å
142	Q	93.1	Very high	93.1	Very high	115 Å²	115	44.5 Å²	44.5	54%	0.537	22%	0.222	S	C	.	.	H	α-helix	trans	-63.9	-43.6	-178.3	-70.5	-70.1	-24.8	0	0	112.5	I138 L146 Y337	I138-Q142 HydrophobicContact CG2-CG 4.4Å; I138-Q142 WeakPolarHBondContact O-CB 3.21Å; I138-Q142 VanDerWaalsContact O-CG 3.29Å; I138-Q142 WeakPolarHBondContact O-CG 3.28Å; I138-Q142 PolarHBondContact O-N 3.26Å; I138-Q142 VanDerWaalsContact O-N 3.07Å; Q142-L146 WeakPolarHBondContact O-CB 3.35Å; Q142-L146 PolarHBondContact O-N 3.11Å; Q142-Y337 PolarHBondContact NE2-OH 3.21Å
143	L	94.5	Very high	92.7	Very high	74 Å²	74	48.1 Å²	48.1	39%	0.387	24%	0.238	S	C	.	.	H	α-helix	trans	-74.4	-38	-179.2	-67.7	174.5	0	0	0	112.6	A139 V140 E141 K147 I227 V231	A139-L143 VanDerWaalsContact O-CB 3.29Å; A139-L143 WeakPolarHBondContact O-CB 3.31Å; A139-L143 WeakPolarHBondContact O-CD1 3.37Å; A139-L143 WeakPolarHBondContact O-CG 3.17Å; A139-L143 PolarHBondContact O-N 3.24Å; V140-L143 PolarHBondContact O-N 3Å; E141-L143 PolarHBondContact O-N 2.92Å; L143-K147 WeakPolarHBondContact O-CB 3.45Å; L143-K147 PolarHBondContact O-N 3.16Å; L143-K147 VanDerWaalsContact O-N 3.08Å; L143-I227 HydrophobicContact CD1-CG2 3.9Å; L143-V231 HydrophobicContact CB-CB 4.45Å; L143-V231 HydrophobicContact CB-CG1 3.91Å; L143-V231 HydrophobicContact CB-CG2 3.64Å; L143-V231 HydrophobicContact CD1-CG2 4.36Å
144	A	91.4	Very high	92.3	Very high	5 Å²	5	49.7 Å²	49.7	4%	0.041	25%	0.246	C	C	.	.	H	α-helix	trans	-71	-41.7	175.9	0	0	0	0	0	111.5	V140 K147 Y148	V140-A144 WeakPolarHBondContact O-CB 3.44Å; V140-A144 PolarHBondContact O-N 3.36Å; A144-K147 WeakPolarHBondContact O-CB 3.49Å; A144-K147 PolarHBondContact O-N 2.95Å; A144-Y148 HydrophobicContact CB-CD2 4.3Å; A144-Y148 HydrophobicContact CB-CE2 4.16Å; A144-Y148 WeakPolarHBondContact O-CD2 3.18Å; A144-Y148 PolarHBondContact O-N 3.27Å
145	G	89.9	Confident	92	Very high	13 Å²	13	49.3 Å²	49.3	13%	0.134	24%	0.243	C	C	.	.	H	α-helix	trans	-60.5	-45.4	175.1	0	0	0	0	0	112.1	E141 K147 Y148 K149	E141-G145 PolarHBondContact O-N 3.12Å; G145-K147 VanDerWaalsContact C-N 3.34Å; G145-K147 PolarHBondContact O-N 3.18Å; G145-Y148 PolarHBondContact O-N 2.68Å; G145-K149 WeakPolarHBondContact O-CB 3.21Å; G145-K149 PolarHBondContact O-N 3.32Å
146	L	92	Very high	91.5	Very high	118 Å²	118	46.4 Å²	46.4	62%	0.618	24%	0.236	S	C	*	.	H	α-helix	trans	-58.8	-44.4	172.6	-179.2	63	0	0	0	111.9	Q142 L150	Q142-L146 WeakPolarHBondContact O-CB 3.35Å; Q142-L146 PolarHBondContact O-N 3.11Å; L146-L150 WeakPolarHBondContact O-CB 3.39Å; L146-L150 PolarHBondContact O-N 3.09Å; L146-L150 VanDerWaalsContact O-N 3.08Å
147	K	92.4	Very high	91.1	Very high	13 Å²	13	52.9 Å²	52.9	6%	0.057	26%	0.264	C	S	.	.	H	α-helix	trans	-61.8	-53.2	177.9	-169.1	-165.6	72.2	173.2	0	111.7	L143 A144 G145 L150 I151 L174 N175 V231	L143-K147 WeakPolarHBondContact O-CB 3.45Å; L143-K147 PolarHBondContact O-N 3.16Å; L143-K147 VanDerWaalsContact O-N 3.08Å; A144-K147 WeakPolarHBondContact O-CB 3.49Å; A144-K147 PolarHBondContact O-N 2.95Å; G145-K147 VanDerWaalsContact C-N 3.34Å; G145-K147 PolarHBondContact O-N 3.18Å; K147-L150 PolarHBondContact O-N 3.33Å; K147-I151 HydrophobicContact CD-CD1 4.35Å; K147-I151 HydrophobicContact CG-CD1 3.84Å; K147-I151 WeakPolarHBondContact O-CD1 3.46Å; K147-I151 VanDerWaalsContact O-CG1 3.27Å; K147-I151 WeakPolarHBondContact O-CG1 3.48Å; K147-I151 PolarHBondContact O-N 3.4Å; K147-L174 HydrophobicContact CG-CB 4.3Å; K147-L174 HydrophobicContact CG-CD1 4.24Å; K147-N175 PolarHBondContact NZ-OD1 2.78Å; K147-V231 WeakPolarHBondContact CD-O 3.49Å; K147-V231 WeakPolarHBondContact CE-O 3.4Å; K147-V231 PolarHBondContact NZ-O 3.16Å
148	Y	89.7	Confident	90.7	Very high	19 Å²	19	53.6 Å²	53.6	8%	0.075	27%	0.266	C	S	.	.	H	α-helix	trans	-69.5	-34.9	-176.5	-68.7	-53.7	0	0	0	112.6	A144 G145 I151 K152 F460	A144-Y148 HydrophobicContact CB-CD2 4.3Å; A144-Y148 HydrophobicContact CB-CE2 4.16Å; A144-Y148 WeakPolarHBondContact O-CD2 3.18Å; A144-Y148 PolarHBondContact O-N 3.27Å; G145-Y148 PolarHBondContact O-N 2.68Å; Y148-I151 PolarHBondContact O-N 3.06Å; Y148-K152 VanDerWaalsContact O-CB 3.25Å; Y148-K152 WeakPolarHBondContact O-CB 3.46Å; Y148-K152 PolarHBondContact O-N 3.48Å; Y148-F460 AromaticContact CD1-CD1 3.69Å; Y148-F460 HydrophobicContact CD1-CD1 3.69Å; Y148-F460 HydrophobicContact CD1-CE1 4.07Å; Y148-F460 HydrophobicContact CD1-CG 4.42Å; Y148-F460 HydrophobicContact CE1-CD1 4.39Å; Y148-F460 HydrophobicContact CG-CD1 4.41Å
149	K	90.1	Very high	90.3	Very high	118 Å²	118	53.7 Å²	53.7	51%	0.513	27%	0.269	S	S	.	.	H	α-helix	trans	-59.6	-51.3	170.8	-179.5	172.3	176.1	174.3	0	111.7	G145 I151 K152 E153	G145-K149 WeakPolarHBondContact O-CB 3.21Å; G145-K149 PolarHBondContact O-N 3.32Å; K149-I151 VanDerWaalsContact C-N 3.32Å; K149-I151 PolarHBondContact O-N 3.36Å; K149-K152 PolarHBondContact O-N 3.12Å; K149-E153 WeakPolarHBondContact CE-OE1 3.48Å; K149-E153 HydrophobicContact CG-CG 4.47Å; K149-E153 WeakPolarHBondContact CG-OE1 3.27Å; K149-E153 IonicContact NZ-OE1 3.29Å; K149-E153 WeakPolarHBondContact O-CG 3.18Å; K149-E153 PolarHBondContact O-N 2.86Å
150	L	91.2	Very high	89.5	Confident	79 Å²	79	61 Å²	61	41%	0.414	30%	0.299	S	S	.	.	H	α-helix	trans	-59.8	-41.5	179.2	179.6	63.2	0	0	0	112.1	L146 K147 N154 L174	L146-L150 WeakPolarHBondContact O-CB 3.39Å; L146-L150 PolarHBondContact O-N 3.09Å; L146-L150 VanDerWaalsContact O-N 3.08Å; K147-L150 PolarHBondContact O-N 3.33Å; L150-N154 WeakPolarHBondContact O-CB 3.33Å; L150-N154 PolarHBondContact O-N 3.08Å; L150-L174 HydrophobicContact CD2-CD1 4.15Å
151	I	90.1	Very high	88.9	Confident	0 Å²	0	64.6 Å²	64.6	0%	0	33%	0.329	C	S	.	.	H	α-helix	trans	-68.4	-43.6	177	-62	161.4	0	0	0	110.8	K147 Y148 K149 N154 I155 W171 L174 F460	K147-I151 HydrophobicContact CD-CD1 4.35Å; K147-I151 HydrophobicContact CG-CD1 3.84Å; K147-I151 WeakPolarHBondContact O-CD1 3.46Å; K147-I151 VanDerWaalsContact O-CG1 3.27Å; K147-I151 WeakPolarHBondContact O-CG1 3.48Å; K147-I151 PolarHBondContact O-N 3.4Å; Y148-I151 PolarHBondContact O-N 3.06Å; K149-I151 VanDerWaalsContact C-N 3.32Å; K149-I151 PolarHBondContact O-N 3.36Å; I151-N154 PolarHBondContact O-N 3.25Å; I151-I155 HydrophobicContact CG2-CD1 3.74Å; I151-I155 HydrophobicContact CG2-CG1 4.23Å; I151-I155 WeakPolarHBondContact O-CG1 3.14Å; I151-I155 PolarHBondContact O-N 2.88Å; I151-W171 HydrophobicContact CD1-CB 4.18Å; I151-W171 VanDerWaalsContact CD1-CD1 3.47Å; I151-W171 HydrophobicContact CD1-CG 3.84Å; I151-W171 HydrophobicContact CG1-CB 4.47Å; I151-W171 HydrophobicContact CG2-CB 4.35Å; I151-W171 HydrophobicContact CG2-CG 4.44Å; I151-L174 HydrophobicContact CD1-CD1 4.07Å; I151-L174 HydrophobicContact CG1-CD1 3.75Å; I151-F460 HydrophobicContact CB-CE1 4.11Å; I151-F460 HydrophobicContact CB-CZ 4.49Å; I151-F460 HydrophobicContact CG2-CE1 3.68Å; I151-F460 HydrophobicContact CG2-CZ 3.58Å
152	K	88.3	Confident	88.4	Confident	57 Å²	57	63.6 Å²	63.6	25%	0.248	34%	0.336	C	S	.	.	H	α-helix	trans	-60.4	-49.1	178	172.1	170.4	167	168.6	0	111.9	Y148 K149 N154 I155 V156 P442 L443	Y148-K152 VanDerWaalsContact O-CB 3.25Å; Y148-K152 WeakPolarHBondContact O-CB 3.46Å; Y148-K152 PolarHBondContact O-N 3.48Å; K149-K152 PolarHBondContact O-N 3.12Å; K152-N154 VanDerWaalsContact C-N 3.25Å; K152-N154 PolarHBondContact O-N 3.13Å; K152-I155 PolarHBondContact O-N 3.22Å; K152-V156 WeakPolarHBondContact O-CG2 3.14Å; K152-V156 PolarHBondContact O-N 3.04Å; K152-P442 VanDerWaalsContact CE-O 3.24Å; K152-P442 WeakPolarHBondContact CE-O 3.22Å; K152-P442 PolarHBondContact NZ-O 3.46Å; K152-L443 HydrophobicContact CG-CD1 4.2Å
153	E	88.7	Confident	88	Confident	108 Å²	108	59.9 Å²	59.9	51%	0.505	33%	0.328	S	S	.	.	H	α-helix	trans	-57.4	-39.9	176.6	-73.1	174.9	-176.6	0	0	111.5	K149 K157	K149-E153 WeakPolarHBondContact CE-OE1 3.48Å; K149-E153 HydrophobicContact CG-CG 4.47Å; K149-E153 WeakPolarHBondContact CG-OE1 3.27Å; K149-E153 IonicContact NZ-OE1 3.29Å; K149-E153 WeakPolarHBondContact O-CG 3.18Å; K149-E153 PolarHBondContact O-N 2.86Å; E153-K157 WeakPolarHBondContact O-CB 3.41Å; E153-K157 PolarHBondContact O-N 3.48Å
154	N	89.9	Confident	87.7	Confident	34 Å²	34	57.5 Å²	57.5	18%	0.182	32%	0.316	C	S	.	.	H	α-helix	trans	-73.2	-37	178.2	-157.9	76.5	0	0	0	113	L150 I151 K152 F158 S167 L170	L150-N154 WeakPolarHBondContact O-CB 3.33Å; L150-N154 PolarHBondContact O-N 3.08Å; I151-N154 PolarHBondContact O-N 3.25Å; K152-N154 VanDerWaalsContact C-N 3.25Å; K152-N154 PolarHBondContact O-N 3.13Å; N154-F158 WeakPolarHBondContact ND2-CD2 3.4Å; N154-F158 VanDerWaalsContact O-CD2 3.28Å; N154-F158 WeakPolarHBondContact O-CD2 3.37Å; N154-F158 PolarHBondContact O-N 3.3Å; N154-F158 VanDerWaalsContact O-N 3.12Å; N154-F158 WeakPolarHBondContact OD1-CE2 3.23Å; N154-S167 WeakPolarHBondContact ND2-CA 3.47Å; N154-S167 PolarHBondContact ND2-OG 3.42Å; N154-S167 PolarHBondContact O-OG 2.9Å; N154-S167 VanDerWaalsContact O-OG 3.14Å; N154-L170 HydrophobicContact CB-CD2 3.78Å
155	I	87.7	Confident	87.6	Confident	1 Å²	1	61 Å²	61	1%	0.005	34%	0.339	C	S	.	.	H	α-helix	trans	-63.7	-51.4	174.6	-70.5	171	0	0	0	110.7	I151 K152 K157 F158 T159 L164 F421 L443 L445 F460	I151-I155 HydrophobicContact CG2-CD1 3.74Å; I151-I155 HydrophobicContact CG2-CG1 4.23Å; I151-I155 WeakPolarHBondContact O-CG1 3.14Å; I151-I155 PolarHBondContact O-N 2.88Å; K152-I155 PolarHBondContact O-N 3.22Å; I155-K157 VanDerWaalsContact C-N 3.33Å; I155-K157 PolarHBondContact O-N 3.48Å; I155-F158 CarbonylContact O-C 3.46Å; I155-F158 PolarHBondContact O-N 3.29Å; I155-T159 PolarHBondContact O-N 3.15Å; I155-T159 PolarHBondContact O-OG1 3.38Å; I155-L164 HydrophobicContact CG2-CD2 4.23Å; I155-F421 HydrophobicContact CD1-CE2 4.26Å; I155-F421 HydrophobicContact CG1-CE2 4.46Å; I155-L443 HydrophobicContact CB-CD1 4.21Å; I155-L443 HydrophobicContact CD1-CD1 4.34Å; I155-L443 HydrophobicContact CD1-CD2 4.12Å; I155-L443 HydrophobicContact CG2-CD1 3.93Å; I155-L443 HydrophobicContact CG2-CD2 4.49Å; I155-L445 HydrophobicContact CG2-CD1 4.11Å; I155-F460 HydrophobicContact CD1-CE1 4.39Å; I155-F460 HydrophobicContact CD1-CE2 4.32Å; I155-F460 HydrophobicContact CD1-CZ 3.63Å
156	V	85.9	Confident	87.6	Confident	61 Å²	61	64.3 Å²	64.3	37%	0.37	35%	0.354	S	S	.	.	H	α-helix	trans	-56.4	-49.4	-179.3	173	0	0	0	0	110.3	K152 F158 T159 E160	K152-V156 WeakPolarHBondContact O-CG2 3.14Å; K152-V156 PolarHBondContact O-N 3.04Å; V156-F158 PolarHBondContact O-N 3.41Å; V156-T159 WeakPolarHBondContact O-CB 3.44Å; V156-T159 PolarHBondContact O-N 3.15Å; V156-T159 VanDerWaalsContact O-N 3.09Å; V156-E160 PolarHBondContact O-N 2.89Å
157	K	87.9	Confident	87.5	Confident	137 Å²	137	58.7 Å²	58.7	60%	0.596	32%	0.324	S	S	*	.	H	α-helix	trans	-57.8	-40.6	178.1	-176.4	178.4	178.6	-179.5	0	114.1	E153 I155 A161	E153-K157 WeakPolarHBondContact O-CB 3.41Å; E153-K157 PolarHBondContact O-N 3.48Å; I155-K157 VanDerWaalsContact C-N 3.33Å; I155-K157 PolarHBondContact O-N 3.48Å; K157-A161 WeakPolarHBondContact O-CB 3.41Å; K157-A161 PolarHBondContact O-N 3.38Å
158	F	87.4	Confident	87.5	Confident	41 Å²	41	60 Å²	60	18%	0.18	33%	0.332	C	S	.	.	H	α-helix	trans	-88.9	-1.5	178.9	-73.5	-60.7	0	0	0	114.2	N154 I155 V156 G162 I166	N154-F158 WeakPolarHBondContact ND2-CD2 3.4Å; N154-F158 VanDerWaalsContact O-CD2 3.28Å; N154-F158 WeakPolarHBondContact O-CD2 3.37Å; N154-F158 PolarHBondContact O-N 3.3Å; N154-F158 VanDerWaalsContact O-N 3.12Å; N154-F158 WeakPolarHBondContact OD1-CE2 3.23Å; I155-F158 CarbonylContact O-C 3.46Å; I155-F158 PolarHBondContact O-N 3.29Å; V156-F158 PolarHBondContact O-N 3.41Å; F158-G162 WeakPolarHBondContact CD1-O 3.21Å; F158-G162 CarbonylContact O-C 3.49Å; F158-G162 VanDerWaalsContact O-C 3.28Å; F158-G162 VanDerWaalsContact O-CA 3.29Å; F158-G162 WeakPolarHBondContact O-CA 3.31Å; F158-G162 PolarHBondContact O-N 3.37Å; F158-I166 HydrophobicContact CD2-CB 4.3Å; F158-I166 HydrophobicContact CD2-CG2 4.35Å; F158-I166 HydrophobicContact CE1-CD1 3.85Å; F158-I166 HydrophobicContact CE2-CB 4.03Å; F158-I166 HydrophobicContact CE2-CD1 4.44Å; F158-I166 HydrophobicContact CE2-CG2 3.67Å; F158-I166 HydrophobicContact CZ-CB 4.27Å; F158-I166 HydrophobicContact CZ-CD1 3.81Å; F158-I166 HydrophobicContact CZ-CG2 3.98Å
159	T	84.4	Confident	87.7	Confident	49 Å²	49	64.9 Å²	64.9	30%	0.301	36%	0.358	S	S	.	.	H	α-helix	trans	-75.2	-47.5	167	-57	0	0	0	0	109.7	I155 V156 L445	I155-T159 PolarHBondContact O-N 3.15Å; I155-T159 PolarHBondContact O-OG1 3.38Å; V156-T159 WeakPolarHBondContact O-CB 3.44Å; V156-T159 PolarHBondContact O-N 3.15Å; V156-T159 VanDerWaalsContact O-N 3.09Å; T159-L445 HydrophobicContact CG2-CD1 4.17Å; T159-L445 WeakPolarHBondContact OG1-CD1 3.25Å
160	E	80.7	Confident	87.9	Confident	173 Å²	173	61.5 Å²	61.5	81%	0.808	35%	0.345	S	S	*	.	H	α-helix	trans	-71.2	-47.2	176.8	-65.8	177.1	-171.8	0	0	112.8	V156 G162	V156-E160 PolarHBondContact O-N 2.89Å; E160-G162 VanDerWaalsContact C-N 3.31Å; E160-G162 PolarHBondContact O-N 3.26Å
161	A	81.6	Confident	88.1	Confident	80 Å²	80	58 Å²	58	66%	0.661	33%	0.327	S	S	*	.	S	Bend	trans	-80	-11.3	-175.7	0	0	0	0	0	114.1	K157	K157-A161 WeakPolarHBondContact O-CB 3.41Å; K157-A161 PolarHBondContact O-N 3.38Å
162	G	80.4	Confident	88.3	Confident	41 Å²	41	59.4 Å²	59.4	42%	0.423	34%	0.335	S	S	.	.	S	Bend	trans	70.3	161.4	-164.4	0	0	0	0	0	113	F158 E160	F158-G162 WeakPolarHBondContact CD1-O 3.21Å; F158-G162 CarbonylContact O-C 3.49Å; F158-G162 VanDerWaalsContact O-C 3.28Å; F158-G162 VanDerWaalsContact O-CA 3.29Å; F158-G162 WeakPolarHBondContact O-CA 3.31Å; F158-G162 PolarHBondContact O-N 3.37Å; E160-G162 VanDerWaalsContact C-N 3.31Å; E160-G162 PolarHBondContact O-N 3.26Å
163	G	84.6	Confident	88.7	Confident	36 Å²	36	59.5 Å²	59.5	37%	0.371	35%	0.347	S	S	.	.			trans	103.6	28.2	179.5	0	0	0	0	0	115.7	S165 I166	G163-S165 PolarHBondContact O-N 3.34Å; G163-I166 WeakPolarHBondContact O-CB 3.21Å; G163-I166 PolarHBondContact O-N 3.25Å
164	L	87.3	Confident	89	Confident	25 Å²	25	56.4 Å²	56.4	13%	0.131	33%	0.333	C	S	.	.	T	Hydrogen-bonded Turn	trans	-47.5	-22.7	176.7	-76.9	168.4	0	0	0	115.8	I155 I166 S167 L168 F421 Y425 L445 F446	I155-L164 HydrophobicContact CG2-CD2 4.23Å; L164-I166 PolarHBondContact O-N 2.81Å; L164-S167 WeakPolarHBondContact O-CB 3.45Å; L164-S167 PolarHBondContact O-N 3.47Å; L164-S167 VanDerWaalsContact O-N 3.13Å; L164-L168 PolarHBondContact O-N 3.19Å; L164-L168 VanDerWaalsContact O-N 3.14Å; L164-F421 HydrophobicContact CB-CZ 4.21Å; L164-F421 HydrophobicContact CD2-CZ 4.48Å; L164-Y425 HydrophobicContact CD1-CD2 4.32Å; L164-Y425 HydrophobicContact CD1-CE2 4.01Å; L164-L445 HydrophobicContact CD1-CD1 4.17Å; L164-L445 HydrophobicContact CD2-CD1 4.04Å; L164-F446 HydrophobicContact CD1-CE2 4.35Å; L164-F446 HydrophobicContact CD1-CZ 3.74Å
165	S	88.8	Confident	89.3	Confident	77 Å²	77	54.9 Å²	54.9	54%	0.538	33%	0.325	S	S	.	.	H	α-helix	trans	-59.7	-28.6	171.9	52.4	0	0	0	0	113.6	G163 L168 L169	G163-S165 PolarHBondContact O-N 3.34Å; S165-L168 PolarHBondContact O-N 3.4Å; S165-L169 WeakPolarHBondContact O-CG 3.43Å; S165-L169 PolarHBondContact O-N 3.44Å
166	I	90.6	Very high	89.7	Confident	84 Å²	84	55.6 Å²	55.6	43%	0.431	33%	0.33	S	S	.	.	H	α-helix	trans	-68	-40.1	174.7	-60.5	172.5	0	0	0	110.2	F158 G163 L164 L169 L170	F158-I166 HydrophobicContact CD2-CB 4.3Å; F158-I166 HydrophobicContact CD2-CG2 4.35Å; F158-I166 HydrophobicContact CE1-CD1 3.85Å; F158-I166 HydrophobicContact CE2-CB 4.03Å; F158-I166 HydrophobicContact CE2-CD1 4.44Å; F158-I166 HydrophobicContact CE2-CG2 3.67Å; F158-I166 HydrophobicContact CZ-CB 4.27Å; F158-I166 HydrophobicContact CZ-CD1 3.81Å; F158-I166 HydrophobicContact CZ-CG2 3.98Å; G163-I166 WeakPolarHBondContact O-CB 3.21Å; G163-I166 PolarHBondContact O-N 3.25Å; L164-I166 PolarHBondContact O-N 2.81Å; I166-L169 PolarHBondContact O-N 3.5Å; I166-L170 WeakPolarHBondContact O-CB 3.4Å; I166-L170 PolarHBondContact O-N 2.76Å
167	S	90.5	Very high	90.2	Very high	0 Å²	0	58 Å²	58	0%	0	34%	0.336	C	S	.	.	H	α-helix	trans	-67.1	-37	175.7	-61.3	0	0	0	0	112.6	N154 L164 L170 W171	N154-S167 WeakPolarHBondContact ND2-CA 3.47Å; N154-S167 PolarHBondContact ND2-OG 3.42Å; N154-S167 PolarHBondContact O-OG 2.9Å; N154-S167 VanDerWaalsContact O-OG 3.14Å; L164-S167 WeakPolarHBondContact O-CB 3.45Å; L164-S167 PolarHBondContact O-N 3.47Å; L164-S167 VanDerWaalsContact O-N 3.13Å; S167-L170 PolarHBondContact O-N 2.72Å; S167-W171 PolarHBondContact O-N 3.43Å
168	L	92.4	Very high	90.6	Very high	41 Å²	41	52.4 Å²	52.4	22%	0.215	31%	0.313	C	S	.	.	H	α-helix	trans	-61.3	-48.9	170.8	173.6	58.2	0	0	0	111.7	L164 S165 L170 W171 V172 T418 F421	L164-L168 PolarHBondContact O-N 3.19Å; L164-L168 VanDerWaalsContact O-N 3.14Å; S165-L168 PolarHBondContact O-N 3.4Å; L168-L170 VanDerWaalsContact C-N 3.32Å; L168-L170 PolarHBondContact O-N 3.13Å; L168-W171 PolarHBondContact O-N 2.77Å; L168-V172 HydrophobicContact CD1-CG2 4.11Å; L168-V172 WeakPolarHBondContact O-CG2 3.29Å; L168-V172 PolarHBondContact O-N 2.77Å; L168-T418 HydrophobicContact CD1-CG2 4Å; L168-F421 HydrophobicContact CB-CD1 4.03Å; L168-F421 HydrophobicContact CB-CE1 4.05Å; L168-F421 HydrophobicContact CB-CG 4.3Å; L168-F421 HydrophobicContact CB-CZ 4.33Å; L168-F421 HydrophobicContact CD1-CB 3.76Å; L168-F421 HydrophobicContact CD1-CD1 3.99Å; L168-F421 HydrophobicContact CD1-CG 3.88Å; L168-F421 HydrophobicContact CD2-CD1 4.19Å; L168-F421 HydrophobicContact CG-CD1 4.3Å
169	L	94.2	Very high	91	Very high	120 Å²	120	50.4 Å²	50.4	63%	0.628	31%	0.305	S	S	*	.	H	α-helix	trans	-61.6	-38.9	177.9	-72.9	171	0	0	0	112.2	S165 I166 A173	S165-L169 WeakPolarHBondContact O-CG 3.43Å; S165-L169 PolarHBondContact O-N 3.44Å; I166-L169 PolarHBondContact O-N 3.5Å; L169-A173 VanDerWaalsContact O-CB 3.26Å; L169-A173 WeakPolarHBondContact O-CB 3.49Å; L169-A173 PolarHBondContact O-N 3.42Å
170	L	94.1	Very high	91.6	Very high	47 Å²	47	50.6 Å²	50.6	25%	0.246	30%	0.303	C	S	.	.	H	α-helix	trans	-62.7	-46.5	174.7	179.3	62.4	0	0	0	111.8	N154 I166 S167 L168 A173 L174	N154-L170 HydrophobicContact CB-CD2 3.78Å; I166-L170 WeakPolarHBondContact O-CB 3.4Å; I166-L170 PolarHBondContact O-N 2.76Å; S167-L170 PolarHBondContact O-N 2.72Å; L168-L170 VanDerWaalsContact C-N 3.32Å; L168-L170 PolarHBondContact O-N 3.13Å; L170-A173 PolarHBondContact O-N 2.79Å; L170-L174 HydrophobicContact CD1-CD1 3.96Å; L170-L174 HydrophobicContact CD1-CG 4.16Å; L170-L174 HydrophobicContact CG-CD1 3.94Å; L170-L174 WeakPolarHBondContact O-CB 3.36Å; L170-L174 VanDerWaalsContact O-CG 3.29Å; L170-L174 WeakPolarHBondContact O-CG 3.48Å; L170-L174 PolarHBondContact O-N 3.05Å
171	W	94.3	Very high	92.4	Very high	6 Å²	6	48 Å²	48	2%	0.023	29%	0.286	C	S	.	.	H	α-helix	trans	-63.9	-45.3	179.3	-171.4	6.4	0	0	0	111.8	I151 S167 L168 A173 L174 N175 A417 A420 F421 I424 F460	I151-W171 HydrophobicContact CD1-CB 4.18Å; I151-W171 VanDerWaalsContact CD1-CD1 3.47Å; I151-W171 HydrophobicContact CD1-CG 3.84Å; I151-W171 HydrophobicContact CG1-CB 4.47Å; I151-W171 HydrophobicContact CG2-CB 4.35Å; I151-W171 HydrophobicContact CG2-CG 4.44Å; S167-W171 PolarHBondContact O-N 3.43Å; L168-W171 PolarHBondContact O-N 2.77Å; W171-A173 PolarHBondContact O-N 3.25Å; W171-L174 PolarHBondContact O-N 3.29Å; W171-N175 WeakPolarHBondContact O-CB 3.35Å; W171-N175 PolarHBondContact O-N 2.96Å; W171-A417 HydrophobicContact CD2-CB 4.16Å; W171-A417 HydrophobicContact CG-CB 4.09Å; W171-A420 HydrophobicContact CH2-CB 3.5Å; W171-A420 VanDerWaalsContact CH2-CB 3.5Å; W171-A420 HydrophobicContact CZ2-CB 4.08Å; W171-A420 HydrophobicContact CZ3-CB 4.15Å; W171-F421 HydrophobicContact CE3-CB 3.93Å; W171-F421 AromaticContact CE3-CD2 3.94Å; W171-F421 HydrophobicContact CE3-CD2 3.94Å; W171-F421 HydrophobicContact CE3-CG 4.41Å; W171-F421 HydrophobicContact CZ3-CB 3.75Å; W171-F421 HydrophobicContact CZ3-CD2 4.05Å; W171-F421 HydrophobicContact CZ3-CG 4.43Å; W171-I424 HydrophobicContact CH2-CD1 4.23Å; W171-I424 HydrophobicContact CZ3-CD1 4.35Å; W171-F460 HydrophobicContact CE3-CE2 4.21Å; W171-F460 HydrophobicContact CE3-CZ 4.22Å; W171-F460 AromaticContact CH2-CD2 3.95Å; W171-F460 HydrophobicContact CH2-CD2 3.95Å; W171-F460 AromaticContact CH2-CE2 3.38Å; W171-F460 HydrophobicContact CH2-CE2 3.38Å; W171-F460 HydrophobicContact CH2-CZ 4.04Å; W171-F460 HydrophobicContact CZ2-CD2 4.44Å; W171-F460 HydrophobicContact CZ2-CE2 4Å; W171-F460 HydrophobicContact CZ2-CZ 4.35Å; W171-F460 HydrophobicContact CZ3-CD2 4.47Å; W171-F460 AromaticContact CZ3-CE2 3.51Å; W171-F460 HydrophobicContact CZ3-CE2 3.51Å; W171-F460 AromaticContact CZ3-CZ 3.98Å; W171-F460 HydrophobicContact CZ3-CZ 3.98Å
172	V	95.7	Very high	93	Very high	30 Å²	30	44.2 Å²	44.2	18%	0.182	25%	0.254	C	S	.	.	H	α-helix	trans	-57.7	-48.4	174	168.8	0	0	0	0	111	L168 L174 N175 S176 A414 A417 T418	L168-V172 HydrophobicContact CD1-CG2 4.11Å; L168-V172 WeakPolarHBondContact O-CG2 3.29Å; L168-V172 PolarHBondContact O-N 2.77Å; V172-L174 PolarHBondContact O-N 3.36Å; V172-N175 PolarHBondContact O-N 2.85Å; V172-S176 WeakPolarHBondContact O-CB 3.38Å; V172-S176 PolarHBondContact O-N 2.75Å; V172-S176 PolarHBondContact O-OG 3.37Å; V172-A414 HydrophobicContact CG1-CB 3.77Å; V172-A417 HydrophobicContact CG2-CB 3.94Å; V172-T418 HydrophobicContact CG2-CG2 3.71Å
173	A	95.8	Very high	93.8	Very high	59 Å²	59	42.2 Å²	42.2	49%	0.488	23%	0.234	S	C	.	.	H	α-helix	trans	-61.1	-43.7	-180	0	0	0	0	0	112.6	L169 L170 W171 F177	L169-A173 VanDerWaalsContact O-CB 3.26Å; L169-A173 WeakPolarHBondContact O-CB 3.49Å; L169-A173 PolarHBondContact O-N 3.42Å; L170-A173 PolarHBondContact O-N 2.79Å; W171-A173 PolarHBondContact O-N 3.25Å; A173-F177 WeakPolarHBondContact O-CB 3.17Å; A173-F177 PolarHBondContact O-N 3.06Å
174	L	95.2	Very high	94.4	Very high	43 Å²	43	43.2 Å²	43.2	23%	0.225	23%	0.23	C	C	.	.	H	α-helix	trans	-65.2	-49.1	178.4	-70.8	169	0	0	0	111.9	K147 L150 I151 L170 W171 V172 F177 C178	K147-L174 HydrophobicContact CG-CB 4.3Å; K147-L174 HydrophobicContact CG-CD1 4.24Å; L150-L174 HydrophobicContact CD2-CD1 4.15Å; I151-L174 HydrophobicContact CD1-CD1 4.07Å; I151-L174 HydrophobicContact CG1-CD1 3.75Å; L170-L174 HydrophobicContact CD1-CD1 3.96Å; L170-L174 HydrophobicContact CD1-CG 4.16Å; L170-L174 HydrophobicContact CG-CD1 3.94Å; L170-L174 WeakPolarHBondContact O-CB 3.36Å; L170-L174 VanDerWaalsContact O-CG 3.29Å; L170-L174 WeakPolarHBondContact O-CG 3.48Å; L170-L174 PolarHBondContact O-N 3.05Å; W171-L174 PolarHBondContact O-N 3.29Å; V172-L174 PolarHBondContact O-N 3.36Å; L174-F177 PolarHBondContact O-N 3.03Å; L174-C178 PolarHBondContact O-N 3.47Å
175	N	95.7	Very high	94.8	Very high	2 Å²	2	43.4 Å²	43.4	1%	0.011	23%	0.231	C	C	.	.	H	α-helix	trans	-60.7	-51.9	177.9	-87.1	15.2	0	0	0	111	K147 W171 V172 F177 C178 V179 G232 A413	K147-N175 PolarHBondContact NZ-OD1 2.78Å; W171-N175 WeakPolarHBondContact O-CB 3.35Å; W171-N175 PolarHBondContact O-N 2.96Å; V172-N175 PolarHBondContact O-N 2.85Å; N175-F177 VanDerWaalsContact C-N 3.34Å; N175-F177 PolarHBondContact O-N 3.29Å; N175-C178 PolarHBondContact O-N 2.84Å; N175-V179 WeakPolarHBondContact O-CG2 3.42Å; N175-V179 PolarHBondContact O-N 3.01Å; N175-G232 VanDerWaalsContact CB-O 3.24Å; N175-G232 WeakPolarHBondContact CB-O 3.08Å; N175-G232 PolarHBondContact ND2-O 2.85Å; N175-G232 PolarHBondContact OD1-O 2.66Å; N175-A413 HydrophobicContact CB-CB 4.44Å
176	S	96.2	Very high	95.2	Very high	15 Å²	15	39.8 Å²	39.8	11%	0.105	21%	0.206	C	C	.	.	H	α-helix	trans	-65.1	-32.4	-179.5	-64.6	0	0	0	0	113.2	V172 M180 M410	V172-S176 WeakPolarHBondContact O-CB 3.38Å; V172-S176 PolarHBondContact O-N 2.75Å; V172-S176 PolarHBondContact O-OG 3.37Å; S176-M180 WeakPolarHBondContact O-CB 3.47Å; S176-M180 PolarHBondContact O-N 2.72Å; S176-M410 PolarHBondContact OG-O 3.47Å
177	F	96.2	Very high	95.4	Very high	113 Å²	113	36.3 Å²	36.3	50%	0.496	19%	0.189	S	C	.	.	H	α-helix	trans	-64.7	-47.9	174.6	175.7	-96.8	0	0	0	112.1	A173 L174 N175 M180 W181	A173-F177 WeakPolarHBondContact O-CB 3.17Å; A173-F177 PolarHBondContact O-N 3.06Å; L174-F177 PolarHBondContact O-N 3.03Å; N175-F177 VanDerWaalsContact C-N 3.34Å; N175-F177 PolarHBondContact O-N 3.29Å; F177-M180 HydrophobicContact CD2-CE 4.08Å; F177-M180 HydrophobicContact CE2-CE 4.48Å; F177-M180 PolarHBondContact O-N 3.23Å; F177-W181 AromaticContact CE1-CD1 3.9Å; F177-W181 AromaticContact CE2-CD1 3.86Å; F177-W181 AromaticContact CE2-NE1 3.37Å; F177-W181 AromaticContact CZ-CD1 3.68Å; F177-W181 AromaticContact CZ-NE1 3.31Å; F177-W181 VanDerWaalsContact CZ-NE1 3.31Å; F177-W181 PolarHBondContact O-N 3.35Å
178	C	95.9	Very high	95.7	Very high	18 Å²	18	42 Å²	42	12%	0.122	22%	0.215	C	C	.	.	H	α-helix	trans	-62.2	-46.7	176.9	-70.5	0	0	0	0	111.6	L174 N175 M180 W181 G182 F228	L174-C178 PolarHBondContact O-N 3.47Å; N175-C178 PolarHBondContact O-N 2.84Å; C178-M180 PolarHBondContact O-N 3.34Å; C178-W181 PolarHBondContact O-N 3.07Å; C178-G182 PolarHBondContact O-N 3.45Å; C178-F228 HydrophobicContact CB-CD1 4.31Å
179	V	97	Very high	95.8	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-66.7	-35.1	179.9	175.9	0	0	0	0	112.3	N175 W181 G182 S183 L234 A409 A413 V502	N175-V179 WeakPolarHBondContact O-CG2 3.42Å; N175-V179 PolarHBondContact O-N 3.01Å; V179-W181 PolarHBondContact O-N 3.26Å; V179-G182 PolarHBondContact O-N 3.44Å; V179-S183 VanDerWaalsContact O-CB 3.27Å; V179-S183 WeakPolarHBondContact O-CB 3.41Å; V179-S183 PolarHBondContact O-N 2.92Å; V179-L234 HydrophobicContact CG1-CD1 3.94Å; V179-L234 HydrophobicContact CG2-CD1 3.72Å; V179-L234 HydrophobicContact CG2-CD2 4.28Å; V179-L234 HydrophobicContact CG2-CG 3.72Å; V179-A409 HydrophobicContact CG1-CB 3.67Å; V179-A409 WeakPolarHBondContact CG1-O 3.43Å; V179-A413 HydrophobicContact CB-CB 3.89Å; V179-A413 HydrophobicContact CG1-CB 4.19Å; V179-A413 HydrophobicContact CG2-CB 3.66Å; V179-V502 HydrophobicContact CG1-CG1 4.32Å
180	M	97	Very high	95.8	Very high	52 Å²	52	38.6 Å²	38.6	26%	0.256	20%	0.196	S	C	.	.	H	α-helix	trans	-56.5	-49.8	173.2	-179.4	-179.7	67.5	0	0	111.2	S176 F177 C178 S183 I184 V406 M410	S176-M180 WeakPolarHBondContact O-CB 3.47Å; S176-M180 PolarHBondContact O-N 2.72Å; F177-M180 HydrophobicContact CD2-CE 4.08Å; F177-M180 HydrophobicContact CE2-CE 4.48Å; F177-M180 PolarHBondContact O-N 3.23Å; C178-M180 PolarHBondContact O-N 3.34Å; M180-S183 PolarHBondContact O-N 2.88Å; M180-I184 HydrophobicContact CG-CD1 3.68Å; M180-I184 HydrophobicContact CG-CG1 4.44Å; M180-I184 WeakPolarHBondContact O-CB 3.33Å; M180-I184 WeakPolarHBondContact O-CG1 3.23Å; M180-I184 PolarHBondContact O-N 2.89Å; M180-V406 HydrophobicContact CG-CG1 4.24Å; M180-M410 HydrophobicContact CB-CE 4.15Å; M180-M410 HydrophobicContact CB-CG 3.85Å; M180-M410 HydrophobicContact CB-SD 3.75Å; M180-M410 HydrophobicContact CG-CE 4.24Å; M180-M410 HydrophobicContact CG-CG 4.41Å; M180-M410 HydrophobicContact CG-SD 3.69Å; M180-M410 HydrophobicContact SD-CE 3.88Å; M180-M410 HydrophobicContact SD-SD 3.98Å
181	W	96.2	Very high	95.8	Very high	119 Å²	119	39.5 Å²	39.5	45%	0.451	21%	0.205	S	C	.	.	H	α-helix	trans	-64.2	-46.9	177.4	-80.2	106.1	0	0	0	112.5	F177 C178 V179 S183 I184 I185 F228	F177-W181 AromaticContact CE1-CD1 3.9Å; F177-W181 AromaticContact CE2-CD1 3.86Å; F177-W181 AromaticContact CE2-NE1 3.37Å; F177-W181 AromaticContact CZ-CD1 3.68Å; F177-W181 AromaticContact CZ-NE1 3.31Å; F177-W181 VanDerWaalsContact CZ-NE1 3.31Å; F177-W181 PolarHBondContact O-N 3.35Å; C178-W181 PolarHBondContact O-N 3.07Å; V179-W181 PolarHBondContact O-N 3.26Å; W181-S183 VanDerWaalsContact C-N 3.28Å; W181-S183 PolarHBondContact O-N 2.74Å; W181-I184 PolarHBondContact O-N 2.85Å; W181-I185 VanDerWaalsContact O-CG1 3.27Å; W181-I185 WeakPolarHBondContact O-CG1 3.27Å; W181-I185 PolarHBondContact O-N 2.94Å; W181-F228 HydrophobicContact CB-CD1 4.49Å; W181-F228 HydrophobicContact CB-CD2 4.47Å; W181-F228 HydrophobicContact CB-CE2 4.47Å; W181-F228 HydrophobicContact CB-CG 4.49Å; W181-F228 HydrophobicContact CB-CZ 4.5Å
182	G	95.5	Very high	95.7	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-57.7	-40.4	176.5	0	0	0	0	0	112.9	C178 V179 V186	C178-G182 PolarHBondContact O-N 3.45Å; V179-G182 PolarHBondContact O-N 3.44Å; G182-V186 WeakPolarHBondContact O-CG2 3.46Å; G182-V186 PolarHBondContact O-N 3.49Å
183	S	96.7	Very high	95.6	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-78.5	-37.5	-179	-166.9	0	0	0	0	113.5	V179 M180 W181 I185 V186 A187 A501	V179-S183 VanDerWaalsContact O-CB 3.27Å; V179-S183 WeakPolarHBondContact O-CB 3.41Å; V179-S183 PolarHBondContact O-N 2.92Å; M180-S183 PolarHBondContact O-N 2.88Å; W181-S183 VanDerWaalsContact C-N 3.28Å; W181-S183 PolarHBondContact O-N 2.74Å; S183-I185 VanDerWaalsContact C-N 3.3Å; S183-I185 PolarHBondContact O-N 3.15Å; S183-V186 PolarHBondContact O-N 3.48Å; S183-A187 VanDerWaalsContact O-CB 3.25Å; S183-A187 WeakPolarHBondContact O-CB 3.38Å; S183-A187 PolarHBondContact O-N 2.95Å; S183-A501 VanDerWaalsContact CA-O 3.31Å; S183-A501 WeakPolarHBondContact CA-O 3.49Å; S183-A501 WeakPolarHBondContact CB-O 3.49Å; S183-A501 PolarHBondContact OG-O 2.81Å
184	I	97.2	Very high	95.5	Very high	56 Å²	56	38.1 Å²	38.1	29%	0.287	19%	0.193	S	C	.	.	H	α-helix	trans	-57.7	-45.4	175.3	-75.2	167.3	0	0	0	110.7	M180 W181 F188 V406	M180-I184 HydrophobicContact CG-CD1 3.68Å; M180-I184 HydrophobicContact CG-CG1 4.44Å; M180-I184 WeakPolarHBondContact O-CB 3.33Å; M180-I184 WeakPolarHBondContact O-CG1 3.23Å; M180-I184 PolarHBondContact O-N 2.89Å; W181-I184 PolarHBondContact O-N 2.85Å; I184-F188 HydrophobicContact CG2-CD2 4.33Å; I184-F188 WeakPolarHBondContact O-CB 3.47Å; I184-F188 PolarHBondContact O-N 2.72Å; I184-V406 HydrophobicContact CG1-CG1 3.97Å; I184-V406 HydrophobicContact CG1-CG2 3.95Å
185	I	96.4	Very high	95.5	Very high	29 Å²	29	36.8 Å²	36.8	15%	0.149	19%	0.189	C	C	.	.	I	π-helix	trans	-63.8	-43.7	-179.7	-60.5	169.4	0	0	0	110.1	W181 S183 I189 E190 V221 V224	W181-I185 VanDerWaalsContact O-CG1 3.27Å; W181-I185 WeakPolarHBondContact O-CG1 3.27Å; W181-I185 PolarHBondContact O-N 2.94Å; S183-I185 VanDerWaalsContact C-N 3.3Å; S183-I185 PolarHBondContact O-N 3.15Å; I185-I189 HydrophobicContact CG2-CD1 4.18Å; I185-I189 WeakPolarHBondContact O-CA 3.44Å; I185-I189 WeakPolarHBondContact O-CB 3.33Å; I185-I189 PolarHBondContact O-N 2.9Å; I185-I189 VanDerWaalsContact O-N 3.13Å; I185-E190 PolarHBondContact O-N 3.18Å; I185-V221 HydrophobicContact CG2-CB 4.15Å; I185-V221 HydrophobicContact CG2-CG1 3.87Å; I185-V221 HydrophobicContact CG2-CG2 3.84Å; I185-V224 HydrophobicContact CD1-CG1 3.75Å
186	V	96.6	Very high	95.3	Very high	1 Å²	1	36.8 Å²	36.8	1%	0.006	19%	0.189	C	C	.	.	I	π-helix	trans	-68.6	-53.5	177.5	173.1	0	0	0	0	111.8	G182 S183 E190 P191 A194 V221	G182-V186 WeakPolarHBondContact O-CG2 3.46Å; G182-V186 PolarHBondContact O-N 3.49Å; S183-V186 PolarHBondContact O-N 3.48Å; V186-E190 CarbonylContact O-C 3.57Å; V186-E190 PolarHBondContact O-N 2.95Å; V186-P191 WeakPolarHBondContact O-CA 2.96Å; V186-P191 VanDerWaalsContact O-N 3.12Å; V186-A194 HydrophobicContact CG1-CB 3.74Å; V186-V221 HydrophobicContact CG2-CG1 4.07Å
187	A	95.3	Very high	95.2	Very high	11 Å²	11	36 Å²	36	9%	0.091	18%	0.184	C	C	.	.	I	π-helix	trans	-68.8	-38.7	-171.3	0	0	0	0	0	114	S183 P402 V406 A501	S183-A187 VanDerWaalsContact O-CB 3.25Å; S183-A187 WeakPolarHBondContact O-CB 3.38Å; S183-A187 PolarHBondContact O-N 2.95Å; A187-P402 HydrophobicContact CB-CB 3.97Å; A187-V406 HydrophobicContact CB-CG2 4.18Å; A187-A501 HydrophobicContact CB-CB 4.27Å
188	F	95.4	Very high	95	Very high	121 Å²	121	30.7 Å²	30.7	53%	0.531	16%	0.161	S	C	.	.	I	π-helix	trans	-96.4	-35.5	-178.4	-70.5	-91.6	0	0	0	113.7	I184 P402 V406	I184-F188 HydrophobicContact CG2-CD2 4.33Å; I184-F188 WeakPolarHBondContact O-CB 3.47Å; I184-F188 PolarHBondContact O-N 2.72Å; F188-P402 HydrophobicContact CD1-CB 4.27Å; F188-P402 HydrophobicContact CD1-CG 4.26Å; F188-P402 HydrophobicContact CD2-CB 4.22Å; F188-P402 HydrophobicContact CE1-CB 4.02Å; F188-P402 HydrophobicContact CE1-CG 3.81Å; F188-P402 HydrophobicContact CE2-CB 3.97Å; F188-P402 HydrophobicContact CG-CB 4.38Å; F188-P402 HydrophobicContact CZ-CB 3.87Å; F188-P402 HydrophobicContact CZ-CG 4Å; F188-V406 HydrophobicContact CE2-CG2 4.15Å
189	I	95.1	Very high	94.9	Very high	85 Å²	85	30.3 Å²	30.3	44%	0.436	16%	0.158	S	C	.	.	I	π-helix	trans	-90.5	-51.8	-172.7	-52.2	-179.8	0	0	0	111.3	I185 K217 V221	I185-I189 HydrophobicContact CG2-CD1 4.18Å; I185-I189 WeakPolarHBondContact O-CA 3.44Å; I185-I189 WeakPolarHBondContact O-CB 3.33Å; I185-I189 PolarHBondContact O-N 2.9Å; I185-I189 VanDerWaalsContact O-N 3.13Å; I189-K217 VanDerWaalsContact CG2-CE 3.45Å; I189-K217 VanDerWaalsContact O-CE 3.31Å; I189-K217 WeakPolarHBondContact O-CE 3.45Å; I189-K217 PolarHBondContact O-NZ 3.03Å; I189-V221 HydrophobicContact CB-CG2 4.38Å; I189-V221 HydrophobicContact CG2-CG2 4.04Å
190	E	94.9	Very high	94.8	Very high	3 Å²	3	32.3 Å²	32.3	1%	0.014	17%	0.167	C	C	.	.			trans	-153	84.3	-177.3	-162.6	54.6	-99.4	0	0	113.6	I185 V186 I192 A193 R212 K217 V221	I185-E190 PolarHBondContact O-N 3.18Å; V186-E190 CarbonylContact O-C 3.57Å; V186-E190 PolarHBondContact O-N 2.95Å; E190-I192 HydrophobicContact CG-CG2 3.97Å; E190-I192 PolarHBondContact O-N 3.12Å; E190-A193 WeakPolarHBondContact O-CB 3.36Å; E190-A193 PolarHBondContact O-N 3.41Å; E190-R212 IonicContact OE1-CZ 3.95Å; E190-R212 VanDerWaalsContact OE1-CZ 3.26Å; E190-R212 IonicContact OE1-NE 2.79Å; E190-R212 PolarHBondContact OE1-NE 2.94Å; E190-R212 IonicContact OE1-NH2 3.61Å; E190-R212 PolarHBondContact OE1-NH2 2.92Å; E190-R212 IonicContact OE2-NE 3.89Å; E190-K217 WeakPolarHBondContact OE2-CD 2.99Å; E190-K217 WeakPolarHBondContact OE2-CE 3.17Å; E190-K217 IonicContact OE2-NZ 3.63Å; E190-K217 PolarHBondContact OE2-NZ 2.94Å; E190-V221 HydrophobicContact CB-CB 4.32Å; E190-V221 HydrophobicContact CB-CG1 4.23Å; E190-V221 HydrophobicContact CB-CG2 3.99Å
191	P	93.2	Very high	94.6	Very high	67 Å²	67	29.9 Å²	29.9	44%	0.435	16%	0.155	S	C	.	.	G	3₁₀ helix	trans	-67.9	-12	-168.9	24.4	-34.9	0	0	0	115.4	V186 A193 A194	V186-P191 WeakPolarHBondContact O-CA 2.96Å; V186-P191 VanDerWaalsContact O-N 3.12Å; P191-A193 PolarHBondContact O-N 3.26Å; P191-A194 WeakPolarHBondContact O-CB 3.36Å; P191-A194 PolarHBondContact O-N 3.43Å
192	I	92.2	Very high	94.4	Very high	35 Å²	35	24.7 Å²	24.7	18%	0.179	14%	0.136	C	C	.	.	G	3₁₀ helix	trans	-72.1	-5.1	172.5	-163	60	0	0	0	112.8	E190 Q200 V210 R212 T218 H244	E190-I192 HydrophobicContact CG-CG2 3.97Å; E190-I192 PolarHBondContact O-N 3.12Å; I192-Q200 HydrophobicContact CD1-CG 3.92Å; I192-V210 HydrophobicContact CD1-CG1 4.12Å; I192-R212 HydrophobicContact CG2-CB 4.12Å; I192-T218 HydrophobicContact CG2-CG2 3.88Å; I192-H244 PolarHBondContact O-CE1 2.91Å; I192-H244 VanDerWaalsContact O-CE1 3.26Å
193	A	94.3	Very high	94.3	Very high	0 Å²	0	24.8 Å²	24.8	0%	0	14%	0.137	C	C	.	.	G	3₁₀ helix	trans	-85.4	-6.4	172.2	0	0	0	0	0	114.3	E190 P191 T218 V221 K222 S503	E190-A193 WeakPolarHBondContact O-CB 3.36Å; E190-A193 PolarHBondContact O-N 3.41Å; P191-A193 PolarHBondContact O-N 3.26Å; A193-T218 HydrophobicContact CB-CG2 4.21Å; A193-V221 HydrophobicContact CB-CB 4.37Å; A193-V221 HydrophobicContact CB-CG1 3.61Å; A193-K222 HydrophobicContact CB-CB 4.09Å; A193-K222 HydrophobicContact CB-CD 4.35Å; A193-K222 HydrophobicContact CB-CG 4.12Å; A193-K222 WeakPolarHBondContact O-CE 3.44Å; A193-S503 WeakPolarHBondContact O-CB 3.2Å; A193-S503 PolarHBondContact O-OG 3.43Å
194	A	94.1	Very high	94.1	Very high	31 Å²	31	25 Å²	25	26%	0.256	14%	0.138	S	C	.	.	S	Bend	trans	-63.9	146.6	179	0	0	0	0	0	112.4	V186 P191 V502	V186-A194 HydrophobicContact CG1-CB 3.74Å; P191-A194 WeakPolarHBondContact O-CB 3.36Å; P191-A194 PolarHBondContact O-N 3.43Å; A194-V502 CarbonylContact C-O 3.6Å; A194-V502 WeakPolarHBondContact CA-O 3.41Å
195	G	93.4	Very high	93.8	Very high	14 Å²	14	22.4 Å²	22.4	14%	0.144	13%	0.125	C	C	.	.	B	Isolated β-bridge	trans	65.8	-154	-177.4	0	0	0	0	0	113.7	K222 V502 S503 A504	G195-K222 PolarHBondContact O-NZ 3.02Å; G195-V502 PolarHBondContact N-O 3.45Å; G195-S503 PolarHBondContact O-OG 3.3Å; G195-A504 CarbonylContact C-O 3.57Å; G195-A504 PolarHBondContact O-N 3Å; G195-A504 VanDerWaalsContact O-N 3.13Å
196	S	93.1	Very high	93.5	Very high	2 Å²	2	23 Å²	23	1%	0.014	13%	0.128	C	C	.	.			trans	-77.3	-29.7	-170.3	64.8	0	0	0	0	113	I198 P199 K222 G240 P241 A504	S196-I198 PolarHBondContact OG-N 3.1Å; S196-P199 WeakPolarHBondContact OG-CD 3.42Å; S196-K222 VanDerWaalsContact C-NZ 3.3Å; S196-K222 PolarHBondContact O-NZ 3.06Å; S196-G240 CarbonylContact O-C 3.53Å; S196-P241 WeakPolarHBondContact O-CA 3.3Å; S196-A504 WeakPolarHBondContact CA-O 3.3Å; S196-A504 PolarHBondContact N-O 3.41Å
197	G	93	Very high	93.2	Very high	0 Å²	0	23.7 Å²	23.7	0%	0	14%	0.135	C	C	.	.	S	Bend	trans	83.5	-8.8	-169.8	0	0	0	0	0	114	Q200 I201 H244	G197-Q200 PolarHBondContact O-N 3.1Å; G197-Q200 PolarHBondContact O-OE1 2.96Å; G197-I201 PolarHBondContact O-N 3.24Å; G197-I201 VanDerWaalsContact O-N 3.11Å; G197-H244 WeakPolarHBondContact CA-ND1 3.44Å
198	I	93.3	Very high	93	Very high	1 Å²	1	23.6 Å²	23.6	1%	0.005	13%	0.133	C	C	.	.	H	α-helix	trans	-65.9	-47	-177.6	-61.1	169.9	0	0	0	111.8	S196 Q200 I201 K202 I243 F302 F507 Y596	S196-I198 PolarHBondContact OG-N 3.1Å; I198-Q200 PolarHBondContact O-N 3.29Å; I198-I201 PolarHBondContact O-N 2.84Å; I198-I201 VanDerWaalsContact O-N 3.12Å; I198-K202 WeakPolarHBondContact O-CB 3.31Å; I198-K202 PolarHBondContact O-N 3.05Å; I198-I243 HydrophobicContact CD1-CD1 3.79Å; I198-I243 HydrophobicContact CG1-CB 4.42Å; I198-I243 HydrophobicContact CG1-CD1 4.09Å; I198-F302 HydrophobicContact CG2-CZ 4.17Å; I198-F507 HydrophobicContact CD1-CD2 4.29Å; I198-F507 HydrophobicContact CD1-CE2 3.67Å; I198-Y596 HydrophobicContact CB-CE2 4.37Å; I198-Y596 HydrophobicContact CD1-CE2 4.19Å; I198-Y596 HydrophobicContact CG2-CD2 3.94Å; I198-Y596 HydrophobicContact CG2-CE2 3.86Å
199	P	93.3	Very high	92.7	Very high	10 Å²	10	19.7 Å²	19.7	7%	0.065	12%	0.116	C	C	.	.	H	α-helix	trans	-52.9	-40.5	173.5	-28.1	36.1	0	0	0	113	S196 K202 C203 Y596 I600	S196-P199 WeakPolarHBondContact OG-CD 3.42Å; P199-K202 PolarHBondContact O-N 3.43Å; P199-C203 PolarHBondContact O-N 2.7Å; P199-C203 PolarHBondContact O-SG 3.07Å; P199-Y596 HydrophobicContact CG-CD1 3.89Å; P199-Y596 HydrophobicContact CG-CG 4.22Å; P199-I600 HydrophobicContact CB-CD1 4.43Å; P199-I600 HydrophobicContact CB-CG1 3.91Å
200	Q	93.9	Very high	92.3	Very high	41 Å²	41	16.2 Å²	16.2	19%	0.192	10%	0.099	C	C	.	.	H	α-helix	trans	-71.3	-32.3	-178.5	-62.4	80	-1.7	0	0	112.6	I192 G197 I198 F204 V210 V213	I192-Q200 HydrophobicContact CD1-CG 3.92Å; G197-Q200 PolarHBondContact O-N 3.1Å; G197-Q200 PolarHBondContact O-OE1 2.96Å; I198-Q200 PolarHBondContact O-N 3.29Å; Q200-F204 WeakPolarHBondContact O-CB 3.44Å; Q200-F204 PolarHBondContact O-N 3.18Å; Q200-F204 VanDerWaalsContact O-N 3.11Å; Q200-V210 HydrophobicContact CB-CG1 4.5Å; Q200-V210 HydrophobicContact CG-CG1 4.39Å; Q200-V213 HydrophobicContact CB-CG2 3.72Å
201	I	93.6	Very high	91.9	Very high	2 Å²	2	18.7 Å²	18.7	1%	0.01	12%	0.115	C	C	.	.	H	α-helix	trans	-76.2	-39.5	172.1	-64.9	-51.6	0	0	0	111.6	G197 I198 C203 F204 L205 V213 H244 A247 A285	G197-I201 PolarHBondContact O-N 3.24Å; G197-I201 VanDerWaalsContact O-N 3.11Å; I198-I201 PolarHBondContact O-N 2.84Å; I198-I201 VanDerWaalsContact O-N 3.12Å; I201-C203 PolarHBondContact O-N 3.15Å; I201-F204 PolarHBondContact O-N 3.45Å; I201-L205 HydrophobicContact CG2-CD1 4Å; I201-L205 HydrophobicContact CG2-CG 4.2Å; I201-L205 WeakPolarHBondContact O-CG 3.48Å; I201-L205 PolarHBondContact O-N 3.47Å; I201-V213 HydrophobicContact CD1-CG2 4.15Å; I201-H244 HydrophobicContact CG1-CB 4.25Å; I201-A247 HydrophobicContact CD1-CB 3.48Å; I201-A247 VanDerWaalsContact CD1-CB 3.48Å; I201-A247 HydrophobicContact CG1-CB 3.91Å; I201-A247 HydrophobicContact CG2-CB 4.42Å; I201-A285 HydrophobicContact CG2-CB 4.19Å
202	K	92.4	Very high	91.8	Very high	9 Å²	9	20.6 Å²	20.6	4%	0.039	11%	0.113	C	C	.	.	H	α-helix	trans	-55.2	-48.4	171	176.7	166.9	-172.8	153.9	0	111.2	I198 P199 F204 L205 N206 E306 D597 I600 F607	I198-K202 WeakPolarHBondContact O-CB 3.31Å; I198-K202 PolarHBondContact O-N 3.05Å; P199-K202 PolarHBondContact O-N 3.43Å; K202-F204 PolarHBondContact O-N 3.45Å; K202-L205 PolarHBondContact O-N 2.87Å; K202-N206 WeakPolarHBondContact O-CB 3.19Å; K202-N206 PolarHBondContact O-N 2.9Å; K202-E306 WeakPolarHBondContact CD-OE1 3.32Å; K202-E306 WeakPolarHBondContact CD-OE2 3.4Å; K202-E306 WeakPolarHBondContact CE-OE1 3.49Å; K202-E306 WeakPolarHBondContact CE-OE2 3.47Å; K202-E306 VanDerWaalsContact NZ-CD 3.28Å; K202-E306 IonicContact NZ-OE1 3.69Å; K202-E306 PolarHBondContact NZ-OE1 2.94Å; K202-E306 IonicContact NZ-OE2 3.95Å; K202-E306 PolarHBondContact NZ-OE2 3.27Å; K202-D597 WeakPolarHBondContact CE-OD1 3.1Å; K202-D597 IonicContact NZ-OD1 2.7Å; K202-D597 PolarHBondContact NZ-OD1 2.79Å; K202-D597 IonicContact NZ-OD2 2.71Å; K202-I600 HydrophobicContact CB-CD1 4.28Å; K202-I600 HydrophobicContact CD-CD1 3.76Å; K202-I600 HydrophobicContact CG-CD1 3.88Å; K202-F607 HydrophobicContact CD-CE2 4.28Å; K202-F607 HydrophobicContact CD-CZ 4.19Å; K202-F607 HydrophobicContact CG-CE2 3.59Å; K202-F607 HydrophobicContact CG-CZ 3.9Å
203	C	92.4	Very high	91.7	Very high	3 Å²	3	19 Å²	19	2%	0.02	11%	0.106	C	C	.	.	H	α-helix	trans	-60.1	-41.4	171.7	-65.8	0	0	0	0	113.2	P199 I201 N206 G207 V208 V210 V605	P199-C203 PolarHBondContact O-N 2.7Å; P199-C203 PolarHBondContact O-SG 3.07Å; I201-C203 PolarHBondContact O-N 3.15Å; C203-N206 PolarHBondContact O-N 2.82Å; C203-G207 PolarHBondContact O-N 2.67Å; C203-V208 HydrophobicContact CB-CB 4.3Å; C203-V208 WeakPolarHBondContact O-CB 3.17Å; C203-V208 PolarHBondContact O-N 3.08Å; C203-V210 HydrophobicContact CB-CG2 3.66Å; C203-V605 HydrophobicContact CB-CG1 4.32Å
204	F	92.3	Very high	91.6	Very high	4 Å²	4	20.8 Å²	20.8	2%	0.018	12%	0.116	C	C	.	.	H	α-helix	trans	-66.2	-41.7	179.9	-172.7	-87.3	0	0	0	112.7	L89 Q200 I201 K202 G207 V208 V213 V214 V281	L89-F204 HydrophobicContact CD1-CE2 3.84Å; L89-F204 HydrophobicContact CD1-CZ 3.81Å; L89-F204 HydrophobicContact CD2-CE1 4.46Å; L89-F204 HydrophobicContact CD2-CZ 4.4Å; Q200-F204 WeakPolarHBondContact O-CB 3.44Å; Q200-F204 PolarHBondContact O-N 3.18Å; Q200-F204 VanDerWaalsContact O-N 3.11Å; I201-F204 PolarHBondContact O-N 3.45Å; K202-F204 PolarHBondContact O-N 3.45Å; F204-G207 PolarHBondContact O-N 3.5Å; F204-V208 WeakPolarHBondContact CA-O 3.38Å; F204-V213 HydrophobicContact CD2-CG1 4.13Å; F204-V214 HydrophobicContact CE2-CG2 4.43Å; F204-V281 HydrophobicContact CD1-CB 4.25Å; F204-V281 HydrophobicContact CD1-CG1 3.66Å; F204-V281 HydrophobicContact CD1-CG2 4.43Å; F204-V281 HydrophobicContact CE1-CB 3.92Å; F204-V281 HydrophobicContact CE1-CG1 3.85Å; F204-V281 HydrophobicContact CE1-CG2 3.82Å; F204-V281 HydrophobicContact CZ-CG2 4.46Å
205	L	91	Very high	91.6	Very high	2 Å²	2	25.3 Å²	25.3	1%	0.01	13%	0.127	C	C	.	.	H	α-helix	trans	-69.8	-37.9	176.7	-68.5	177.8	0	0	0	111.9	I201 K202 G207 R278 V281 E306	I201-L205 HydrophobicContact CG2-CD1 4Å; I201-L205 HydrophobicContact CG2-CG 4.2Å; I201-L205 WeakPolarHBondContact O-CG 3.48Å; I201-L205 PolarHBondContact O-N 3.47Å; K202-L205 PolarHBondContact O-N 2.87Å; L205-G207 PolarHBondContact O-N 3.49Å; L205-G207 VanDerWaalsContact O-N 3.16Å; L205-R278 HydrophobicContact CD2-CG 4.12Å; L205-R278 WeakPolarHBondContact O-CD 3.48Å; L205-R278 PolarHBondContact O-NH1 3.35Å; L205-V281 HydrophobicContact CD2-CG1 4.06Å; L205-E306 WeakPolarHBondContact CB-O 3.46Å
206	N	90.9	Very high	91.5	Very high	42 Å²	42	28.3 Å²	28.3	23%	0.225	14%	0.139	C	C	.	.	H	α-helix	trans	-61.6	-17	171	-168.2	-112.8	0	0	0	113.6	K202 C203 F607 L608	K202-N206 WeakPolarHBondContact O-CB 3.19Å; K202-N206 PolarHBondContact O-N 2.9Å; C203-N206 PolarHBondContact O-N 2.82Å; N206-F607 HydrophobicContact CB-CD2 3.85Å; N206-F607 HydrophobicContact CB-CE2 3.5Å; N206-F607 HydrophobicContact CB-CZ 4.39Å; N206-F607 WeakPolarHBondContact OD1-CD2 3.37Å; N206-L608 PolarHBondContact ND2-O 2.99Å; N206-L608 PolarHBondContact OD1-N 3.13Å
207	G	89.5	Confident	91.6	Very high	14 Å²	14	32.5 Å²	32.5	14%	0.144	16%	0.157	C	C	.	.	T	Hydrogen-bonded Turn	trans	109.1	21.9	174.8	0	0	0	0	0	114.7	S88 L89 C203 F204 L205	S88-G207 CarbonylContact C-O 3.55Å; S88-G207 WeakPolarHBondContact CA-O 3.19Å; L89-G207 PolarHBondContact N-O 3.12Å; C203-G207 PolarHBondContact O-N 2.67Å; F204-G207 PolarHBondContact O-N 3.5Å; L205-G207 PolarHBondContact O-N 3.49Å; L205-G207 VanDerWaalsContact O-N 3.16Å
208	V	91.2	Very high	91.7	Very high	9 Å²	9	32.5 Å²	32.5	6%	0.055	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	121.9	178.6	-169.6	0	0	0	0	111.2	F86 C203 F204 V210 V605 P606	F86-V208 HydrophobicContact CB-CG1 3.78Å; F86-V208 HydrophobicContact CD1-CG1 4.24Å; F86-V208 HydrophobicContact CG-CG1 4.23Å; C203-V208 HydrophobicContact CB-CB 4.3Å; C203-V208 WeakPolarHBondContact O-CB 3.17Å; C203-V208 PolarHBondContact O-N 3.08Å; F204-V208 WeakPolarHBondContact CA-O 3.38Å; V208-V210 VanDerWaalsContact C-N 3.27Å; V208-V210 PolarHBondContact O-N 3.3Å; V208-V605 HydrophobicContact CB-CG1 4.41Å; V208-V605 HydrophobicContact CG1-CG1 3.87Å; V208-V605 HydrophobicContact CG2-CG1 4.36Å; V208-P606 WeakPolarHBondContact CG2-O 3.17Å
209	K	88.8	Confident	91.8	Very high	39 Å²	39	33 Å²	33	17%	0.17	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	73.8	175.4	-73.3	178.7	165.7	83	0	111.1	E87 S88 L89 D90 P211 D274	E87-K209 HydrophobicContact CB-CB 4.01Å; E87-K209 HydrophobicContact CB-CD 3.83Å; E87-K209 HydrophobicContact CB-CG 4.41Å; E87-K209 WeakPolarHBondContact O-CB 3.26Å; E87-K209 PolarHBondContact O-N 3.34Å; S88-K209 WeakPolarHBondContact O-CD 3.42Å; S88-K209 WeakPolarHBondContact O-CG 3.44Å; S88-K209 PolarHBondContact O-NZ 2.99Å; L89-K209 HydrophobicContact CB-CG 4.42Å; L89-K209 HydrophobicContact CD1-CG 3.83Å; D90-K209 IonicContact OD2-NZ 3.26Å; D90-K209 PolarHBondContact OD2-NZ 3.47Å; K209-P211 VanDerWaalsContact O-CD 3.29Å; K209-P211 WeakPolarHBondContact O-CD 3.27Å; K209-D274 WeakPolarHBondContact CE-OD2 3.36Å; K209-D274 IonicContact NZ-OD2 2.74Å; K209-D274 PolarHBondContact NZ-OD2 2.99Å
210	V	87.9	Confident	92	Very high	13 Å²	13	36.6 Å²	36.6	8%	0.079	18%	0.181	C	C	.	.			trans	-59.1	119.7	175.2	179.7	0	0	0	0	110.6	I192 Q200 C203 V208 R212 V213	I192-V210 HydrophobicContact CD1-CG1 4.12Å; Q200-V210 HydrophobicContact CB-CG1 4.5Å; Q200-V210 HydrophobicContact CG-CG1 4.39Å; C203-V210 HydrophobicContact CB-CG2 3.66Å; V208-V210 VanDerWaalsContact C-N 3.27Å; V208-V210 PolarHBondContact O-N 3.3Å; V210-R212 PolarHBondContact O-N 2.93Å; V210-V213 HydrophobicContact CB-CB 4.12Å; V210-V213 HydrophobicContact CB-CG1 4.05Å; V210-V213 HydrophobicContact CG1-CB 4.13Å; V210-V213 WeakPolarHBondContact O-CG1 3.38Å; V210-V213 PolarHBondContact O-N 3Å
211	P	86.8	Confident	92.1	Very high	54 Å²	54	35 Å²	35	35%	0.351	17%	0.174	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.8	132.9	-174.8	-27.9	36.5	0	0	0	113.4	K209 V213	K209-P211 VanDerWaalsContact O-CD 3.29Å; K209-P211 WeakPolarHBondContact O-CD 3.27Å; P211-V213 PolarHBondContact O-N 3.11Å
212	R	89.8	Confident	92.3	Very high	108 Å²	108	35 Å²	35	41%	0.408	17%	0.174	S	C	.	.	T	Hydrogen-bonded Turn	trans	66.1	4.1	176.5	-46.1	-165.3	-58	-109.8	4	116.3	E190 I192 V210 V214 R215 T218	E190-R212 IonicContact OE1-CZ 3.95Å; E190-R212 VanDerWaalsContact OE1-CZ 3.26Å; E190-R212 IonicContact OE1-NE 2.79Å; E190-R212 PolarHBondContact OE1-NE 2.94Å; E190-R212 IonicContact OE1-NH2 3.61Å; E190-R212 PolarHBondContact OE1-NH2 2.92Å; E190-R212 IonicContact OE2-NE 3.89Å; I192-R212 HydrophobicContact CG2-CB 4.12Å; V210-R212 PolarHBondContact O-N 2.93Å; R212-V214 PolarHBondContact O-N 3.05Å; R212-R215 HydrophobicContact CB-CG 4.48Å; R212-R215 PolarHBondContact O-N 3.36Å; R212-T218 PolarHBondContact O-OG1 3.38Å
213	V	90.9	Very high	92.5	Very high	2 Å²	2	35.2 Å²	35.2	1%	0.012	18%	0.176	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.6	-48.4	-179.7	66.9	0	0	0	0	113.3	Q200 I201 F204 V210 P211 R215 H244 V248	Q200-V213 HydrophobicContact CB-CG2 3.72Å; I201-V213 HydrophobicContact CD1-CG2 4.15Å; F204-V213 HydrophobicContact CD2-CG1 4.13Å; V210-V213 HydrophobicContact CB-CB 4.12Å; V210-V213 HydrophobicContact CB-CG1 4.05Å; V210-V213 HydrophobicContact CG1-CB 4.13Å; V210-V213 WeakPolarHBondContact O-CG1 3.38Å; V210-V213 PolarHBondContact O-N 3Å; P211-V213 PolarHBondContact O-N 3.11Å; V213-R215 PolarHBondContact O-N 2.86Å; V213-H244 WeakPolarHBondContact CA-NE2 3.43Å; V213-H244 WeakPolarHBondContact CG2-NE2 3.45Å; V213-H244 PolarHBondContact O-NE2 3.27Å; V213-V248 WeakPolarHBondContact O-CG2 3.38Å
214	V	92.4	Very high	92.7	Very high	37 Å²	37	37.4 Å²	37.4	22%	0.224	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	-99	46.4	-177.7	-74.3	0	0	0	0	113.4	F204 R212 A251	F204-V214 HydrophobicContact CE2-CG2 4.43Å; R212-V214 PolarHBondContact O-N 3.05Å; V214-A251 HydrophobicContact CB-CB 3.54Å; V214-A251 HydrophobicContact CG1-CB 3.49Å; V214-A251 VanDerWaalsContact CG1-CB 3.49Å; V214-A251 HydrophobicContact CG2-CB 4.14Å
215	R	92.8	Very high	92.9	Very high	126 Å²	126	37.2 Å²	37.2	48%	0.475	19%	0.189	S	C	.	.			trans	-103.6	141.8	174.1	-71	-173.7	176.7	-167.8	-1.8	111.5	R212 V213 K217 T218 L219	R212-R215 HydrophobicContact CB-CG 4.48Å; R212-R215 PolarHBondContact O-N 3.36Å; V213-R215 PolarHBondContact O-N 2.86Å; R215-K217 PolarHBondContact O-N 3.09Å; R215-T218 WeakPolarHBondContact O-CA 3.32Å; R215-T218 WeakPolarHBondContact O-CB 3.11Å; R215-T218 PolarHBondContact O-N 3.18Å; R215-L219 PolarHBondContact O-N 2.89Å; R215-L219 VanDerWaalsContact O-N 3.13Å
216	L	93.3	Very high	93.2	Very high	76 Å²	76	37.1 Å²	37.1	40%	0.398	19%	0.188	S	C	.	.	H	α-helix	trans	-54.5	-37.9	174	178.5	61	0	0	0	112.5	T218 L219 V220 L261	L216-T218 VanDerWaalsContact C-N 3.3Å; L216-T218 PolarHBondContact O-N 3.35Å; L216-L219 HydrophobicContact CD1-CD2 4.27Å; L216-L219 WeakPolarHBondContact O-CB 3.21Å; L216-L219 PolarHBondContact O-N 2.92Å; L216-V220 PolarHBondContact O-N 3.45Å; L216-V220 VanDerWaalsContact O-N 3.08Å; L216-L261 HydrophobicContact CD2-CD1 4.41Å
217	K	94.3	Very high	93.5	Very high	90 Å²	90	35.7 Å²	35.7	39%	0.391	18%	0.18	S	C	.	.	H	α-helix	trans	-57.5	-42.2	172.7	-177.1	-173.6	168.7	-147.8	0	112.2	I189 E190 R215 V220 V221	I189-K217 VanDerWaalsContact CG2-CE 3.45Å; I189-K217 VanDerWaalsContact O-CE 3.31Å; I189-K217 WeakPolarHBondContact O-CE 3.45Å; I189-K217 PolarHBondContact O-NZ 3.03Å; E190-K217 WeakPolarHBondContact OE2-CD 2.99Å; E190-K217 WeakPolarHBondContact OE2-CE 3.17Å; E190-K217 IonicContact OE2-NZ 3.63Å; E190-K217 PolarHBondContact OE2-NZ 2.94Å; R215-K217 PolarHBondContact O-N 3.09Å; K217-V220 PolarHBondContact O-N 3.44Å; K217-V221 WeakPolarHBondContact O-CB 3.09Å; K217-V221 WeakPolarHBondContact O-CG2 3.37Å; K217-V221 PolarHBondContact O-N 3.04Å
218	T	95.3	Very high	93.8	Very high	1 Å²	1	37.7 Å²	37.7	1%	0.006	19%	0.185	C	C	.	.	H	α-helix	trans	-63.6	-45.6	176.6	-47.3	0	0	0	0	110.4	I192 A193 R212 R215 L216 V220 V221 K222 H244	I192-T218 HydrophobicContact CG2-CG2 3.88Å; A193-T218 HydrophobicContact CB-CG2 4.21Å; R212-T218 PolarHBondContact O-OG1 3.38Å; R215-T218 WeakPolarHBondContact O-CA 3.32Å; R215-T218 WeakPolarHBondContact O-CB 3.11Å; R215-T218 PolarHBondContact O-N 3.18Å; L216-T218 VanDerWaalsContact C-N 3.3Å; L216-T218 PolarHBondContact O-N 3.35Å; T218-V220 PolarHBondContact O-N 2.84Å; T218-V221 PolarHBondContact O-N 3.32Å; T218-K222 WeakPolarHBondContact O-CB 2.89Å; T218-K222 PolarHBondContact O-N 3.45Å; T218-H244 WeakPolarHBondContact CG2-CE1 3.31Å
219	L	96.3	Very high	94.1	Very high	12 Å²	12	37.3 Å²	37.3	6%	0.063	18%	0.182	C	C	.	.	H	α-helix	trans	-54.8	-52.3	175.4	179.1	65.3	0	0	0	111.8	I132 R215 L216 V221 K222 V223 V248 L249	I132-L219 HydrophobicContact CD1-CD1 4.12Å; I132-L219 HydrophobicContact CD1-CD2 4.02Å; I132-L219 HydrophobicContact CD1-CG 4.42Å; R215-L219 PolarHBondContact O-N 2.89Å; R215-L219 VanDerWaalsContact O-N 3.13Å; L216-L219 HydrophobicContact CD1-CD2 4.27Å; L216-L219 WeakPolarHBondContact O-CB 3.21Å; L216-L219 PolarHBondContact O-N 2.92Å; L219-V221 PolarHBondContact O-N 3.13Å; L219-K222 PolarHBondContact O-N 2.01Å; L219-K222 VanDerWaalsContact O-N 3.13Å; L219-V223 HydrophobicContact CD1-CG2 3.96Å; L219-V223 HydrophobicContact CG-CG2 4.36Å; L219-V223 VanDerWaalsContact O-CG2 3.31Å; L219-V223 WeakPolarHBondContact O-CG2 3.49Å; L219-V223 PolarHBondContact O-N 3.27Å; L219-V248 HydrophobicContact CB-CB 4.32Å; L219-V248 HydrophobicContact CB-CG1 3.79Å; L219-L249 HydrophobicContact CD2-CD2 3.91Å; L219-L249 HydrophobicContact CD2-CG 4.18Å
220	V	96.4	Very high	94.4	Very high	85 Å²	85	36 Å²	36	52%	0.515	18%	0.178	S	C	.	.	H	α-helix	trans	-61.3	-47.1	-178.8	175.9	0	0	0	0	111.7	L216 K217 T218 K222 V224	L216-V220 PolarHBondContact O-N 3.45Å; L216-V220 VanDerWaalsContact O-N 3.08Å; K217-V220 PolarHBondContact O-N 3.44Å; T218-V220 PolarHBondContact O-N 2.84Å; V220-K222 PolarHBondContact O-N 3.39Å; V220-V224 WeakPolarHBondContact O-CB 3.3Å; V220-V224 WeakPolarHBondContact O-CG2 3.47Å; V220-V224 PolarHBondContact O-N 3.03Å; V220-V224 VanDerWaalsContact O-N 3.09Å
221	V	96.8	Very high	94.7	Very high	7 Å²	7	35.6 Å²	35.6	4%	0.042	18%	0.176	C	C	.	.	H	α-helix	trans	-58.8	-38	175.8	165	0	0	0	0	111.4	I185 V186 I189 E190 A193 K217 T218 L219 G225	I185-V221 HydrophobicContact CG2-CB 4.15Å; I185-V221 HydrophobicContact CG2-CG1 3.87Å; I185-V221 HydrophobicContact CG2-CG2 3.84Å; V186-V221 HydrophobicContact CG2-CG1 4.07Å; I189-V221 HydrophobicContact CB-CG2 4.38Å; I189-V221 HydrophobicContact CG2-CG2 4.04Å; E190-V221 HydrophobicContact CB-CB 4.32Å; E190-V221 HydrophobicContact CB-CG1 4.23Å; E190-V221 HydrophobicContact CB-CG2 3.99Å; A193-V221 HydrophobicContact CB-CB 4.37Å; A193-V221 HydrophobicContact CB-CG1 3.61Å; K217-V221 WeakPolarHBondContact O-CB 3.09Å; K217-V221 WeakPolarHBondContact O-CG2 3.37Å; K217-V221 PolarHBondContact O-N 3.04Å; T218-V221 PolarHBondContact O-N 3.32Å; L219-V221 PolarHBondContact O-N 3.13Å; V221-G225 WeakPolarHBondContact O-CA 3.35Å; V221-G225 PolarHBondContact O-N 3.46Å
222	K	96.9	Very high	95	Very high	2 Å²	2	33 Å²	33	1%	0.009	16%	0.159	C	C	.	.	H	α-helix	trans	-77.4	-41.3	-174.7	-151	167.2	-168.4	-59.5	0	113	A193 G195 S196 T218 L219 V220 G225 V226 H244 S503	A193-K222 HydrophobicContact CB-CB 4.09Å; A193-K222 HydrophobicContact CB-CD 4.35Å; A193-K222 HydrophobicContact CB-CG 4.12Å; A193-K222 WeakPolarHBondContact O-CE 3.44Å; G195-K222 PolarHBondContact O-NZ 3.02Å; S196-K222 VanDerWaalsContact C-NZ 3.3Å; S196-K222 PolarHBondContact O-NZ 3.06Å; T218-K222 WeakPolarHBondContact O-CB 2.89Å; T218-K222 PolarHBondContact O-N 3.45Å; L219-K222 PolarHBondContact O-N 2.01Å; L219-K222 VanDerWaalsContact O-N 3.13Å; V220-K222 PolarHBondContact O-N 3.39Å; K222-G225 PolarHBondContact O-N 3.49Å; K222-V226 WeakPolarHBondContact O-CG1 3.36Å; K222-V226 PolarHBondContact O-N 3.26Å; K222-H244 HydrophobicContact CD-CB 4.35Å; K222-H244 WeakPolarHBondContact CD-ND1 3.41Å; K222-H244 WeakPolarHBondContact CE-ND1 3.47Å; K222-S503 VanDerWaalsContact CE-OG 3.32Å; K222-S503 WeakPolarHBondContact CE-OG 3.44Å; K222-S503 WeakPolarHBondContact CG-OG 3.41Å; K222-S503 PolarHBondContact NZ-OG 3.43Å
223	V	97.1	Very high	95.1	Very high	14 Å²	14	28.7 Å²	28.7	9%	0.085	15%	0.147	C	C	.	.	H	α-helix	trans	-61.6	-49.4	173.1	171.2	0	0	0	0	110.7	I132 F135 I136 L219 V226 I227	I132-V223 HydrophobicContact CG2-CG2 3.95Å; F135-V223 HydrophobicContact CD1-CG1 4.12Å; F135-V223 HydrophobicContact CE1-CG1 4.01Å; I136-V223 HydrophobicContact CD1-CG1 4.14Å; I136-V223 HydrophobicContact CD1-CG2 4.28Å; I136-V223 HydrophobicContact CG1-CG1 3.89Å; L219-V223 HydrophobicContact CD1-CG2 3.96Å; L219-V223 HydrophobicContact CG-CG2 4.36Å; L219-V223 VanDerWaalsContact O-CG2 3.31Å; L219-V223 WeakPolarHBondContact O-CG2 3.49Å; L219-V223 PolarHBondContact O-N 3.27Å; V223-V226 WeakPolarHBondContact O-CG1 3.4Å; V223-I227 HydrophobicContact CG1-CD1 4.28Å; V223-I227 WeakPolarHBondContact O-CD1 3.48Å; V223-I227 WeakPolarHBondContact O-CG1 3.34Å; V223-I227 PolarHBondContact O-N 3.43Å
224	V	97.1	Very high	95.3	Very high	49 Å²	49	28.9 Å²	28.9	30%	0.297	15%	0.148	S	C	.	.	H	α-helix	trans	-68.1	-40.9	178.7	176.1	0	0	0	0	111.2	I185 V220 V226 I227 F228	I185-V224 HydrophobicContact CD1-CG1 3.75Å; V220-V224 WeakPolarHBondContact O-CB 3.3Å; V220-V224 WeakPolarHBondContact O-CG2 3.47Å; V220-V224 PolarHBondContact O-N 3.03Å; V220-V224 VanDerWaalsContact O-N 3.09Å; V224-V226 PolarHBondContact O-N 3.48Å; V224-I227 PolarHBondContact O-N 2.92Å; V224-F228 HydrophobicContact CG1-CD2 3.71Å; V224-F228 HydrophobicContact CG1-CE2 3.64Å; V224-F228 WeakPolarHBondContact O-CD2 3.48Å; V224-F228 PolarHBondContact O-N 3Å
225	G	96.7	Very high	95.4	Very high	0 Å²	0	27.5 Å²	27.5	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-65.7	-32.4	179.9	0	0	0	0	0	114.5	V221 K222 S229	V221-G225 WeakPolarHBondContact O-CA 3.35Å; V221-G225 PolarHBondContact O-N 3.46Å; K222-G225 PolarHBondContact O-N 3.49Å; G225-S229 WeakPolarHBondContact O-CB 3.45Å; G225-S229 PolarHBondContact O-N 2.83Å; G225-S229 VanDerWaalsContact O-N 3.13Å; G225-S229 PolarHBondContact O-OG 2.89Å
226	V	96.8	Very high	95.5	Very high	0 Å²	0	21.6 Å²	21.6	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-77.6	-35.8	176.9	72.7	0	0	0	0	112.6	I136 K222 V223 V224 F228 S229 V230 K238 P241	I136-V226 HydrophobicContact CD1-CG1 4.23Å; I136-V226 HydrophobicContact CG2-CG1 4.37Å; K222-V226 WeakPolarHBondContact O-CG1 3.36Å; K222-V226 PolarHBondContact O-N 3.26Å; V223-V226 WeakPolarHBondContact O-CG1 3.4Å; V224-V226 PolarHBondContact O-N 3.48Å; V226-F228 PolarHBondContact O-N 3.22Å; V226-S229 WeakPolarHBondContact CA-OG 3.47Å; V226-S229 PolarHBondContact O-N 3.11Å; V226-S229 PolarHBondContact O-OG 3.06Å; V226-S229 VanDerWaalsContact O-OG 3.11Å; V226-V230 HydrophobicContact CG2-CG2 4.3Å; V226-V230 WeakPolarHBondContact O-CG2 3.22Å; V226-V230 PolarHBondContact O-N 3.44Å; V226-V230 VanDerWaalsContact O-N 3.11Å; V226-K238 HydrophobicContact CG2-CB 4.05Å; V226-P241 HydrophobicContact CB-CB 4.27Å; V226-P241 HydrophobicContact CB-CG 4.35Å; V226-P241 HydrophobicContact CG1-CB 4.45Å; V226-P241 HydrophobicContact CG2-CB 4.09Å; V226-P241 HydrophobicContact CG2-CG 3.83Å
227	I	96.9	Very high	95.5	Very high	12 Å²	12	18 Å²	18	6%	0.062	10%	0.1	C	C	.	.	H	α-helix	trans	-59.8	-49.2	173.1	-65	162.3	0	0	0	109.4	F135 I136 A139 V140 L143 V223 V224 S229 V231	F135-I227 HydrophobicContact CE1-CD1 3.98Å; I136-I227 HydrophobicContact CG1-CD1 4.31Å; I136-I227 HydrophobicContact CG1-CG1 4.33Å; I136-I227 HydrophobicContact CG2-CG1 4.24Å; A139-I227 HydrophobicContact CB-CD1 3.86Å; A139-I227 HydrophobicContact CB-CG1 4.3Å; A139-I227 HydrophobicContact CB-CG2 4.2Å; V140-I227 HydrophobicContact CG2-CB 4.35Å; V140-I227 HydrophobicContact CG2-CG1 4.21Å; V140-I227 HydrophobicContact CG2-CG2 4.23Å; L143-I227 HydrophobicContact CD1-CG2 3.9Å; V223-I227 HydrophobicContact CG1-CD1 4.28Å; V223-I227 WeakPolarHBondContact O-CD1 3.48Å; V223-I227 WeakPolarHBondContact O-CG1 3.34Å; V223-I227 PolarHBondContact O-N 3.43Å; V224-I227 PolarHBondContact O-N 2.92Å; I227-S229 PolarHBondContact O-N 2.85Å; I227-V231 HydrophobicContact CG2-CG2 4.31Å; I227-V231 VanDerWaalsContact O-CB 3.3Å; I227-V231 WeakPolarHBondContact O-CB 3.48Å; I227-V231 WeakPolarHBondContact O-CG2 3.28Å; I227-V231 PolarHBondContact O-N 2.94Å
228	F	96.8	Very high	95.5	Very high	56 Å²	56	14.2 Å²	14.2	25%	0.246	8%	0.083	C	C	.	.	H	α-helix	trans	-68.4	-30	179.8	-80.4	-59	0	0	0	114.7	C178 W181 V224 V226 G232	C178-F228 HydrophobicContact CB-CD1 4.31Å; W181-F228 HydrophobicContact CB-CD1 4.49Å; W181-F228 HydrophobicContact CB-CD2 4.47Å; W181-F228 HydrophobicContact CB-CE2 4.47Å; W181-F228 HydrophobicContact CB-CG 4.49Å; W181-F228 HydrophobicContact CB-CZ 4.5Å; V224-F228 HydrophobicContact CG1-CD2 3.71Å; V224-F228 HydrophobicContact CG1-CE2 3.64Å; V224-F228 WeakPolarHBondContact O-CD2 3.48Å; V224-F228 PolarHBondContact O-N 3Å; V226-F228 PolarHBondContact O-N 3.22Å; F228-G232 WeakPolarHBondContact O-CA 3.35Å; F228-G232 PolarHBondContact O-N 2.91Å
229	S	95.9	Very high	95.4	Very high	0 Å²	0	14.2 Å²	14.2	0%	0	8%	0.083	C	C	.	.	H	α-helix	trans	-75.2	-39.3	178	66.8	0	0	0	0	112.7	G225 V226 I227 L234 S503	G225-S229 WeakPolarHBondContact O-CB 3.45Å; G225-S229 PolarHBondContact O-N 2.83Å; G225-S229 VanDerWaalsContact O-N 3.13Å; G225-S229 PolarHBondContact O-OG 2.89Å; V226-S229 WeakPolarHBondContact CA-OG 3.47Å; V226-S229 PolarHBondContact O-N 3.11Å; V226-S229 PolarHBondContact O-OG 3.06Å; V226-S229 VanDerWaalsContact O-OG 3.11Å; I227-S229 PolarHBondContact O-N 2.85Å; S229-L234 PolarHBondContact O-N 3.21Å; S229-S503 WeakPolarHBondContact CB-O 3.38Å; S229-S503 PolarHBondContact OG-O 3.48Å
230	V	95	Very high	95.2	Very high	13 Å²	13	13.6 Å²	13.6	8%	0.079	8%	0.08	C	C	.	.	H	α-helix	trans	-70.6	-49.9	175.5	177.9	0	0	0	0	110.9	V140 V226 G232 G233 V236 K238	V140-V230 HydrophobicContact CG1-CB 4.41Å; V140-V230 HydrophobicContact CG1-CG1 3.65Å; V140-V230 HydrophobicContact CG2-CB 4.38Å; V140-V230 HydrophobicContact CG2-CG1 4.45Å; V226-V230 HydrophobicContact CG2-CG2 4.3Å; V226-V230 WeakPolarHBondContact O-CG2 3.22Å; V226-V230 PolarHBondContact O-N 3.44Å; V226-V230 VanDerWaalsContact O-N 3.11Å; V230-G232 PolarHBondContact O-N 3.01Å; V230-G233 PolarHBondContact O-N 3.47Å; V230-V236 HydrophobicContact CG2-CG2 3.88Å; V230-K238 HydrophobicContact CG2-CB 4.33Å
231	V	95.1	Very high	95.2	Very high	4 Å²	4	9.6 Å²	9.6	2%	0.024	6%	0.056	C	C	.	.	H	α-helix	trans	-59.9	-35	175.2	173.9	0	0	0	0	110.8	L143 K147 I227 G233	L143-V231 HydrophobicContact CB-CB 4.45Å; L143-V231 HydrophobicContact CB-CG1 3.91Å; L143-V231 HydrophobicContact CB-CG2 3.64Å; L143-V231 HydrophobicContact CD1-CG2 4.36Å; K147-V231 WeakPolarHBondContact CD-O 3.49Å; K147-V231 WeakPolarHBondContact CE-O 3.4Å; K147-V231 PolarHBondContact NZ-O 3.16Å; I227-V231 HydrophobicContact CG2-CG2 4.31Å; I227-V231 VanDerWaalsContact O-CB 3.3Å; I227-V231 WeakPolarHBondContact O-CB 3.48Å; I227-V231 WeakPolarHBondContact O-CG2 3.28Å; I227-V231 PolarHBondContact O-N 2.94Å; V231-G233 PolarHBondContact O-N 2.96Å; V231-G233 VanDerWaalsContact O-N 3.08Å
232	G	93.8	Very high	95.1	Very high	0 Å²	0	9.3 Å²	9.3	0%	0	5%	0.054	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-2.3	173.5	0	0	0	0	0	116	N175 F228 V230 L234	N175-G232 VanDerWaalsContact CB-O 3.24Å; N175-G232 WeakPolarHBondContact CB-O 3.08Å; N175-G232 PolarHBondContact ND2-O 2.85Å; N175-G232 PolarHBondContact OD1-O 2.66Å; F228-G232 WeakPolarHBondContact O-CA 3.35Å; F228-G232 PolarHBondContact O-N 2.91Å; V230-G232 PolarHBondContact O-N 3.01Å; G232-L234 VanDerWaalsContact C-N 3.31Å; G232-L234 PolarHBondContact O-N 2.71Å
233	G	91.8	Very high	95	Very high	16 Å²	16	9.3 Å²	9.3	17%	0.165	5%	0.054	C	C	.	.	T	Hydrogen-bonded Turn	trans	69.8	23.5	172.7	0	0	0	0	0	114.5	V230 V231 T416	V230-G233 PolarHBondContact O-N 3.47Å; V231-G233 PolarHBondContact O-N 2.96Å; V231-G233 VanDerWaalsContact O-N 3.08Å; G233-T416 VanDerWaalsContact O-CG2 3.3Å; G233-T416 WeakPolarHBondContact O-CG2 3.38Å
234	L	94.7	Very high	95	Very high	7 Å²	7	8.6 Å²	8.6	4%	0.037	5%	0.05	C	C	.	.			trans	-73.2	155.4	169.9	-67.5	174.8	0	0	0	110.6	V179 S229 G232 V236 V412 A413 T497 V502	V179-L234 HydrophobicContact CG1-CD1 3.94Å; V179-L234 HydrophobicContact CG2-CD1 3.72Å; V179-L234 HydrophobicContact CG2-CD2 4.28Å; V179-L234 HydrophobicContact CG2-CG 3.72Å; S229-L234 PolarHBondContact O-N 3.21Å; G232-L234 VanDerWaalsContact C-N 3.31Å; G232-L234 PolarHBondContact O-N 2.71Å; L234-V236 HydrophobicContact CB-CG1 3.89Å; L234-V236 HydrophobicContact CB-CG2 4.13Å; L234-V236 PolarHBondContact O-N 3.03Å; L234-V412 HydrophobicContact CD2-CB 4.45Å; L234-V412 HydrophobicContact CD2-CG1 4.02Å; L234-A413 HydrophobicContact CD2-CB 4Å; L234-T497 HydrophobicContact CB-CG2 3.87Å; L234-T497 HydrophobicContact CD2-CG2 4.39Å; L234-T497 HydrophobicContact CG-CG2 4.5Å; L234-V502 HydrophobicContact CD1-CG2 4.12Å
235	A	94.6	Very high	95	Very high	7 Å²	7	6.4 Å²	6.4	6%	0.058	4%	0.036	C	C	.	.	S	Bend	trans	-73.9	71	174.1	0	0	0	0	0	111.2	Y490 A494 P509	A235-Y490 HydrophobicContact CB-CE1 4.3Å; A235-Y490 HydrophobicContact CB-CE2 4.02Å; A235-A494 HydrophobicContact CB-CB 4.14Å; A235-P509 WeakPolarHBondContact O-CG 3.37Å
236	V	94.8	Very high	95	Very high	3 Å²	3	6.4 Å²	6.4	2%	0.018	4%	0.036	C	C	.	.			trans	-138.1	157.9	-174.2	-56.2	0	0	0	0	111.6	V230 L234 T497 A504	V230-V236 HydrophobicContact CG2-CG2 3.88Å; L234-V236 HydrophobicContact CB-CG1 3.89Å; L234-V236 HydrophobicContact CB-CG2 4.13Å; L234-V236 PolarHBondContact O-N 3.03Å; V236-T497 HydrophobicContact CG1-CG2 3.38Å; V236-A504 HydrophobicContact CB-CB 3.87Å; V236-A504 HydrophobicContact CG1-CB 3.48Å; V236-A504 VanDerWaalsContact CG1-CB 3.48Å
237	G	93	Very high	95	Very high	0 Å²	0	6.4 Å²	6.4	0%	0	4%	0.036	C	C	.	.	B	Isolated β-bridge	trans	-118.9	153.2	168.6	0	0	0	0	0	112.9	G505	G237-G505 PolarHBondContact N-O 3.45Å; G237-G505 VanDerWaalsContact O-CA 3.26Å; G237-G505 WeakPolarHBondContact O-CA 3.43Å; G237-G505 PolarHBondContact O-N 3.23Å
238	K	94.4	Very high	94.9	Very high	10 Å²	10	6.1 Å²	6.1	4%	0.043	4%	0.036	C	C	.	.	S	Bend	trans	-76	-20.1	177.3	61.5	-159.1	170.3	-178.7	0	114.2	I136 D137 V226 V230 P241 L349 E464	I136-K238 HydrophobicContact CG2-CB 4.26Å; I136-K238 HydrophobicContact CG2-CD 4.49Å; D137-K238 IonicContact OD1-NZ 3.38Å; D137-K238 PolarHBondContact OD1-NZ 2.93Å; V226-K238 HydrophobicContact CG2-CB 4.05Å; V230-K238 HydrophobicContact CG2-CB 4.33Å; K238-P241 VanDerWaalsContact O-CD 3.28Å; K238-P241 WeakPolarHBondContact O-CD 3.39Å; K238-L349 HydrophobicContact CG-CD1 4.43Å; K238-E464 WeakPolarHBondContact CE-OE1 3.47Å; K238-E464 IonicContact NZ-OE1 3.51Å
239	E	92.9	Very high	94.9	Very high	1 Å²	1	4.6 Å²	4.6	1%	0.005	3%	0.03	C	C	.	.	H	α-helix	trans	-61.4	-50.6	-171.5	-51.5	-33.2	129.9	0	0	115.9	P241 M242 A292 F293 L349 I508	E239-P241 VanDerWaalsContact C-N 3.35Å; E239-M242 WeakPolarHBondContact O-CB 3.33Å; E239-M242 PolarHBondContact O-N 3.24Å; E239-A292 HydrophobicContact CB-CB 3.91Å; E239-A292 HydrophobicContact CG-CB 4.32Å; E239-A292 WeakPolarHBondContact OE2-CA 3.42Å; E239-A292 WeakPolarHBondContact OE2-CB 3.35Å; E239-F293 HydrophobicContact CB-CE1 4.32Å; E239-F293 HydrophobicContact CB-CE2 4.4Å; E239-F293 HydrophobicContact CB-CZ 3.88Å; E239-F293 HydrophobicContact CG-CE1 4.22Å; E239-F293 HydrophobicContact CG-CZ 4.29Å; E239-L349 VanDerWaalsContact OE2-CB 3.26Å; E239-L349 WeakPolarHBondContact OE2-CB 3.46Å; E239-L349 WeakPolarHBondContact OE2-CD1 3.27Å; E239-I508 HydrophobicContact CG-CD1 3.66Å; E239-I508 HydrophobicContact CG-CG1 3.82Å
240	G	91.8	Very high	94.9	Very high	0 Å²	0	4.6 Å²	4.6	0%	0	3%	0.03	C	C	.	.	H	α-helix	trans	-57.1	-45.2	-178.9	0	0	0	0	0	112.7	S196 M242 I243	S196-G240 CarbonylContact O-C 3.53Å; G240-M242 VanDerWaalsContact C-N 3.26Å; G240-M242 PolarHBondContact O-N 3.16Å; G240-I243 PolarHBondContact O-N 3.38Å
241	P	95.7	Very high	94.8	Very high	1 Å²	1	4.4 Å²	4.4	1%	0.006	3%	0.03	C	C	.	.	H	α-helix	trans	-55.5	-24.6	169.9	-32.9	38.6	0	0	0	117.7	S196 V226 K238 E239 S245	S196-P241 WeakPolarHBondContact O-CA 3.3Å; V226-P241 HydrophobicContact CB-CB 4.27Å; V226-P241 HydrophobicContact CB-CG 4.35Å; V226-P241 HydrophobicContact CG1-CB 4.45Å; V226-P241 HydrophobicContact CG2-CB 4.09Å; V226-P241 HydrophobicContact CG2-CG 3.83Å; K238-P241 VanDerWaalsContact O-CD 3.28Å; K238-P241 WeakPolarHBondContact O-CD 3.39Å; E239-P241 VanDerWaalsContact C-N 3.35Å; P241-S245 WeakPolarHBondContact O-CB 3.26Å; P241-S245 PolarHBondContact O-N 3.03Å; P241-S245 PolarHBondContact O-OG 3.46Å
242	M	95.4	Very high	94.7	Very high	1 Å²	1	6 Å²	6	1%	0.005	5%	0.047	C	C	.	.	H	α-helix	trans	-67.3	-37.7	176.2	-76.1	-55.2	-48.8	0	0	113	T129 I132 A133 I136 E239 G240 H244 S245 G246 L349	T129-M242 HydrophobicContact CG2-CE 4.05Å; I132-M242 HydrophobicContact CG2-CE 4.18Å; I132-M242 HydrophobicContact CG2-SD 4.32Å; A133-M242 HydrophobicContact CB-CE 3.72Å; A133-M242 HydrophobicContact CB-SD 4.18Å; I136-M242 HydrophobicContact CD1-SD 3.61Å; E239-M242 WeakPolarHBondContact O-CB 3.33Å; E239-M242 PolarHBondContact O-N 3.24Å; G240-M242 VanDerWaalsContact C-N 3.26Å; G240-M242 PolarHBondContact O-N 3.16Å; M242-H244 PolarHBondContact O-N 3.08Å; M242-S245 WeakPolarHBondContact O-CB 3.36Å; M242-S245 PolarHBondContact O-N 2.96Å; M242-S245 VanDerWaalsContact O-N 3.09Å; M242-G246 PolarHBondContact O-N 3.34Å; M242-L349 HydrophobicContact CG-CD1 3.67Å; M242-L349 HydrophobicContact SD-CD1 4.3Å
243	I	95.6	Very high	94.7	Very high	1 Å²	1	7.5 Å²	7.5	1%	0.005	6%	0.056	C	C	.	.	H	α-helix	trans	-60.3	-46	179.6	-56.1	173.9	0	0	0	110.5	I198 G240 A247 A285 V289 F302	I198-I243 HydrophobicContact CD1-CD1 3.79Å; I198-I243 HydrophobicContact CG1-CB 4.42Å; I198-I243 HydrophobicContact CG1-CD1 4.09Å; G240-I243 PolarHBondContact O-N 3.38Å; I243-A247 WeakPolarHBondContact O-CB 3.38Å; I243-A247 PolarHBondContact O-N 2.96Å; I243-A247 VanDerWaalsContact O-N 3.16Å; I243-A285 HydrophobicContact CG2-CB 4.06Å; I243-V289 HydrophobicContact CD1-CG2 3.65Å; I243-V289 HydrophobicContact CG1-CG2 3.71Å; I243-V289 HydrophobicContact CG2-CG2 4.4Å; I243-F302 HydrophobicContact CD1-CZ 4.18Å; I243-F302 HydrophobicContact CG2-CE1 3.69Å; I243-F302 HydrophobicContact CG2-CZ 3.97Å
244	H	96.5	Very high	94.7	Very high	0 Å²	0	6.7 Å²	6.7	0%	0	5%	0.048	C	C	.	.	H	α-helix	trans	-68.5	-36.1	174.5	-173.4	-168	0	0	0	111.6	I192 G197 I201 V213 T218 K222 M242 A247 V248	I192-H244 PolarHBondContact O-CE1 2.91Å; I192-H244 VanDerWaalsContact O-CE1 3.26Å; G197-H244 WeakPolarHBondContact CA-ND1 3.44Å; I201-H244 HydrophobicContact CG1-CB 4.25Å; V213-H244 WeakPolarHBondContact CA-NE2 3.43Å; V213-H244 WeakPolarHBondContact CG2-NE2 3.45Å; V213-H244 PolarHBondContact O-NE2 3.27Å; T218-H244 WeakPolarHBondContact CG2-CE1 3.31Å; K222-H244 HydrophobicContact CD-CB 4.35Å; K222-H244 WeakPolarHBondContact CD-ND1 3.41Å; K222-H244 WeakPolarHBondContact CE-ND1 3.47Å; M242-H244 PolarHBondContact O-N 3.08Å; H244-A247 PolarHBondContact O-N 3.47Å; H244-V248 VanDerWaalsContact CD2-CG2 3.44Å; H244-V248 WeakPolarHBondContact CD2-CG2 3.48Å; H244-V248 WeakPolarHBondContact NE2-CG2 3.48Å; H244-V248 WeakPolarHBondContact O-CG2 3.23Å; H244-V248 PolarHBondContact O-N 2.95Å
245	S	96.9	Very high	94.5	Very high	2 Å²	2	7.3 Å²	7.3	1%	0.014	5%	0.051	C	C	.	.	H	α-helix	trans	-63.6	-46.2	178.6	-59.8	0	0	0	0	112.6	P241 M242 V248 L249	P241-S245 WeakPolarHBondContact O-CB 3.26Å; P241-S245 PolarHBondContact O-N 3.03Å; P241-S245 PolarHBondContact O-OG 3.46Å; M242-S245 WeakPolarHBondContact O-CB 3.36Å; M242-S245 PolarHBondContact O-N 2.96Å; M242-S245 VanDerWaalsContact O-N 3.09Å; S245-V248 PolarHBondContact O-N 3.4Å; S245-L249 PolarHBondContact O-N 3.37Å
246	G	96.8	Very high	94.1	Very high	0 Å²	0	7.5 Å²	7.5	0%	0	5%	0.053	C	C	.	.	H	α-helix	trans	-63.7	-40.4	174.6	0	0	0	0	0	113	M242 V248 L249 A250 G284	M242-G246 PolarHBondContact O-N 3.34Å; G246-V248 PolarHBondContact O-N 3.01Å; G246-L249 WeakPolarHBondContact O-CB 3.46Å; G246-L249 PolarHBondContact O-N 3.38Å; G246-A250 WeakPolarHBondContact O-CB 3.36Å; G246-A250 PolarHBondContact O-N 3.44Å; G246-G284 CarbonylContact C-O 3.44Å; G246-G284 WeakPolarHBondContact CA-O 3.42Å; G246-G284 WeakPolarHBondContact O-CA 3.4Å
247	A	95.9	Very high	93.7	Very high	0 Å²	0	12.5 Å²	12.5	0%	0	7%	0.072	C	C	.	.	H	α-helix	trans	-61.2	-40.6	173	0	0	0	0	0	113.2	I201 I243 H244 A250 A251 V281	I201-A247 HydrophobicContact CD1-CB 3.48Å; I201-A247 VanDerWaalsContact CD1-CB 3.48Å; I201-A247 HydrophobicContact CG1-CB 3.91Å; I201-A247 HydrophobicContact CG2-CB 4.42Å; I243-A247 WeakPolarHBondContact O-CB 3.38Å; I243-A247 PolarHBondContact O-N 2.96Å; I243-A247 VanDerWaalsContact O-N 3.16Å; H244-A247 PolarHBondContact O-N 3.47Å; A247-A250 PolarHBondContact O-N 2.98Å; A247-A251 WeakPolarHBondContact O-CB 3.41Å; A247-A251 PolarHBondContact O-N 3.07Å; A247-A251 VanDerWaalsContact O-N 3.08Å; A247-V281 HydrophobicContact CB-CG1 4.02Å
248	V	96.3	Very high	93.3	Very high	7 Å²	7	13.6 Å²	13.6	4%	0.042	8%	0.08	C	C	.	.	H	α-helix	trans	-69.3	-39.7	176.5	-179.4	0	0	0	0	111.4	V213 L219 H244 S245 G246 A251 G252	V213-V248 WeakPolarHBondContact O-CG2 3.38Å; L219-V248 HydrophobicContact CB-CB 4.32Å; L219-V248 HydrophobicContact CB-CG1 3.79Å; H244-V248 VanDerWaalsContact CD2-CG2 3.44Å; H244-V248 WeakPolarHBondContact CD2-CG2 3.48Å; H244-V248 WeakPolarHBondContact NE2-CG2 3.48Å; H244-V248 WeakPolarHBondContact O-CG2 3.23Å; H244-V248 PolarHBondContact O-N 2.95Å; S245-V248 PolarHBondContact O-N 3.4Å; G246-V248 PolarHBondContact O-N 3.01Å; V248-A251 PolarHBondContact O-N 2.88Å; V248-G252 PolarHBondContact O-N 2.8Å; V248-G252 VanDerWaalsContact O-N 3.1Å
249	L	95.6	Very high	92.6	Very high	23 Å²	23	18.2 Å²	18.2	12%	0.12	11%	0.109	C	C	.	.	H	α-helix	trans	-56.7	-51	172.4	-80.7	176.8	0	0	0	110.8	L128 I132 L219 S245 G246 A251 G252 V253	L128-L249 HydrophobicContact CB-CD1 3.83Å; L128-L249 HydrophobicContact CB-CD2 4.37Å; I132-L249 HydrophobicContact CD1-CD1 3.78Å; I132-L249 HydrophobicContact CD1-CD2 4.08Å; I132-L249 HydrophobicContact CD1-CG 4.08Å; I132-L249 HydrophobicContact CG1-CD1 4.39Å; L219-L249 HydrophobicContact CD2-CD2 3.91Å; L219-L249 HydrophobicContact CD2-CG 4.18Å; S245-L249 PolarHBondContact O-N 3.37Å; G246-L249 WeakPolarHBondContact O-CB 3.46Å; G246-L249 PolarHBondContact O-N 3.38Å; L249-A251 PolarHBondContact O-N 2.97Å; L249-G252 PolarHBondContact O-N 3.41Å; L249-V253 WeakPolarHBondContact O-CB 3.41Å; L249-V253 WeakPolarHBondContact O-CG2 3.21Å; L249-V253 PolarHBondContact O-N 2.86Å
250	A	95.7	Very high	92.1	Very high	0 Å²	0	21 Å²	21	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-59.6	-45	-179.6	0	0	0	0	0	113.6	I125 G246 A247 G252 S254 F280	I125-A250 HydrophobicContact CD1-CB 3.61Å; I125-A250 HydrophobicContact CG1-CB 4.04Å; I125-A250 HydrophobicContact CG2-CB 4.06Å; G246-A250 WeakPolarHBondContact O-CB 3.36Å; G246-A250 PolarHBondContact O-N 3.44Å; A247-A250 PolarHBondContact O-N 2.98Å; A250-G252 PolarHBondContact O-N 3.28Å; A250-S254 VanDerWaalsContact O-CB 3.27Å; A250-S254 WeakPolarHBondContact O-CB 3.29Å; A250-S254 PolarHBondContact O-N 3.41Å; A250-S254 VanDerWaalsContact O-N 3.15Å; A250-S254 PolarHBondContact O-OG 3.49Å; A250-F280 HydrophobicContact CB-CB 4.3Å; A250-F280 WeakPolarHBondContact CB-O 3.33Å
251	A	94.3	Very high	91.7	Very high	10 Å²	10	27 Å²	27	8%	0.083	16%	0.16	C	C	.	.	H	α-helix	trans	-66.4	-19.3	175.4	0	0	0	0	0	114.1	V214 A247 V248 L249 Q255 V281	V214-A251 HydrophobicContact CB-CB 3.54Å; V214-A251 HydrophobicContact CG1-CB 3.49Å; V214-A251 VanDerWaalsContact CG1-CB 3.49Å; V214-A251 HydrophobicContact CG2-CB 4.14Å; A247-A251 WeakPolarHBondContact O-CB 3.41Å; A247-A251 PolarHBondContact O-N 3.07Å; A247-A251 VanDerWaalsContact O-N 3.08Å; V248-A251 PolarHBondContact O-N 2.88Å; L249-A251 PolarHBondContact O-N 2.97Å; A251-Q255 WeakPolarHBondContact O-CG 3.18Å; A251-V281 HydrophobicContact CB-CG2 3.72Å
252	G	92.6	Very high	91.1	Very high	38 Å²	38	36.6 Å²	36.6	39%	0.392	20%	0.201	S	C	.	.	H	α-helix	trans	-88.7	-51.8	173.8	0	0	0	0	0	113.1	V248 L249 A250 Q255	V248-G252 PolarHBondContact O-N 2.8Å; V248-G252 VanDerWaalsContact O-N 3.1Å; L249-G252 PolarHBondContact O-N 3.41Å; A250-G252 PolarHBondContact O-N 3.28Å; G252-Q255 PolarHBondContact O-N 3.36Å
253	V	92.9	Very high	90.7	Very high	30 Å²	30	42.1 Å²	42.1	18%	0.182	23%	0.225	C	C	.	.	H	α-helix	trans	-63.6	-46.4	-175	172.8	0	0	0	0	111.5	I121 L124 L128 L249 Q255 G256	I121-V253 HydrophobicContact CG2-CG1 4.43Å; L124-V253 HydrophobicContact CD2-CG1 3.7Å; L124-V253 HydrophobicContact CG-CG1 4.13Å; L128-V253 HydrophobicContact CD1-CG2 3.84Å; L249-V253 WeakPolarHBondContact O-CB 3.41Å; L249-V253 WeakPolarHBondContact O-CG2 3.21Å; L249-V253 PolarHBondContact O-N 2.86Å; V253-Q255 PolarHBondContact O-N 2.91Å; V253-Q255 VanDerWaalsContact O-N 3.1Å; V253-G256 PolarHBondContact O-N 3.19Å
254	S	92.5	Very high	90.3	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	24%	0.243	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.3	-26.8	-179.6	56.9	0	0	0	0	114.4	A250 F271	A250-S254 VanDerWaalsContact O-CB 3.27Å; A250-S254 WeakPolarHBondContact O-CB 3.29Å; A250-S254 PolarHBondContact O-N 3.41Å; A250-S254 VanDerWaalsContact O-N 3.15Å; A250-S254 PolarHBondContact O-OG 3.49Å; S254-F271 WeakPolarHBondContact O-CB 3.43Å
255	Q	89.8	Confident	89.7	Confident	20 Å²	20	50.8 Å²	50.8	9%	0.093	27%	0.267	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.2	-16.3	-173.2	-59.6	-61.2	-69.4	0	0	113.4	A251 G252 V253 R257 F271 R272	A251-Q255 WeakPolarHBondContact O-CG 3.18Å; G252-Q255 PolarHBondContact O-N 3.36Å; V253-Q255 PolarHBondContact O-N 2.91Å; V253-Q255 VanDerWaalsContact O-N 3.1Å; Q255-R257 HydrophobicContact CB-CG 4.21Å; Q255-R257 PolarHBondContact O-N 2.95Å; Q255-R257 VanDerWaalsContact O-N 3.1Å; Q255-F271 PolarHBondContact NE2-O 3.34Å; Q255-R272 PolarHBondContact O-NE 2.88Å; Q255-R272 PolarHBondContact O-NH2 3.4Å; Q255-R272 VanDerWaalsContact O-NH2 3.16Å
256	G	86.1	Confident	89	Confident	11 Å²	11	58.8 Å²	58.8	11%	0.113	30%	0.301	C	S	.	.	T	Hydrogen-bonded Turn	trans	60.8	16.6	-177.7	0	0	0	0	0	115.4	V253 F265 I267	V253-G256 PolarHBondContact O-N 3.19Å; G256-F265 WeakPolarHBondContact O-CB 3.43Å; G256-F265 PolarHBondContact O-N 2.98Å; G256-F265 VanDerWaalsContact O-N 3.13Å; G256-I267 WeakPolarHBondContact CA-O 3.39Å
257	R	86.6	Confident	88.4	Confident	107 Å²	107	63.3 Å²	63.3	40%	0.404	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.9	138.1	-179.6	61.9	-178.1	174.5	170.8	-1.6	111.7	Q255 K263 D264	Q255-R257 HydrophobicContact CB-CG 4.21Å; Q255-R257 PolarHBondContact O-N 2.95Å; Q255-R257 VanDerWaalsContact O-N 3.1Å; R257-K263 CarbonylContact C-O 3.34Å; R257-D264 HydrophobicContact CB-CB 4.27Å
258	S	84.9	Confident	87.9	Confident	24 Å²	24	65.6 Å²	65.6	17%	0.168	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	98.2	170.4	-176.6	0	0	0	0	110	S260 L261 K262 K263	S258-S260 PolarHBondContact O-N 3.34Å; S258-L261 CarbonylContact O-C 3.47Å; S258-L261 PolarHBondContact O-N 3.41Å; S258-L261 WeakPolarHBondContact OG-CB 3.31Å; S258-L261 WeakPolarHBondContact OG-CG 3.44Å; S258-L261 PolarHBondContact OG-N 3.1Å; S258-K262 PolarHBondContact O-N 3.42Å; S258-K263 PolarHBondContact N-O 3.25Å; S258-K263 PolarHBondContact O-N 2.98Å; S258-K263 VanDerWaalsContact O-N 3.08Å
259	T	81	Confident	87.4	Confident	106 Å²	106	70.3 Å²	70.3	65%	0.65	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.5	-30.2	173.1	54.4	0	0	0	0	112.2
260	S	81.7	Confident	87	Confident	60 Å²	60	71 Å²	71	42%	0.42	36%	0.357	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.9	-30.8	177.7	-58.6	0	0	0	0	112.8	S258	S258-S260 PolarHBondContact O-N 3.34Å
261	L	82.3	Confident	86.7	Confident	125 Å²	125	71.1 Å²	71.1	65%	0.654	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.6	7.7	178.5	-57.5	175.8	0	0	0	113	L216 S258 K263	L216-L261 HydrophobicContact CD2-CD1 4.41Å; S258-L261 CarbonylContact O-C 3.47Å; S258-L261 PolarHBondContact O-N 3.41Å; S258-L261 WeakPolarHBondContact OG-CB 3.31Å; S258-L261 WeakPolarHBondContact OG-CG 3.44Å; S258-L261 PolarHBondContact OG-N 3.1Å; L261-K263 PolarHBondContact O-N 3.35Å; L261-K263 VanDerWaalsContact O-N 3.1Å
262	K	84.5	Confident	86.4	Confident	203 Å²	203	73.5 Å²	73.5	88%	0.883	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.8	31.7	-174.5	-60	-175.3	178.3	-178.4	0	114.3	S258	S258-K262 PolarHBondContact O-N 3.42Å
263	K	85.8	Confident	86.3	Confident	117 Å²	117	74.4 Å²	74.4	51%	0.509	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	120.6	-177.2	-173.4	172.7	-178.6	176.8	0	111.1	R257 S258 L261 F265	R257-K263 CarbonylContact C-O 3.34Å; S258-K263 PolarHBondContact N-O 3.25Å; S258-K263 PolarHBondContact O-N 2.98Å; S258-K263 VanDerWaalsContact O-N 3.08Å; L261-K263 PolarHBondContact O-N 3.35Å; L261-K263 VanDerWaalsContact O-N 3.1Å; K263-F265 HydrophobicContact CD-CE1 4.12Å; K263-F265 HydrophobicContact CD-CE2 4.26Å; K263-F265 HydrophobicContact CD-CZ 3.8Å; K263-F265 HydrophobicContact CG-CE2 4.22Å; K263-F265 HydrophobicContact CG-CZ 4.25Å
264	D	87.1	Confident	86.1	Confident	71 Å²	71	74.1 Å²	74.1	38%	0.38	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	138.5	168.4	-157.3	-41.5	0	0	0	109.3	R257 K266 R272	R257-D264 HydrophobicContact CB-CB 4.27Å; D264-K266 PolarHBondContact OD1-N 3.43Å; D264-R272 VanDerWaalsContact CG-NH2 3.35Å; D264-R272 IonicContact OD1-CZ 3.2Å; D264-R272 IonicContact OD1-NH1 2.71Å; D264-R272 IonicContact OD1-NH2 3.41Å; D264-R272 PolarHBondContact OD1-NH2 3.09Å; D264-R272 IonicContact OD2-CZ 3.91Å; D264-R272 IonicContact OD2-NH1 2.85Å; D264-R272 PolarHBondContact OD2-NH1 3.48Å; D264-R272 IonicContact OD2-NH2 3.89Å; D264-R272 PolarHBondContact OD2-NH2 3.42Å
265	F	84.1	Confident	85.9	Confident	112 Å²	112	74.7 Å²	74.7	49%	0.491	36%	0.357	S	S	.	.			trans	-99.9	-4.4	177.5	-65.4	-93.8	0	0	0	113.1	G256 K263 I267	G256-F265 WeakPolarHBondContact O-CB 3.43Å; G256-F265 PolarHBondContact O-N 2.98Å; G256-F265 VanDerWaalsContact O-N 3.13Å; K263-F265 HydrophobicContact CD-CE1 4.12Å; K263-F265 HydrophobicContact CD-CE2 4.26Å; K263-F265 HydrophobicContact CD-CZ 3.8Å; K263-F265 HydrophobicContact CG-CE2 4.22Å; K263-F265 HydrophobicContact CG-CZ 4.25Å; F265-I267 HydrophobicContact CB-CD1 4.39Å; F265-I267 PolarHBondContact O-N 3.49Å
266	K	82.8	Confident	86	Confident	171 Å²	171	74.9 Å²	74.9	74%	0.743	36%	0.358	S	S	*	.	S	Bend	trans	55.5	31.1	-175.5	-57.5	-171	177	-171.4	0	114.5	D264 E269	D264-K266 PolarHBondContact OD1-N 3.43Å; K266-E269 WeakPolarHBondContact CA-OE1 3.29Å
267	I	84.9	Confident	86.3	Confident	94 Å²	94	76.2 Å²	76.2	48%	0.482	36%	0.361	S	S	.	.			trans	-119.1	152.2	175.3	-60.6	163.6	0	0	0	106.7	G256 F265 E269	G256-I267 WeakPolarHBondContact CA-O 3.39Å; F265-I267 HydrophobicContact CB-CD1 4.39Å; F265-I267 PolarHBondContact O-N 3.49Å; I267-E269 VanDerWaalsContact C-N 3.28Å; I267-E269 PolarHBondContact O-N 2.87Å
268	F	85.4	Confident	86.5	Confident	49 Å²	49	71.9 Å²	71.9	22%	0.215	34%	0.344	C	S	.	.	S	Bend	trans	59.5	30.6	175.7	-57.5	-33.5	0	0	0	115.1	I121 Y270 F271	I121-F268 HydrophobicContact CD1-CD1 3.81Å; I121-F268 HydrophobicContact CD1-CD2 4.04Å; I121-F268 HydrophobicContact CD1-CE1 3.93Å; I121-F268 HydrophobicContact CD1-CE2 4.15Å; I121-F268 HydrophobicContact CD1-CG 3.88Å; I121-F268 HydrophobicContact CD1-CZ 4.11Å; I121-F268 HydrophobicContact CG1-CD1 4.33Å; I121-F268 HydrophobicContact CG1-CD2 4.09Å; I121-F268 HydrophobicContact CG1-CE1 4Å; I121-F268 HydrophobicContact CG1-CE2 3.74Å; I121-F268 HydrophobicContact CG1-CG 4.4Å; I121-F268 HydrophobicContact CG1-CZ 3.7Å; F268-Y270 VanDerWaalsContact C-N 3.34Å; F268-Y270 PolarHBondContact O-N 3.05Å; F268-F271 HydrophobicContact CB-CD2 3.8Å; F268-F271 AromaticContact CD1-CD2 3.98Å; F268-F271 HydrophobicContact CD1-CD2 3.98Å; F268-F271 AromaticContact CD1-CE2 3.97Å; F268-F271 HydrophobicContact CD1-CE2 3.97Å; F268-F271 HydrophobicContact CG-CD2 4.15Å; F268-F271 PolarHBondContact O-N 3.38Å; F268-F271 VanDerWaalsContact O-N 3.16Å
269	E	85.4	Confident	86.9	Confident	106 Å²	106	71.9 Å²	71.9	50%	0.495	34%	0.343	S	S	.	.	G	3₁₀ helix	trans	-62.9	-36.4	-177.4	-57.7	-166.7	158	0	0	113.4	K266 I267 F271 R272	K266-E269 WeakPolarHBondContact CA-OE1 3.29Å; I267-E269 VanDerWaalsContact C-N 3.28Å; I267-E269 PolarHBondContact O-N 2.87Å; E269-F271 VanDerWaalsContact C-N 3.25Å; E269-F271 PolarHBondContact O-N 2.95Å; E269-R272 VanDerWaalsContact O-CB 3.31Å; E269-R272 WeakPolarHBondContact O-CB 3.19Å; E269-R272 VanDerWaalsContact O-CG 3.28Å; E269-R272 WeakPolarHBondContact O-CG 3.43Å; E269-R272 PolarHBondContact O-N 3.46Å
270	Y	86.1	Confident	87.6	Confident	38 Å²	38	67.1 Å²	67.1	15%	0.149	31%	0.313	C	S	.	.	G	3₁₀ helix	trans	-56.8	-36.3	174.9	-176.6	-86.7	0	0	0	113.1	M106 L114 F268 R272 R273	M106-Y270 HydrophobicContact SD-CE2 4.05Å; L114-Y270 HydrophobicContact CD1-CD1 4.22Å; L114-Y270 HydrophobicContact CD1-CD2 3.91Å; L114-Y270 HydrophobicContact CD1-CE1 4.28Å; L114-Y270 HydrophobicContact CD1-CE2 3.93Å; L114-Y270 HydrophobicContact CD1-CG 4.06Å; L114-Y270 HydrophobicContact CD2-CD1 4.04Å; L114-Y270 HydrophobicContact CD2-CD2 4.42Å; L114-Y270 HydrophobicContact CD2-CG 3.84Å; F268-Y270 VanDerWaalsContact C-N 3.34Å; F268-Y270 PolarHBondContact O-N 3.05Å; Y270-R272 PolarHBondContact O-N 3.41Å; Y270-R273 PolarHBondContact O-NE 3.25Å; Y270-R273 VanDerWaalsContact O-NE 3.12Å
271	F	89.9	Confident	88.2	Confident	2 Å²	2	64.3 Å²	64.3	1%	0.009	29%	0.293	C	S	.	.	G	3₁₀ helix	trans	-80.4	8.1	-175.6	-56.3	-64.8	0	0	0	113.7	L114 R118 I121 S254 Q255 F268 E269 R273 E276 F280	L114-F271 HydrophobicContact CB-CZ 4.48Å; L114-F271 HydrophobicContact CD2-CE2 4.21Å; L114-F271 HydrophobicContact CD2-CZ 3.89Å; R118-F271 HydrophobicContact CG-CD1 4.36Å; R118-F271 HydrophobicContact CG-CE1 3.44Å; R118-F271 VanDerWaalsContact CG-CE1 3.44Å; R118-F271 HydrophobicContact CG-CZ 3.8Å; I121-F271 HydrophobicContact CD1-CD2 3.72Å; I121-F271 HydrophobicContact CD1-CE2 3.83Å; I121-F271 HydrophobicContact CD1-CG 4.27Å; I121-F271 HydrophobicContact CD1-CZ 4.48Å; S254-F271 WeakPolarHBondContact O-CB 3.43Å; Q255-F271 PolarHBondContact NE2-O 3.34Å; F268-F271 HydrophobicContact CB-CD2 3.8Å; F268-F271 AromaticContact CD1-CD2 3.98Å; F268-F271 HydrophobicContact CD1-CD2 3.98Å; F268-F271 AromaticContact CD1-CE2 3.97Å; F268-F271 HydrophobicContact CD1-CE2 3.97Å; F268-F271 HydrophobicContact CG-CD2 4.15Å; F268-F271 PolarHBondContact O-N 3.38Å; F268-F271 VanDerWaalsContact O-N 3.16Å; E269-F271 VanDerWaalsContact C-N 3.25Å; E269-F271 PolarHBondContact O-N 2.95Å; F271-R273 PolarHBondContact O-N 2.97Å; F271-E276 HydrophobicContact CB-CB 4.43Å; F271-E276 HydrophobicContact CD1-CB 4.19Å; F271-E276 HydrophobicContact CD1-CG 3.94Å; F271-E276 WeakPolarHBondContact CD1-OE2 3.37Å; F271-F280 HydrophobicContact CB-CE2 4.22Å; F271-F280 AromaticContact CD1-CE2 3.97Å; F271-F280 HydrophobicContact CD1-CE2 3.97Å; F271-F280 HydrophobicContact CD1-CZ 4.3Å; F271-F280 HydrophobicContact CG-CE2 4.14Å
272	R	89.2	Confident	88.8	Confident	59 Å²	59	58.7 Å²	58.7	22%	0.223	26%	0.264	C	S	.	.			trans	-80	32.9	178.8	-62.9	175.1	179.3	-169.3	-2.3	113.3	Q255 D264 E269 Y270	Q255-R272 PolarHBondContact O-NE 2.88Å; Q255-R272 PolarHBondContact O-NH2 3.4Å; Q255-R272 VanDerWaalsContact O-NH2 3.16Å; D264-R272 VanDerWaalsContact CG-NH2 3.35Å; D264-R272 IonicContact OD1-CZ 3.2Å; D264-R272 IonicContact OD1-NH1 2.71Å; D264-R272 IonicContact OD1-NH2 3.41Å; D264-R272 PolarHBondContact OD1-NH2 3.09Å; D264-R272 IonicContact OD2-CZ 3.91Å; D264-R272 IonicContact OD2-NH1 2.85Å; D264-R272 PolarHBondContact OD2-NH1 3.48Å; D264-R272 IonicContact OD2-NH2 3.89Å; D264-R272 PolarHBondContact OD2-NH2 3.42Å; E269-R272 VanDerWaalsContact O-CB 3.31Å; E269-R272 WeakPolarHBondContact O-CB 3.19Å; E269-R272 VanDerWaalsContact O-CG 3.28Å; E269-R272 WeakPolarHBondContact O-CG 3.43Å; E269-R272 PolarHBondContact O-N 3.46Å; Y270-R272 PolarHBondContact O-N 3.41Å
273	R	88.9	Confident	89.3	Confident	57 Å²	57	49 Å²	49	22%	0.215	22%	0.222	C	C	.	.	S	Bend	trans	-111.4	148.4	-179	-56.5	175.9	-160.3	-145.8	-9.3	109.5	E102 Y270 F271 T275 K277	E102-R273 VanDerWaalsContact CD-NH2 3.27Å; E102-R273 IonicContact OE1-NH2 3.67Å; E102-R273 PolarHBondContact OE1-NH2 3.45Å; E102-R273 VanDerWaalsContact OE1-NH2 3.11Å; E102-R273 IonicContact OE2-CZ 3.12Å; E102-R273 IonicContact OE2-NH1 2.83Å; E102-R273 IonicContact OE2-NH2 2.74Å; E102-R273 PolarHBondContact OE2-NH2 3.05Å; Y270-R273 PolarHBondContact O-NE 3.25Å; Y270-R273 VanDerWaalsContact O-NE 3.12Å; F271-R273 PolarHBondContact O-N 2.97Å; R273-T275 VanDerWaalsContact C-N 3.25Å; R273-T275 PolarHBondContact O-N 3.33Å; R273-K277 WeakPolarHBondContact O-CB 3.3Å; R273-K277 PolarHBondContact O-N 3.23Å; R273-K277 VanDerWaalsContact O-N 3.15Å
274	D	89.4	Confident	89.8	Confident	25 Å²	25	43.5 Å²	43.5	13%	0.134	20%	0.198	C	C	.	.	H	α-helix	trans	-68.2	-25.7	-178.7	-105.2	1.3	0	0	0	112.4	L89 D90 K209 K277 R278	L89-D274 HydrophobicContact CD1-CB 4.23Å; L89-D274 VanDerWaalsContact CD1-CG 3.4Å; L89-D274 VanDerWaalsContact CD1-OD2 3.23Å; L89-D274 WeakPolarHBondContact CD1-OD2 3.47Å; L89-D274 HydrophobicContact CD2-CB 4.49Å; L89-D274 HydrophobicContact CG-CB 3.96Å; L89-D274 WeakPolarHBondContact CG-OD2 3.47Å; D90-D274 HydrophobicContact CB-CB 4.37Å; D90-D274 PolarHBondContact N-OD2 3.07Å; D90-D274 VanDerWaalsContact N-OD2 3.13Å; D90-D274 WeakPolarHBondContact O-CB 3.36Å; K209-D274 WeakPolarHBondContact CE-OD2 3.36Å; K209-D274 IonicContact NZ-OD2 2.74Å; K209-D274 PolarHBondContact NZ-OD2 2.99Å; D274-K277 IonicContact OD1-NZ 2.95Å; D274-K277 PolarHBondContact OD1-NZ 3.09Å; D274-R278 PolarHBondContact O-N 3.17Å
275	T	88.9	Confident	90.3	Very high	11 Å²	11	40.1 Å²	40.1	7%	0.067	18%	0.18	C	C	.	.	H	α-helix	trans	-58.1	-71.5	169.6	35.4	0	0	0	0	113.3	Y91 N93 R273 K277 R278 D279	Y91-T275 HydrophobicContact CD2-CG2 3.95Å; Y91-T275 HydrophobicContact CE2-CG2 4.05Å; Y91-T275 HydrophobicContact CG-CG2 4.22Å; Y91-T275 WeakPolarHBondContact O-CG2 3.42Å; N93-T275 VanDerWaalsContact OD1-CG2 3.31Å; N93-T275 WeakPolarHBondContact OD1-CG2 3.48Å; N93-T275 PolarHBondContact OD1-OG1 3.08Å; R273-T275 VanDerWaalsContact C-N 3.25Å; R273-T275 PolarHBondContact O-N 3.33Å; T275-K277 PolarHBondContact O-N 3.34Å; T275-K277 VanDerWaalsContact O-N 3.11Å; T275-R278 PolarHBondContact O-N 3Å; T275-D279 PolarHBondContact O-N 3.45Å; T275-D279 VanDerWaalsContact O-N 3.09Å
276	E	91.1	Very high	90.8	Very high	25 Å²	25	34.8 Å²	34.8	12%	0.117	16%	0.157	C	C	.	.	H	α-helix	trans	-53.6	-36.6	179.7	-62.9	-80.9	169	0	0	111.1	R118 F271 D279 F280	R118-E276 IonicContact CZ-OE1 2.7Å; R118-E276 VanDerWaalsContact CZ-OE1 3.27Å; R118-E276 IonicContact CZ-OE2 2.9Å; R118-E276 IonicContact NE-OE1 3.59Å; R118-E276 PolarHBondContact NE-OE1 3.26Å; R118-E276 IonicContact NE-OE2 2.74Å; R118-E276 PolarHBondContact NE-OE2 2.89Å; R118-E276 IonicContact NH2-OE1 3.95Å; R118-E276 PolarHBondContact NH2-OE1 3.17Å; R118-E276 IonicContact NH2-OE2 3.73Å; F271-E276 HydrophobicContact CB-CB 4.43Å; F271-E276 HydrophobicContact CD1-CB 4.19Å; F271-E276 HydrophobicContact CD1-CG 3.94Å; F271-E276 WeakPolarHBondContact CD1-OE2 3.37Å; E276-D279 PolarHBondContact O-N 3.49Å; E276-F280 HydrophobicContact CB-CD2 4.41Å; E276-F280 HydrophobicContact CB-CE2 4.2Å; E276-F280 WeakPolarHBondContact O-CD2 3.45Å; E276-F280 WeakPolarHBondContact O-CG 3.1Å; E276-F280 PolarHBondContact O-N 3.49Å
277	K	92.4	Very high	91.6	Very high	38 Å²	38	26.6 Å²	26.6	17%	0.165	12%	0.121	C	C	.	.	H	α-helix	trans	-66.4	-35.7	176.6	-179.5	-179.9	155.6	-143.7	0	113.4	R273 D274 T275 V281	R273-K277 WeakPolarHBondContact O-CB 3.3Å; R273-K277 PolarHBondContact O-N 3.23Å; R273-K277 VanDerWaalsContact O-N 3.15Å; D274-K277 IonicContact OD1-NZ 2.95Å; D274-K277 PolarHBondContact OD1-NZ 3.09Å; T275-K277 PolarHBondContact O-N 3.34Å; T275-K277 VanDerWaalsContact O-N 3.11Å; K277-V281 WeakPolarHBondContact O-CB 3.43Å; K277-V281 WeakPolarHBondContact O-CG2 3.48Å; K277-V281 PolarHBondContact O-N 3.46Å
278	R	91.8	Very high	92.1	Very high	17 Å²	17	22.1 Å²	22.1	6%	0.064	10%	0.098	C	C	.	.	H	α-helix	trans	-68.4	-43.7	172	-164.3	174.8	74.1	150.8	-5.1	110.8	L89 Y91 L205 D274 T275 F280 V281 S282	L89-R278 HydrophobicContact CD2-CB 3.82Å; L89-R278 HydrophobicContact CD2-CG 4.05Å; Y91-R278 HydrophobicContact CD2-CB 3.88Å; Y91-R278 HydrophobicContact CD2-CG 4.4Å; Y91-R278 HydrophobicContact CE2-CB 3.95Å; Y91-R278 HydrophobicContact CE2-CG 4.49Å; L205-R278 HydrophobicContact CD2-CG 4.12Å; L205-R278 WeakPolarHBondContact O-CD 3.48Å; L205-R278 PolarHBondContact O-NH1 3.35Å; D274-R278 PolarHBondContact O-N 3.17Å; T275-R278 PolarHBondContact O-N 3Å; R278-F280 PolarHBondContact O-N 2.98Å; R278-V281 PolarHBondContact O-N 3.46Å; R278-S282 PolarHBondContact O-N 3.11Å; R278-S282 PolarHBondContact O-OG 2.69Å
279	D	92.6	Very high	92.6	Very high	24 Å²	24	19.9 Å²	19.9	13%	0.128	9%	0.088	C	C	.	.	H	α-helix	trans	-62	-38.3	178.2	-79	26	0	0	0	112.8	Y91 T275 E276 S282 A283 L315	Y91-D279 PolarHBondContact OH-OD1 2.78Å; T275-D279 PolarHBondContact O-N 3.45Å; T275-D279 VanDerWaalsContact O-N 3.09Å; E276-D279 PolarHBondContact O-N 3.49Å; D279-S282 PolarHBondContact O-OG 2.98Å; D279-A283 PolarHBondContact O-N 3.08Å; D279-L315 HydrophobicContact CB-CD1 3.67Å; D279-L315 HydrophobicContact CB-CD2 4.31Å
280	F	95.3	Very high	93.2	Very high	6 Å²	6	14.8 Å²	14.8	3%	0.026	7%	0.065	C	C	.	.	H	α-helix	trans	-72	-36.7	170.6	-69.8	-56.8	0	0	0	112.1	R118 I121 I125 A250 F271 E276 R278 A283 G284	R118-F280 HydrophobicContact CB-CE1 4.42Å; R118-F280 HydrophobicContact CB-CZ 4.23Å; R118-F280 HydrophobicContact CG-CZ 4.03Å; I121-F280 HydrophobicContact CB-CD1 4.38Å; I121-F280 HydrophobicContact CB-CE1 3.68Å; I121-F280 HydrophobicContact CB-CZ 3.93Å; I121-F280 HydrophobicContact CD1-CE1 4.35Å; I121-F280 HydrophobicContact CD1-CE2 4.18Å; I121-F280 HydrophobicContact CD1-CZ 3.7Å; I121-F280 HydrophobicContact CG1-CZ 4.44Å; I121-F280 HydrophobicContact CG2-CD1 3.56Å; I121-F280 HydrophobicContact CG2-CD2 4.43Å; I121-F280 HydrophobicContact CG2-CE1 3.34Å; I121-F280 HydrophobicContact CG2-CE2 4.25Å; I121-F280 HydrophobicContact CG2-CG 4.12Å; I121-F280 HydrophobicContact CG2-CZ 3.71Å; I125-F280 HydrophobicContact CD1-CB 4.11Å; I125-F280 HydrophobicContact CD1-CD1 3.96Å; I125-F280 HydrophobicContact CD1-CG 4.34Å; A250-F280 HydrophobicContact CB-CB 4.3Å; A250-F280 WeakPolarHBondContact CB-O 3.33Å; F271-F280 HydrophobicContact CB-CE2 4.22Å; F271-F280 AromaticContact CD1-CE2 3.97Å; F271-F280 HydrophobicContact CD1-CE2 3.97Å; F271-F280 HydrophobicContact CD1-CZ 4.3Å; F271-F280 HydrophobicContact CG-CE2 4.14Å; E276-F280 HydrophobicContact CB-CD2 4.41Å; E276-F280 HydrophobicContact CB-CE2 4.2Å; E276-F280 WeakPolarHBondContact O-CD2 3.45Å; E276-F280 WeakPolarHBondContact O-CG 3.1Å; E276-F280 PolarHBondContact O-N 3.49Å; R278-F280 PolarHBondContact O-N 2.98Å; F280-A283 WeakPolarHBondContact O-CB 3.48Å; F280-A283 PolarHBondContact O-N 3.5Å; F280-G284 PolarHBondContact O-N 3.39Å
281	V	95	Very high	93.7	Very high	0 Å²	0	13 Å²	13	0%	0	6%	0.058	C	C	.	.	H	α-helix	trans	-65.3	-37.3	178	164.5	0	0	0	0	112.5	F204 L205 A247 A251 K277 R278 G284 A285	F204-V281 HydrophobicContact CD1-CB 4.25Å; F204-V281 HydrophobicContact CD1-CG1 3.66Å; F204-V281 HydrophobicContact CD1-CG2 4.43Å; F204-V281 HydrophobicContact CE1-CB 3.92Å; F204-V281 HydrophobicContact CE1-CG1 3.85Å; F204-V281 HydrophobicContact CE1-CG2 3.82Å; F204-V281 HydrophobicContact CZ-CG2 4.46Å; L205-V281 HydrophobicContact CD2-CG1 4.06Å; A247-V281 HydrophobicContact CB-CG1 4.02Å; A251-V281 HydrophobicContact CB-CG2 3.72Å; K277-V281 WeakPolarHBondContact O-CB 3.43Å; K277-V281 WeakPolarHBondContact O-CG2 3.48Å; K277-V281 PolarHBondContact O-N 3.46Å; R278-V281 PolarHBondContact O-N 3.46Å; V281-G284 PolarHBondContact O-N 2.8Å; V281-A285 WeakPolarHBondContact O-CB 3.46Å; V281-A285 PolarHBondContact O-N 3.11Å
282	S	94.1	Very high	93.9	Very high	8 Å²	8	12.9 Å²	12.9	6%	0.056	6%	0.057	C	C	.	.	H	α-helix	trans	-65.2	-41.4	172.3	56.7	0	0	0	0	111.6	R278 D279 G284 A285 A286	R278-S282 PolarHBondContact O-N 3.11Å; R278-S282 PolarHBondContact O-OG 2.69Å; D279-S282 PolarHBondContact O-OG 2.98Å; S282-G284 VanDerWaalsContact C-N 3.34Å; S282-G284 PolarHBondContact O-N 3.07Å; S282-A285 PolarHBondContact O-N 2.91Å; S282-A286 WeakPolarHBondContact O-CB 3.41Å; S282-A286 PolarHBondContact O-N 3.09Å
283	A	95.8	Very high	94.2	Very high	0 Å²	0	10.3 Å²	10.3	0%	0	5%	0.048	C	C	.	.	H	α-helix	trans	-60.4	-40	171.5	0	0	0	0	0	112.9	D279 F280 A287 I319 A322	D279-A283 PolarHBondContact O-N 3.08Å; F280-A283 WeakPolarHBondContact O-CB 3.48Å; F280-A283 PolarHBondContact O-N 3.5Å; A283-A287 VanDerWaalsContact O-CB 3.27Å; A283-A287 WeakPolarHBondContact O-CB 3.46Å; A283-A287 PolarHBondContact O-N 3.38Å; A283-I319 HydrophobicContact CB-CB 4.49Å; A283-I319 HydrophobicContact CB-CG1 3.96Å; A283-A322 HydrophobicContact CB-CB 4.29Å
284	G	96.6	Very high	94.4	Very high	0 Å²	0	8.2 Å²	8.2	0%	0	4%	0.043	C	C	.	.	H	α-helix	trans	-69	-37.2	175.6	0	0	0	0	0	113.7	G246 F280 V281 S282 G288	G246-G284 CarbonylContact C-O 3.44Å; G246-G284 WeakPolarHBondContact CA-O 3.42Å; G246-G284 WeakPolarHBondContact O-CA 3.4Å; F280-G284 PolarHBondContact O-N 3.39Å; V281-G284 PolarHBondContact O-N 2.8Å; S282-G284 VanDerWaalsContact C-N 3.34Å; S282-G284 PolarHBondContact O-N 3.07Å; G284-G288 PolarHBondContact O-N 3.31Å
285	A	95.8	Very high	94.7	Very high	0 Å²	0	7 Å²	7	0%	0	4%	0.037	C	C	.	.	H	α-helix	trans	-65.6	-47.4	174.2	0	0	0	0	0	111.1	I201 I243 V281 S282 A287 G288 V289 F302	I201-A285 HydrophobicContact CG2-CB 4.19Å; I243-A285 HydrophobicContact CG2-CB 4.06Å; V281-A285 WeakPolarHBondContact O-CB 3.46Å; V281-A285 PolarHBondContact O-N 3.11Å; S282-A285 PolarHBondContact O-N 2.91Å; A285-A287 PolarHBondContact O-N 3.16Å; A285-G288 WeakPolarHBondContact O-CA 3.44Å; A285-G288 PolarHBondContact O-N 3.44Å; A285-G288 VanDerWaalsContact O-N 3.11Å; A285-V289 PolarHBondContact O-N 2.92Å; A285-F302 HydrophobicContact CB-CE1 4.44Å
286	A	96.5	Very high	95.1	Very high	0 Å²	0	7.1 Å²	7.1	0%	0	4%	0.038	C	C	.	.	H	α-helix	trans	-59.4	-45.9	175.3	0	0	0	0	0	112.1	S282 G288 V289 S290 G299 I319 S323	S282-A286 WeakPolarHBondContact O-CB 3.41Å; S282-A286 PolarHBondContact O-N 3.09Å; A286-G288 PolarHBondContact O-N 2.85Å; A286-V289 PolarHBondContact O-N 3.06Å; A286-V289 VanDerWaalsContact O-N 3.14Å; A286-S290 WeakPolarHBondContact O-CB 3.48Å; A286-S290 PolarHBondContact O-N 3.26Å; A286-G299 WeakPolarHBondContact CA-O 3.24Å; A286-G299 WeakPolarHBondContact CB-O 3.49Å; A286-I319 HydrophobicContact CB-CG2 3.33Å; A286-S323 WeakPolarHBondContact CB-OG 3.37Å
287	A	97.7	Very high	95.3	Very high	0 Å²	0	8.9 Å²	8.9	0%	0	5%	0.05	C	C	.	.	H	α-helix	trans	-59.7	-31.7	174.8	0	0	0	0	0	113.1	T129 A283 A285 A291 S326	T129-A287 HydrophobicContact CG2-CB 4.33Å; A283-A287 VanDerWaalsContact O-CB 3.27Å; A283-A287 WeakPolarHBondContact O-CB 3.46Å; A283-A287 PolarHBondContact O-N 3.38Å; A285-A287 PolarHBondContact O-N 3.16Å; A287-A291 WeakPolarHBondContact O-CB 3.5Å; A287-A291 PolarHBondContact O-N 3.45Å; A287-A291 VanDerWaalsContact O-N 3.09Å; A287-S326 WeakPolarHBondContact O-CB 3.28Å; A287-S326 PolarHBondContact O-OG 2.7Å
288	G	96.8	Very high	95.4	Very high	0 Å²	0	7.1 Å²	7.1	0%	0	4%	0.043	C	C	.	.	H	α-helix	trans	-71.1	-42.1	172.9	0	0	0	0	0	113.5	G284 A285 A286 S290 A292	G284-G288 PolarHBondContact O-N 3.31Å; A285-G288 WeakPolarHBondContact O-CA 3.44Å; A285-G288 PolarHBondContact O-N 3.44Å; A285-G288 VanDerWaalsContact O-N 3.11Å; A286-G288 PolarHBondContact O-N 2.85Å; G288-S290 VanDerWaalsContact C-N 3.34Å; G288-A292 WeakPolarHBondContact O-CB 3.43Å; G288-A292 PolarHBondContact O-N 2.86Å
289	V	95.9	Very high	95.6	Very high	1 Å²	1	6.3 Å²	6.3	1%	0.006	4%	0.039	C	C	.	.	H	α-helix	trans	-62.5	-42.9	171.7	179.7	0	0	0	0	110.8	I243 A285 A286 A291 A292 F293 F302 I563	I243-V289 HydrophobicContact CD1-CG2 3.65Å; I243-V289 HydrophobicContact CG1-CG2 3.71Å; I243-V289 HydrophobicContact CG2-CG2 4.4Å; A285-V289 PolarHBondContact O-N 2.92Å; A286-V289 PolarHBondContact O-N 3.06Å; A286-V289 VanDerWaalsContact O-N 3.14Å; V289-A291 PolarHBondContact O-N 3.36Å; V289-A292 PolarHBondContact O-N 2.95Å; V289-F293 HydrophobicContact CG1-CD2 3.95Å; V289-F293 HydrophobicContact CG1-CE2 4.48Å; V289-F293 PolarHBondContact O-N 3.46Å; V289-F302 HydrophobicContact CG2-CB 4.27Å; V289-F302 HydrophobicContact CG2-CD1 3.59Å; V289-F302 HydrophobicContact CG2-CD2 4.46Å; V289-F302 HydrophobicContact CG2-CE1 4.02Å; V289-F302 HydrophobicContact CG2-CG 3.86Å; V289-I563 HydrophobicContact CG1-CD1 3.71Å; V289-I563 HydrophobicContact CG1-CG1 4.21Å
290	S	96.8	Very high	95.7	Very high	0 Å²	0	5.6 Å²	5.6	0%	0	4%	0.036	C	C	.	.	H	α-helix	trans	-62.6	-41.7	-179.1	-156.8	0	0	0	0	112.3	A286 G288 G294 P296 S323 T327	A286-S290 WeakPolarHBondContact O-CB 3.48Å; A286-S290 PolarHBondContact O-N 3.26Å; G288-S290 VanDerWaalsContact C-N 3.34Å; S290-G294 WeakPolarHBondContact O-CA 3.37Å; S290-G294 PolarHBondContact O-N 3.45Å; S290-P296 WeakPolarHBondContact OG-CA 3.39Å; S290-P296 WeakPolarHBondContact OG-CB 3.17Å; S290-S323 PolarHBondContact OG-O 3.45Å; S290-T327 PolarHBondContact O-OG1 2.93Å; S290-T327 PolarHBondContact OG-OG1 3.01Å
291	A	96.6	Very high	95.6	Very high	0 Å²	0	7.8 Å²	7.8	0%	0	5%	0.048	C	C	.	.	H	α-helix	trans	-72.1	-33.4	173.9	0	0	0	0	0	112.8	A133 A287 V289 L330 G348 L349	A133-A291 HydrophobicContact CB-CB 3.94Å; A287-A291 WeakPolarHBondContact O-CB 3.5Å; A287-A291 PolarHBondContact O-N 3.45Å; A287-A291 VanDerWaalsContact O-N 3.09Å; V289-A291 PolarHBondContact O-N 3.36Å; A291-L330 HydrophobicContact CB-CD2 4.19Å; A291-L330 WeakPolarHBondContact O-CD2 3.45Å; A291-G348 WeakPolarHBondContact O-CA 3.36Å; A291-L349 PolarHBondContact O-N 3.07Å
292	A	95.2	Very high	95.5	Very high	0 Å²	0	8 Å²	8	0%	0	5%	0.049	C	C	.	.	H	α-helix	trans	-66.4	-57.4	178.1	0	0	0	0	0	112.3	E239 G288 V289 L349 I350	E239-A292 HydrophobicContact CB-CB 3.91Å; E239-A292 HydrophobicContact CG-CB 4.32Å; E239-A292 WeakPolarHBondContact OE2-CA 3.42Å; E239-A292 WeakPolarHBondContact OE2-CB 3.35Å; G288-A292 WeakPolarHBondContact O-CB 3.43Å; G288-A292 PolarHBondContact O-N 2.86Å; V289-A292 PolarHBondContact O-N 2.95Å; A292-L349 PolarHBondContact O-N 3.47Å; A292-I350 PolarHBondContact O-N 2.82Å
293	F	94.3	Very high	95.3	Very high	5 Å²	5	7.8 Å²	7.8	2%	0.022	5%	0.047	C	C	.	.	H	α-helix	trans	-105.2	-1.4	-169.5	-56.3	-79.1	0	0	0	114.6	E239 V289 A295 I350 F507 I563	E239-F293 HydrophobicContact CB-CE1 4.32Å; E239-F293 HydrophobicContact CB-CE2 4.4Å; E239-F293 HydrophobicContact CB-CZ 3.88Å; E239-F293 HydrophobicContact CG-CE1 4.22Å; E239-F293 HydrophobicContact CG-CZ 4.29Å; V289-F293 HydrophobicContact CG1-CD2 3.95Å; V289-F293 HydrophobicContact CG1-CE2 4.48Å; V289-F293 PolarHBondContact O-N 3.46Å; F293-A295 HydrophobicContact CB-CB 4.17Å; F293-A295 PolarHBondContact O-N 3.25Å; F293-I350 HydrophobicContact CD1-CG2 3.69Å; F293-I350 HydrophobicContact CE1-CG2 4.24Å; F293-F507 HydrophobicContact CE1-CB 4.47Å; F293-F507 HydrophobicContact CE1-CD1 4.12Å; F293-F507 HydrophobicContact CE2-CD1 4.4Å; F293-F507 HydrophobicContact CE2-CE1 4.49Å; F293-F507 HydrophobicContact CZ-CB 4.09Å; F293-F507 AromaticContact CZ-CD1 3.53Å; F293-F507 HydrophobicContact CZ-CD1 3.53Å; F293-F507 HydrophobicContact CZ-CD2 4.49Å; F293-F507 HydrophobicContact CZ-CE1 4.03Å; F293-F507 AromaticContact CZ-CG 3.81Å; F293-F507 HydrophobicContact CZ-CG 3.81Å; F293-I563 HydrophobicContact CB-CG2 3.71Å; F293-I563 HydrophobicContact CD1-CG2 4.16Å; F293-I563 HydrophobicContact CD2-CG2 4.12Å; F293-I563 HydrophobicContact CG-CG2 3.73Å
294	G	94.8	Very high	95	Very high	12 Å²	12	8.7 Å²	8.7	12%	0.124	5%	0.052	C	C	.	.	S	Bend	trans	70.6	14.2	-173.2	0	0	0	0	0	114.2	S290 P296 P347	S290-G294 WeakPolarHBondContact O-CA 3.37Å; S290-G294 PolarHBondContact O-N 3.45Å; G294-P296 WeakPolarHBondContact O-CD 3.21Å; G294-P347 WeakPolarHBondContact CA-O 3.38Å
295	A	95.6	Very high	94.5	Very high	0 Å²	0	10.4 Å²	10.4	0%	0	6%	0.06	C	C	.	.			trans	-112.4	82.2	-167.7	0	0	0	0	0	112.5	F293 G299 I563 E566	F293-A295 HydrophobicContact CB-CB 4.17Å; F293-A295 PolarHBondContact O-N 3.25Å; A295-G299 PolarHBondContact O-N 3.31Å; A295-I563 HydrophobicContact CB-CB 4.28Å; A295-I563 HydrophobicContact CB-CG1 4.14Å; A295-I563 HydrophobicContact CB-CG2 4.23Å; A295-E566 VanDerWaalsContact C-OE1 3.28Å; A295-E566 WeakPolarHBondContact CA-OE1 3.33Å; A295-E566 HydrophobicContact CB-CB 3.74Å; A295-E566 HydrophobicContact CB-CG 4.43Å; A295-E566 WeakPolarHBondContact CB-OE1 3.38Å
296	P	96.7	Very high	93.7	Very high	13 Å²	13	11 Å²	11	8%	0.084	6%	0.063	C	C	.	.	H	α-helix	trans	-66	-36	-178	23.9	-33.9	0	0	0	114.4	S290 G294 V300 F320 M324 E566	S290-P296 WeakPolarHBondContact OG-CA 3.39Å; S290-P296 WeakPolarHBondContact OG-CB 3.17Å; G294-P296 WeakPolarHBondContact O-CD 3.21Å; P296-V300 WeakPolarHBondContact O-CG2 3.37Å; P296-V300 PolarHBondContact O-N 3.42Å; P296-V300 VanDerWaalsContact O-N 3.1Å; P296-F320 HydrophobicContact CB-CE2 4.27Å; P296-M324 HydrophobicContact CB-CG 4.3Å; P296-M324 HydrophobicContact CB-SD 3.67Å; P296-M324 HydrophobicContact CG-SD 3.52Å; P296-M324 VanDerWaalsContact CG-SD 3.52Å; P296-E566 WeakPolarHBondContact CD-OE2 3.33Å; P296-E566 WeakPolarHBondContact CG-OE2 3.5Å
297	V	96.3	Very high	92.3	Very high	63 Å²	63	11.8 Å²	11.8	38%	0.382	7%	0.07	S	C	.	.	H	α-helix	trans	-74.3	-40.8	178.9	-174.3	0	0	0	0	110.4	G299 V300 L301 F320 V562 E566	V297-G299 VanDerWaalsContact C-N 3.31Å; V297-G299 PolarHBondContact O-N 2.93Å; V297-V300 WeakPolarHBondContact O-CB 3.49Å; V297-V300 PolarHBondContact O-N 2.93Å; V297-L301 HydrophobicContact CG1-CD1 4.33Å; V297-L301 WeakPolarHBondContact O-CG 3.46Å; V297-L301 PolarHBondContact O-N 2.9Å; V297-F320 HydrophobicContact CG2-CE2 3.96Å; V297-V562 HydrophobicContact CB-CG1 4.03Å; V297-V562 HydrophobicContact CG1-CG1 4.06Å; V297-E566 WeakPolarHBondContact CG2-OE2 3.38Å; V297-E566 PolarHBondContact N-OE1 3.37Å; V297-E566 VanDerWaalsContact N-OE1 3.11Å; V297-E566 PolarHBondContact N-OE2 2.68Å
298	G	94.4	Very high	90.5	Very high	0 Å²	0	13.7 Å²	13.7	0%	0	9%	0.086	C	C	.	.	H	α-helix	trans	-60	-38.1	171.9	0	0	0	0	0	112.8	L301 F302 E566	G298-L301 PolarHBondContact O-N 3.35Å; G298-F302 WeakPolarHBondContact O-CB 3.28Å; G298-F302 PolarHBondContact O-N 2.96Å; G298-E566 PolarHBondContact N-OE1 2.89Å
299	G	94.3	Very high	88.9	Confident	0 Å²	0	18.4 Å²	18.4	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-64.8	-41.8	172.7	0	0	0	0	0	113.8	A286 A295 V297 S303	A286-G299 WeakPolarHBondContact CA-O 3.24Å; A286-G299 WeakPolarHBondContact CB-O 3.49Å; A295-G299 PolarHBondContact O-N 3.31Å; V297-G299 VanDerWaalsContact C-N 3.31Å; V297-G299 PolarHBondContact O-N 2.93Å; G299-S303 PolarHBondContact O-N 3.46Å
300	V	95.1	Very high	87.7	Confident	10 Å²	10	23.9 Å²	23.9	6%	0.061	14%	0.143	C	C	.	.	H	α-helix	trans	-60.4	-51.6	171.8	171.6	0	0	0	0	110.2	P296 V297 F302 S303 L304 T316 I319 F320	P296-V300 WeakPolarHBondContact O-CG2 3.37Å; P296-V300 PolarHBondContact O-N 3.42Å; P296-V300 VanDerWaalsContact O-N 3.1Å; V297-V300 WeakPolarHBondContact O-CB 3.49Å; V297-V300 PolarHBondContact O-N 2.93Å; V300-F302 VanDerWaalsContact C-N 3.34Å; V300-F302 PolarHBondContact O-N 3.45Å; V300-S303 PolarHBondContact O-N 2.98Å; V300-S303 VanDerWaalsContact O-N 3.11Å; V300-S303 PolarHBondContact O-OG 3.27Å; V300-L304 HydrophobicContact CG1-CD1 3.75Å; V300-L304 WeakPolarHBondContact O-CG 3.42Å; V300-L304 PolarHBondContact O-N 2.92Å; V300-T316 HydrophobicContact CG1-CG2 3.84Å; V300-I319 HydrophobicContact CB-CG2 4.3Å; V300-I319 HydrophobicContact CG1-CG2 4.41Å; V300-I319 HydrophobicContact CG2-CB 4.48Å; V300-I319 HydrophobicContact CG2-CG2 3.82Å; V300-F320 VanDerWaalsContact CG2-CA 3.45Å; V300-F320 HydrophobicContact CG2-CB 3.75Å; V300-F320 HydrophobicContact CG2-CD2 4.04Å; V300-F320 HydrophobicContact CG2-CG 4.41Å
301	L	93.9	Very high	86.6	Confident	51 Å²	51	31.4 Å²	31.4	27%	0.267	17%	0.172	S	C	.	.	H	α-helix	trans	-60.2	-41	-179.7	-71	172.1	0	0	0	112.4	V297 G298 S303 L304 E305 V562	V297-L301 HydrophobicContact CG1-CD1 4.33Å; V297-L301 WeakPolarHBondContact O-CG 3.46Å; V297-L301 PolarHBondContact O-N 2.9Å; G298-L301 PolarHBondContact O-N 3.35Å; L301-S303 VanDerWaalsContact C-N 3.32Å; L301-S303 PolarHBondContact O-N 2.98Å; L301-L304 PolarHBondContact O-N 3.34Å; L301-L304 VanDerWaalsContact O-N 3.12Å; L301-E305 WeakPolarHBondContact O-CB 3.33Å; L301-E305 PolarHBondContact O-N 3.38Å; L301-V562 HydrophobicContact CD1-CB 3.92Å; L301-V562 HydrophobicContact CD1-CG1 4.14Å; L301-V562 HydrophobicContact CD1-CG2 3.59Å
302	F	91.7	Very high	86.1	Confident	6 Å²	6	34 Å²	34	3%	0.026	19%	0.185	C	C	.	.	H	α-helix	trans	-56.1	-45.8	173.6	170.1	-89.3	0	0	0	111.8	I198 I243 A285 V289 G298 V300 L304 E306 M556	I198-F302 HydrophobicContact CG2-CZ 4.17Å; I243-F302 HydrophobicContact CD1-CZ 4.18Å; I243-F302 HydrophobicContact CG2-CE1 3.69Å; I243-F302 HydrophobicContact CG2-CZ 3.97Å; A285-F302 HydrophobicContact CB-CE1 4.44Å; V289-F302 HydrophobicContact CG2-CB 4.27Å; V289-F302 HydrophobicContact CG2-CD1 3.59Å; V289-F302 HydrophobicContact CG2-CD2 4.46Å; V289-F302 HydrophobicContact CG2-CE1 4.02Å; V289-F302 HydrophobicContact CG2-CG 3.86Å; G298-F302 WeakPolarHBondContact O-CB 3.28Å; G298-F302 PolarHBondContact O-N 2.96Å; V300-F302 VanDerWaalsContact C-N 3.34Å; V300-F302 PolarHBondContact O-N 3.45Å; F302-L304 PolarHBondContact O-N 3.48Å; F302-E306 HydrophobicContact CE2-CG 4.36Å; F302-E306 WeakPolarHBondContact O-CB 3.42Å; F302-E306 PolarHBondContact O-N 3.34Å; F302-M556 HydrophobicContact CD2-CE 4.18Å; F302-M556 HydrophobicContact CD2-SD 4.18Å; F302-M556 HydrophobicContact CE2-CE 3.61Å; F302-M556 HydrophobicContact CE2-SD 4.05Å
303	S	91.3	Very high	85.8	Confident	2 Å²	2	38.4 Å²	38.4	1%	0.014	21%	0.206	C	C	.	.	H	α-helix	trans	-68.9	-19.5	-179.9	74.8	0	0	0	0	114.1	G299 V300 L301 G307	G299-S303 PolarHBondContact O-N 3.46Å; V300-S303 PolarHBondContact O-N 2.98Å; V300-S303 VanDerWaalsContact O-N 3.11Å; V300-S303 PolarHBondContact O-OG 3.27Å; L301-S303 VanDerWaalsContact C-N 3.32Å; L301-S303 PolarHBondContact O-N 2.98Å; S303-G307 PolarHBondContact O-N 3.01Å
304	L	88.3	Confident	85.6	Confident	20 Å²	20	41.2 Å²	41.2	11%	0.105	22%	0.22	C	C	.	.	H	α-helix	trans	-90.1	-47.9	176.5	-63	166.8	0	0	0	110.8	V300 L301 F302 E306 G307 A308 W311 T316	V300-L304 HydrophobicContact CG1-CD1 3.75Å; V300-L304 WeakPolarHBondContact O-CG 3.42Å; V300-L304 PolarHBondContact O-N 2.92Å; L301-L304 PolarHBondContact O-N 3.34Å; L301-L304 VanDerWaalsContact O-N 3.12Å; F302-L304 PolarHBondContact O-N 3.48Å; L304-E306 VanDerWaalsContact C-N 3.27Å; L304-E306 PolarHBondContact O-N 3.29Å; L304-G307 PolarHBondContact O-N 2.7Å; L304-A308 HydrophobicContact CB-CB 4.07Å; L304-A308 HydrophobicContact CD2-CB 3.68Å; L304-A308 HydrophobicContact CG-CB 4.5Å; L304-A308 WeakPolarHBondContact O-CB 3.33Å; L304-A308 PolarHBondContact O-N 3.47Å; L304-W311 HydrophobicContact CD1-CE3 4.31Å; L304-W311 HydrophobicContact CD1-CH2 3.77Å; L304-W311 HydrophobicContact CD1-CZ3 3.64Å; L304-T316 HydrophobicContact CD1-CG2 4.29Å
305	E	86.2	Confident	85.4	Confident	35 Å²	35	41.8 Å²	41.8	16%	0.164	22%	0.22	C	C	.	.	H	α-helix	trans	-54.8	-41.6	175.4	-170.5	173	167	0	0	111.3	L301 T557 S559 W610	L301-E305 WeakPolarHBondContact O-CB 3.33Å; L301-E305 PolarHBondContact O-N 3.38Å; E305-T557 PolarHBondContact OE1-N 3.38Å; E305-S559 WeakPolarHBondContact OE2-CB 3.37Å; E305-S559 PolarHBondContact OE2-N 3.01Å; E305-S559 PolarHBondContact OE2-OG 3.39Å; E305-W610 HydrophobicContact CG-CZ2 4.47Å; E305-W610 PolarHBondContact O-NE1 3.47Å
306	E	78.8	Confident	85.4	Confident	14 Å²	14	42.5 Å²	42.5	7%	0.065	22%	0.224	C	C	.	.	T	Hydrogen-bonded Turn	trans	-99.7	7.7	-178.3	-64.1	-73.3	-154.6	0	0	114.9	K202 L205 F302 L304 M556	K202-E306 WeakPolarHBondContact CD-OE1 3.32Å; K202-E306 WeakPolarHBondContact CD-OE2 3.4Å; K202-E306 WeakPolarHBondContact CE-OE1 3.49Å; K202-E306 WeakPolarHBondContact CE-OE2 3.47Å; K202-E306 VanDerWaalsContact NZ-CD 3.28Å; K202-E306 IonicContact NZ-OE1 3.69Å; K202-E306 PolarHBondContact NZ-OE1 2.94Å; K202-E306 IonicContact NZ-OE2 3.95Å; K202-E306 PolarHBondContact NZ-OE2 3.27Å; L205-E306 WeakPolarHBondContact CB-O 3.46Å; F302-E306 HydrophobicContact CE2-CG 4.36Å; F302-E306 WeakPolarHBondContact O-CB 3.42Å; F302-E306 PolarHBondContact O-N 3.34Å; L304-E306 VanDerWaalsContact C-N 3.27Å; L304-E306 PolarHBondContact O-N 3.29Å; E306-M556 HydrophobicContact CG-CE 4.13Å; E306-M556 WeakPolarHBondContact OE1-CE 3.44Å
307	G	67.4	Low	85.3	Confident	15 Å²	15	48 Å²	48	16%	0.155	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	-158	-14.1	-172.5	0	0	0	0	0	119.4	S303 L304 S309	S303-G307 PolarHBondContact O-N 3.01Å; L304-G307 PolarHBondContact O-N 2.7Å; G307-S309 PolarHBondContact O-N 2.99Å
308	A	60.9	Low	85.2	Confident	41 Å²	41	46.3 Å²	46.3	34%	0.339	23%	0.23	S	C	.	.			trans	-95.2	94.9	-178.1	0	0	0	0	0	112.1	L304 F310	L304-A308 HydrophobicContact CB-CB 4.07Å; L304-A308 HydrophobicContact CD2-CB 3.68Å; L304-A308 HydrophobicContact CG-CB 4.5Å; L304-A308 WeakPolarHBondContact O-CB 3.33Å; L304-A308 PolarHBondContact O-N 3.47Å; A308-F310 PolarHBondContact O-N 3.01Å
309	S	63.1	Low	85.3	Confident	99 Å²	99	46.4 Å²	46.4	69%	0.692	23%	0.231	S	C	*	.	S	Bend	trans	-63.4	-20.3	165.4	-39.9	0	0	0	0	112.6	G307	G307-S309 PolarHBondContact O-N 2.99Å
310	F	69.3	Low	85.4	Confident	115 Å²	115	50.5 Å²	50.5	50%	0.504	25%	0.249	S	C	.	.	S	Bend	trans	-153.6	153.2	174.8	58.4	-93.4	0	0	0	110.5	Y91 A308 N312	Y91-F310 AromaticContact CE1-CE1 3.8Å; Y91-F310 HydrophobicContact CE1-CE1 3.8Å; Y91-F310 AromaticContact CE1-CZ 3.85Å; Y91-F310 HydrophobicContact CE1-CZ 3.85Å; A308-F310 PolarHBondContact O-N 3.01Å; F310-N312 HydrophobicContact CD2-CB 4.45Å; F310-N312 HydrophobicContact CE2-CB 4.26Å
311	W	74.5	Confident	85.5	Confident	159 Å²	159	53.9 Å²	53.9	60%	0.602	26%	0.263	S	S	*	.			trans	-84.7	118	-179.7	-170.6	-81.2	0	0	0	111.9	L304 T316	L304-W311 HydrophobicContact CD1-CE3 4.31Å; L304-W311 HydrophobicContact CD1-CH2 3.77Å; L304-W311 HydrophobicContact CD1-CZ3 3.64Å; W311-T316 HydrophobicContact CH2-CG2 4.46Å; W311-T316 HydrophobicContact CZ2-CG2 3.97Å
312	N	86.4	Confident	85.7	Confident	54 Å²	54	51.4 Å²	51.4	29%	0.289	25%	0.25	S	C	.	.			trans	-114	105.2	174.1	177	-6.1	0	0	0	110.4	F310 M314 L315 T316	F310-N312 HydrophobicContact CD2-CB 4.45Å; F310-N312 HydrophobicContact CE2-CB 4.26Å; N312-M314 VanDerWaalsContact C-N 3.32Å; N312-M314 PolarHBondContact O-N 3.01Å; N312-M314 PolarHBondContact OD1-N 2.87Å; N312-L315 HydrophobicContact CB-CB 3.87Å; N312-L315 WeakPolarHBondContact O-CB 3.48Å; N312-L315 PolarHBondContact O-N 3.24Å; N312-L315 PolarHBondContact OD1-N 3.22Å; N312-T316 PolarHBondContact O-N 3.47Å; N312-T316 PolarHBondContact O-OG1 2.96Å
313	Q	89.6	Confident	86	Confident	92 Å²	92	51.1 Å²	51.1	43%	0.43	25%	0.249	S	C	.	.	H	α-helix	trans	-56.9	-40.8	-174.9	-169.4	69.3	-1.1	0	0	113.7	L315 T316 W317	Q313-L315 VanDerWaalsContact C-N 3.32Å; Q313-L315 PolarHBondContact O-N 2.77Å; Q313-T316 PolarHBondContact O-N 3.26Å; Q313-W317 HydrophobicContact CG-CD2 4.43Å; Q313-W317 HydrophobicContact CG-CZ2 3.94Å; Q313-W317 PolarHBondContact O-N 3.13Å; Q313-W317 VanDerWaalsContact O-N 3.09Å
314	M	89.8	Confident	86.2	Confident	65 Å²	65	55.2 Å²	55.2	32%	0.32	27%	0.268	S	S	.	.	H	α-helix	trans	-72.4	-27.6	-179.5	-66.6	-62.8	-71.3	0	0	112.1	E115 N312 W317 R318	E115-M314 WeakPolarHBondContact OE1-CE 3.35Å; N312-M314 VanDerWaalsContact C-N 3.32Å; N312-M314 PolarHBondContact O-N 3.01Å; N312-M314 PolarHBondContact OD1-N 2.87Å; M314-W317 HydrophobicContact SD-CE3 3.61Å; M314-W317 HydrophobicContact SD-CZ3 3.58Å; M314-W317 VanDerWaalsContact SD-CZ3 3.58Å; M314-R318 WeakPolarHBondContact O-CD 3.46Å; M314-R318 VanDerWaalsContact O-CG 3.29Å; M314-R318 WeakPolarHBondContact O-CG 3.35Å; M314-R318 PolarHBondContact O-N 3.35Å
315	L	90.6	Very high	86.7	Confident	23 Å²	23	56.1 Å²	56.1	12%	0.12	27%	0.273	C	S	.	.	H	α-helix	trans	-71.7	-50.4	170.5	177.8	59.2	0	0	0	110.2	D279 N312 Q313 W317 R318 I319	D279-L315 HydrophobicContact CB-CD1 3.67Å; D279-L315 HydrophobicContact CB-CD2 4.31Å; N312-L315 HydrophobicContact CB-CB 3.87Å; N312-L315 WeakPolarHBondContact O-CB 3.48Å; N312-L315 PolarHBondContact O-N 3.24Å; N312-L315 PolarHBondContact OD1-N 3.22Å; Q313-L315 VanDerWaalsContact C-N 3.32Å; Q313-L315 PolarHBondContact O-N 2.77Å; L315-W317 VanDerWaalsContact C-N 3.27Å; L315-W317 PolarHBondContact O-N 3.23Å; L315-R318 WeakPolarHBondContact O-CA 3.36Å; L315-R318 PolarHBondContact O-N 3.32Å; L315-I319 HydrophobicContact CD1-CD1 4Å; L315-I319 HydrophobicContact CD1-CG1 4Å; L315-I319 HydrophobicContact CD2-CD1 4.35Å; L315-I319 HydrophobicContact CG-CD1 3.73Å; L315-I319 HydrophobicContact CG-CG1 4.18Å; L315-I319 WeakPolarHBondContact O-CG1 3.31Å; L315-I319 PolarHBondContact O-N 3.31Å
316	T	93.8	Very high	87.2	Confident	15 Å²	15	54.4 Å²	54.4	9%	0.092	27%	0.265	C	S	.	.	H	α-helix	trans	-52.7	-43	178.6	-55.5	0	0	0	0	112.3	V300 L304 W311 N312 Q313 R318 I319 F320	V300-T316 HydrophobicContact CG1-CG2 3.84Å; L304-T316 HydrophobicContact CD1-CG2 4.29Å; W311-T316 HydrophobicContact CH2-CG2 4.46Å; W311-T316 HydrophobicContact CZ2-CG2 3.97Å; N312-T316 PolarHBondContact O-N 3.47Å; N312-T316 PolarHBondContact O-OG1 2.96Å; Q313-T316 PolarHBondContact O-N 3.26Å; T316-R318 PolarHBondContact O-N 3.22Å; T316-I319 PolarHBondContact O-N 2.84Å; T316-F320 WeakPolarHBondContact O-CB 3.45Å; T316-F320 PolarHBondContact O-N 3.12Å
317	W	95.4	Very high	88	Confident	130 Å²	130	54.6 Å²	54.6	49%	0.492	27%	0.267	S	S	.	.	H	α-helix	trans	-63.4	-38.3	175.4	-67.8	-13.2	0	0	0	113.7	W119 Q313 M314 L315 F321	W119-W317 HydrophobicContact CH2-CB 3.95Å; Q313-W317 HydrophobicContact CG-CD2 4.43Å; Q313-W317 HydrophobicContact CG-CZ2 3.94Å; Q313-W317 PolarHBondContact O-N 3.13Å; Q313-W317 VanDerWaalsContact O-N 3.09Å; M314-W317 HydrophobicContact SD-CE3 3.61Å; M314-W317 HydrophobicContact SD-CZ3 3.58Å; M314-W317 VanDerWaalsContact SD-CZ3 3.58Å; L315-W317 VanDerWaalsContact C-N 3.27Å; L315-W317 PolarHBondContact O-N 3.23Å; W317-F321 WeakPolarHBondContact O-CB 2.8Å; W317-F321 PolarHBondContact O-N 3.11Å
318	R	95.3	Very high	89.4	Confident	27 Å²	27	59.5 Å²	59.5	10%	0.102	29%	0.285	C	S	.	.	H	α-helix	trans	-72.7	-35.3	177.3	-68.8	171.3	-169.1	149.3	4.8	112.3	E115 R118 W119 M314 L315 T316 A322	E115-R318 IonicContact OE1-CZ 2.73Å; E115-R318 IonicContact OE1-NH2 3.1Å; E115-R318 PolarHBondContact OE1-NH2 2.93Å; R118-R318 VanDerWaalsContact CD-NH1 3.35Å; W119-R318 HydrophobicContact CD2-CG 3.94Å; W119-R318 HydrophobicContact CE3-CG 4.1Å; W119-R318 HydrophobicContact CH2-CG 4.15Å; W119-R318 HydrophobicContact CZ2-CG 3.97Å; W119-R318 HydrophobicContact CZ3-CG 4.2Å; M314-R318 WeakPolarHBondContact O-CD 3.46Å; M314-R318 VanDerWaalsContact O-CG 3.29Å; M314-R318 WeakPolarHBondContact O-CG 3.35Å; M314-R318 PolarHBondContact O-N 3.35Å; L315-R318 WeakPolarHBondContact O-CA 3.36Å; L315-R318 PolarHBondContact O-N 3.32Å; T316-R318 PolarHBondContact O-N 3.22Å; R318-A322 PolarHBondContact O-N 3.42Å
319	I	95.4	Very high	91	Very high	1 Å²	1	57.9 Å²	57.9	1%	0.005	27%	0.27	C	S	.	.	H	α-helix	trans	-64.5	-46.3	172.8	-64.1	175.2	0	0	0	110	A283 A286 V300 L315 T316 F321 A322 S323	A283-I319 HydrophobicContact CB-CB 4.49Å; A283-I319 HydrophobicContact CB-CG1 3.96Å; A286-I319 HydrophobicContact CB-CG2 3.33Å; V300-I319 HydrophobicContact CB-CG2 4.3Å; V300-I319 HydrophobicContact CG1-CG2 4.41Å; V300-I319 HydrophobicContact CG2-CB 4.48Å; V300-I319 HydrophobicContact CG2-CG2 3.82Å; L315-I319 HydrophobicContact CD1-CD1 4Å; L315-I319 HydrophobicContact CD1-CG1 4Å; L315-I319 HydrophobicContact CD2-CD1 4.35Å; L315-I319 HydrophobicContact CG-CD1 3.73Å; L315-I319 HydrophobicContact CG-CG1 4.18Å; L315-I319 WeakPolarHBondContact O-CG1 3.31Å; L315-I319 PolarHBondContact O-N 3.31Å; T316-I319 PolarHBondContact O-N 2.84Å; I319-F321 PolarHBondContact O-N 3.46Å; I319-A322 PolarHBondContact O-N 2.85Å; I319-S323 WeakPolarHBondContact O-CB 3.29Å; I319-S323 PolarHBondContact O-N 2.95Å; I319-S323 PolarHBondContact O-OG 3.24Å
320	F	96.8	Very high	92.5	Very high	87 Å²	87	53.1 Å²	53.1	38%	0.382	24%	0.237	S	C	.	.	H	α-helix	trans	-61.5	-44.9	176.9	-179.5	-116.6	0	0	0	111.9	P296 V297 V300 T316 A322 S323 M324	P296-F320 HydrophobicContact CB-CE2 4.27Å; V297-F320 HydrophobicContact CG2-CE2 3.96Å; V300-F320 VanDerWaalsContact CG2-CA 3.45Å; V300-F320 HydrophobicContact CG2-CB 3.75Å; V300-F320 HydrophobicContact CG2-CD2 4.04Å; V300-F320 HydrophobicContact CG2-CG 4.41Å; T316-F320 WeakPolarHBondContact O-CB 3.45Å; T316-F320 PolarHBondContact O-N 3.12Å; F320-A322 PolarHBondContact O-N 3.16Å; F320-S323 WeakPolarHBondContact O-CB 3.17Å; F320-S323 PolarHBondContact O-N 2.78Å; F320-S323 VanDerWaalsContact O-N 3.16Å; F320-M324 HydrophobicContact CD1-CG 4.33Å; F320-M324 HydrophobicContact CD2-CG 4.17Å; F320-M324 HydrophobicContact CE1-CG 3.94Å; F320-M324 HydrophobicContact CE2-CG 3.77Å; F320-M324 HydrophobicContact CE2-SD 3.81Å; F320-M324 HydrophobicContact CG-CG 4.44Å; F320-M324 HydrophobicContact CZ-CG 3.64Å; F320-M324 HydrophobicContact CZ-SD 3.73Å; F320-M324 WeakPolarHBondContact O-CG 3.41Å; F320-M324 PolarHBondContact O-N 2.89Å
321	F	97.6	Very high	93.6	Very high	80 Å²	80	48.3 Å²	48.3	35%	0.351	22%	0.217	S	C	.	.	H	α-helix	trans	-60	-44.5	175.9	177.5	-105	0	0	0	113.1	W119 C122 W317 I319 S323 I325	W119-F321 HydrophobicContact CE3-CB 4.23Å; W119-F321 AromaticContact CE3-CD1 3.75Å; W119-F321 HydrophobicContact CE3-CD1 3.75Å; W119-F321 HydrophobicContact CE3-CD2 4.43Å; W119-F321 HydrophobicContact CE3-CE1 4.13Å; W119-F321 AromaticContact CE3-CG 3.91Å; W119-F321 HydrophobicContact CE3-CG 3.91Å; W119-F321 HydrophobicContact CZ3-CB 3.74Å; W119-F321 HydrophobicContact CZ3-CD1 4.14Å; W119-F321 HydrophobicContact CZ3-CD2 4.27Å; W119-F321 AromaticContact CZ3-CG 3.82Å; W119-F321 HydrophobicContact CZ3-CG 3.82Å; C122-F321 HydrophobicContact CB-CD1 4.39Å; W317-F321 WeakPolarHBondContact O-CB 2.8Å; W317-F321 PolarHBondContact O-N 3.11Å; I319-F321 PolarHBondContact O-N 3.46Å; F321-S323 VanDerWaalsContact C-N 3.3Å; F321-S323 PolarHBondContact O-N 2.92Å; F321-I325 HydrophobicContact CD1-CD1 3.96Å; F321-I325 HydrophobicContact CD2-CD1 4.1Å; F321-I325 HydrophobicContact CE1-CD1 3.53Å; F321-I325 HydrophobicContact CE2-CD1 3.69Å; F321-I325 HydrophobicContact CG-CD1 4.24Å; F321-I325 HydrophobicContact CZ-CD1 3.39Å; F321-I325 WeakPolarHBondContact O-CG1 3.23Å; F321-I325 PolarHBondContact O-N 2.82Å; F321-I325 VanDerWaalsContact O-N 3.09Å
322	A	97.4	Very high	94.6	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-60.8	-39.6	173.9	0	0	0	0	0	112.2	C122 G126 A283 R318 I319 F320 S326	C122-A322 HydrophobicContact CB-CB 4.17Å; C122-A322 WeakPolarHBondContact O-CB 3.18Å; G126-A322 VanDerWaalsContact CA-O 3.28Å; G126-A322 WeakPolarHBondContact CA-O 3.31Å; A283-A322 HydrophobicContact CB-CB 4.29Å; R318-A322 PolarHBondContact O-N 3.42Å; I319-A322 PolarHBondContact O-N 2.85Å; F320-A322 PolarHBondContact O-N 3.16Å; A322-S326 WeakPolarHBondContact O-CB 3.37Å; A322-S326 PolarHBondContact O-N 3.37Å
323	S	97.2	Very high	94.9	Very high	0 Å²	0	45.8 Å²	45.8	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-66.7	-51.3	-179.9	-55.1	0	0	0	0	111.6	A286 S290 I319 F320 F321 I325 S326 T327	A286-S323 WeakPolarHBondContact CB-OG 3.37Å; S290-S323 PolarHBondContact OG-O 3.45Å; I319-S323 WeakPolarHBondContact O-CB 3.29Å; I319-S323 PolarHBondContact O-N 2.95Å; I319-S323 PolarHBondContact O-OG 3.24Å; F320-S323 WeakPolarHBondContact O-CB 3.17Å; F320-S323 PolarHBondContact O-N 2.78Å; F320-S323 VanDerWaalsContact O-N 3.16Å; F321-S323 VanDerWaalsContact C-N 3.3Å; F321-S323 PolarHBondContact O-N 2.92Å; S323-I325 VanDerWaalsContact C-N 3.3Å; S323-I325 PolarHBondContact O-N 2.95Å; S323-S326 VanDerWaalsContact O-CB 3.29Å; S323-S326 WeakPolarHBondContact O-CB 3.08Å; S323-S326 PolarHBondContact O-N 2.75Å; S323-T327 PolarHBondContact O-N 3.43Å
324	M	97.1	Very high	94.9	Very high	87 Å²	87	41.5 Å²	41.5	43%	0.429	19%	0.188	S	C	.	.	H	α-helix	trans	-55.4	-42.5	175	-70.6	-63	-63.8	0	0	112.4	P296 F320 F328	P296-M324 HydrophobicContact CB-CG 4.3Å; P296-M324 HydrophobicContact CB-SD 3.67Å; P296-M324 HydrophobicContact CG-SD 3.52Å; P296-M324 VanDerWaalsContact CG-SD 3.52Å; F320-M324 HydrophobicContact CD1-CG 4.33Å; F320-M324 HydrophobicContact CD2-CG 4.17Å; F320-M324 HydrophobicContact CE1-CG 3.94Å; F320-M324 HydrophobicContact CE2-CG 3.77Å; F320-M324 HydrophobicContact CE2-SD 3.81Å; F320-M324 HydrophobicContact CG-CG 4.44Å; F320-M324 HydrophobicContact CZ-CG 3.64Å; F320-M324 HydrophobicContact CZ-SD 3.73Å; F320-M324 WeakPolarHBondContact O-CG 3.41Å; F320-M324 PolarHBondContact O-N 2.89Å; M324-F328 VanDerWaalsContact O-CB 3.31Å; M324-F328 WeakPolarHBondContact O-CB 3.17Å; M324-F328 PolarHBondContact O-N 3.2Å
325	I	97.6	Very high	94.9	Very high	39 Å²	39	38.7 Å²	38.7	20%	0.2	18%	0.175	C	C	.	.	H	α-helix	trans	-67.9	-37.1	176.5	-70	171.5	0	0	0	111.6	F127 F321 S323 T329	F127-I325 HydrophobicContact CB-CG2 4.21Å; F321-I325 HydrophobicContact CD1-CD1 3.96Å; F321-I325 HydrophobicContact CD2-CD1 4.1Å; F321-I325 HydrophobicContact CE1-CD1 3.53Å; F321-I325 HydrophobicContact CE2-CD1 3.69Å; F321-I325 HydrophobicContact CG-CD1 4.24Å; F321-I325 HydrophobicContact CZ-CD1 3.39Å; F321-I325 WeakPolarHBondContact O-CG1 3.23Å; F321-I325 PolarHBondContact O-N 2.82Å; F321-I325 VanDerWaalsContact O-N 3.09Å; S323-I325 VanDerWaalsContact C-N 3.3Å; S323-I325 PolarHBondContact O-N 2.95Å; I325-T329 VanDerWaalsContact O-CB 3.23Å; I325-T329 WeakPolarHBondContact O-CB 3.16Å; I325-T329 PolarHBondContact O-N 2.81Å; I325-T329 PolarHBondContact O-OG1 2.94Å
326	S	97.5	Very high	95	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-59.4	-52.1	176	-158.6	0	0	0	0	111.4	G126 A287 A322 S323 T329 L330	G126-S326 WeakPolarHBondContact O-CA 3.36Å; A287-S326 WeakPolarHBondContact O-CB 3.28Å; A287-S326 PolarHBondContact O-OG 2.7Å; A322-S326 WeakPolarHBondContact O-CB 3.37Å; A322-S326 PolarHBondContact O-N 3.37Å; S323-S326 VanDerWaalsContact O-CB 3.29Å; S323-S326 WeakPolarHBondContact O-CB 3.08Å; S323-S326 PolarHBondContact O-N 2.75Å; S326-T329 PolarHBondContact O-N 2.79Å; S326-L330 PolarHBondContact O-N 3.17Å
327	T	95.5	Very high	94.8	Very high	18 Å²	18	43.8 Å²	43.8	11%	0.11	20%	0.196	C	C	.	.	H	α-helix	trans	-60.7	-47.4	176.7	-69.8	0	0	0	0	112	S290 S323 T329 L330 N331 P347	S290-T327 PolarHBondContact O-OG1 2.93Å; S290-T327 PolarHBondContact OG-OG1 3.01Å; S323-T327 PolarHBondContact O-N 3.43Å; T327-T329 PolarHBondContact O-N 3.35Å; T327-L330 PolarHBondContact O-N 3.34Å; T327-N331 WeakPolarHBondContact O-CB 3.35Å; T327-N331 PolarHBondContact O-N 3.37Å; T327-N331 VanDerWaalsContact O-N 3.07Å; T327-P347 HydrophobicContact CG2-CB 4.2Å; T327-P347 WeakPolarHBondContact CG2-O 3.42Å
328	F	95.6	Very high	94.4	Very high	118 Å²	118	41 Å²	41	52%	0.518	19%	0.189	S	C	.	.	H	α-helix	trans	-61.6	-43.1	177.3	176.3	-99	0	0	0	112.3	M324 N331 F332	M324-F328 VanDerWaalsContact O-CB 3.31Å; M324-F328 WeakPolarHBondContact O-CB 3.17Å; M324-F328 PolarHBondContact O-N 3.2Å; F328-N331 PolarHBondContact O-N 2.93Å; F328-F332 VanDerWaalsContact O-CB 3.23Å; F328-F332 WeakPolarHBondContact O-CB 3.37Å; F328-F332 PolarHBondContact O-N 2.89Å
329	T	95.8	Very high	93.9	Very high	6 Å²	6	46.5 Å²	46.5	4%	0.037	22%	0.22	C	C	.	.	H	α-helix	trans	-64.5	-46.4	-179.3	-57	0	0	0	0	111.2	F127 L131 I325 S326 T327 F332 F333	F127-T329 HydrophobicContact CD2-CG2 3.59Å; F127-T329 HydrophobicContact CE2-CG2 3.93Å; F127-T329 HydrophobicContact CG-CG2 4.35Å; L131-T329 HydrophobicContact CG-CG2 4.23Å; I325-T329 VanDerWaalsContact O-CB 3.23Å; I325-T329 WeakPolarHBondContact O-CB 3.16Å; I325-T329 PolarHBondContact O-N 2.81Å; I325-T329 PolarHBondContact O-OG1 2.94Å; S326-T329 PolarHBondContact O-N 2.79Å; T327-T329 PolarHBondContact O-N 3.35Å; T329-F332 PolarHBondContact O-N 2.82Å; T329-F333 HydrophobicContact CG2-CD2 3.75Å; T329-F333 HydrophobicContact CG2-CE2 3.83Å; T329-F333 VanDerWaalsContact O-CD2 3.31Å; T329-F333 WeakPolarHBondContact O-CD2 3.28Å; T329-F333 PolarHBondContact O-N 2.94Å; T329-F333 VanDerWaalsContact O-N 3.1Å
330	L	94.6	Very high	93.4	Very high	0 Å²	0	51.8 Å²	51.8	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-57.6	-53.3	176.5	176.5	59.8	0	0	0	111.4	A133 C134 A291 S326 T327 F332 F333 L334 L349	A133-L330 HydrophobicContact CB-CD1 3.84Å; A133-L330 HydrophobicContact CB-CD2 4.16Å; C134-L330 HydrophobicContact CB-CD1 3.83Å; A291-L330 HydrophobicContact CB-CD2 4.19Å; A291-L330 WeakPolarHBondContact O-CD2 3.45Å; S326-L330 PolarHBondContact O-N 3.17Å; T327-L330 PolarHBondContact O-N 3.34Å; L330-F332 VanDerWaalsContact C-N 3.34Å; L330-F332 PolarHBondContact O-N 3.04Å; L330-F333 PolarHBondContact O-N 3.38Å; L330-L334 HydrophobicContact CD1-CD1 3.63Å; L330-L334 HydrophobicContact CD1-CG 3.98Å; L330-L334 HydrophobicContact CG-CD1 3.95Å; L330-L334 WeakPolarHBondContact O-CB 3.34Å; L330-L334 WeakPolarHBondContact O-CG 3.29Å; L330-L334 PolarHBondContact O-N 3.38Å; L330-L349 HydrophobicContact CD1-CD2 4.19Å; L330-L349 HydrophobicContact CD2-CD2 4.24Å; L330-L349 HydrophobicContact CD2-CG 4.09Å
331	N	92.9	Very high	92.6	Very high	13 Å²	13	52.7 Å²	52.7	7%	0.07	26%	0.258	C	S	.	.	H	α-helix	trans	-62.3	-40.6	-177	-161.8	-8.5	0	0	0	111.7	T327 F328 S335 L344 S345 N346	T327-N331 WeakPolarHBondContact O-CB 3.35Å; T327-N331 PolarHBondContact O-N 3.37Å; T327-N331 VanDerWaalsContact O-N 3.07Å; F328-N331 PolarHBondContact O-N 2.93Å; N331-S335 WeakPolarHBondContact O-CB 3.42Å; N331-S335 PolarHBondContact O-N 3.49Å; N331-L344 HydrophobicContact CB-CD2 4.05Å; N331-L344 VanDerWaalsContact ND2-C 3.32Å; N331-L344 PolarHBondContact ND2-O 3.48Å; N331-L344 VanDerWaalsContact OD1-CA 3.23Å; N331-L344 WeakPolarHBondContact OD1-CA 3.28Å; N331-L344 PolarHBondContact OD1-O 3.34Å; N331-S345 PolarHBondContact OD1-N 3.23Å; N331-N346 WeakPolarHBondContact CA-O 3.07Å; N331-N346 WeakPolarHBondContact CB-O 3.46Å; N331-N346 VanDerWaalsContact CG-C 3.42Å; N331-N346 PolarHBondContact OD1-N 2.92Å; N331-N346 VanDerWaalsContact OD1-N 3.1Å; N331-N346 PolarHBondContact OD1-O 2.89Å
332	F	93.8	Very high	91.5	Very high	93 Å²	93	51.9 Å²	51.9	41%	0.408	27%	0.272	S	S	.	.	H	α-helix	trans	-62.4	-47.3	176	179.5	-100.5	0	0	0	113.1	F328 T329 L330 S335 I336	F328-F332 VanDerWaalsContact O-CB 3.23Å; F328-F332 WeakPolarHBondContact O-CB 3.37Å; F328-F332 PolarHBondContact O-N 2.89Å; T329-F332 PolarHBondContact O-N 2.82Å; L330-F332 VanDerWaalsContact C-N 3.34Å; L330-F332 PolarHBondContact O-N 3.04Å; F332-S335 PolarHBondContact O-N 2.78Å; F332-I336 HydrophobicContact CD1-CD1 3.99Å; F332-I336 HydrophobicContact CE1-CD1 3.51Å; F332-I336 HydrophobicContact CE2-CD1 4.3Å; F332-I336 HydrophobicContact CZ-CD1 3.7Å; F332-I336 WeakPolarHBondContact O-CG1 3.47Å; F332-I336 PolarHBondContact O-N 3Å
333	F	93.5	Very high	90.8	Very high	67 Å²	67	56.2 Å²	56.2	29%	0.294	29%	0.292	S	S	.	.	H	α-helix	trans	-72.6	-34.8	-179.7	-79.3	-71.4	0	0	0	112.9	F127 L131 C134 T329 L330 I336 Y337	F127-F333 HydrophobicContact CE2-CE2 4.05Å; F127-F333 HydrophobicContact CZ-CE2 4.43Å; L131-F333 HydrophobicContact CD2-CD2 3.65Å; L131-F333 HydrophobicContact CD2-CE2 3.52Å; L131-F333 HydrophobicContact CD2-CG 4.24Å; L131-F333 HydrophobicContact CD2-CZ 3.99Å; L131-F333 HydrophobicContact CG-CE2 4.34Å; C134-F333 HydrophobicContact CB-CB 4.43Å; T329-F333 HydrophobicContact CG2-CD2 3.75Å; T329-F333 HydrophobicContact CG2-CE2 3.83Å; T329-F333 VanDerWaalsContact O-CD2 3.31Å; T329-F333 WeakPolarHBondContact O-CD2 3.28Å; T329-F333 PolarHBondContact O-N 2.94Å; T329-F333 VanDerWaalsContact O-N 3.1Å; L330-F333 PolarHBondContact O-N 3.38Å; F333-I336 PolarHBondContact O-N 2.97Å; F333-Y337 WeakPolarHBondContact O-CB 3.5Å; F333-Y337 PolarHBondContact O-N 3.48Å
334	L	89.3	Confident	90.1	Very high	2 Å²	2	60.5 Å²	60.5	1%	0.01	31%	0.314	C	S	.	.	H	α-helix	trans	-67	-40.3	171.6	-69.6	177.8	0	0	0	112.2	I138 L330 I336 Y337 H338 N346	I138-L334 HydrophobicContact CG1-CD2 4.38Å; L330-L334 HydrophobicContact CD1-CD1 3.63Å; L330-L334 HydrophobicContact CD1-CG 3.98Å; L330-L334 HydrophobicContact CG-CD1 3.95Å; L330-L334 WeakPolarHBondContact O-CB 3.34Å; L330-L334 WeakPolarHBondContact O-CG 3.29Å; L330-L334 PolarHBondContact O-N 3.38Å; L334-I336 VanDerWaalsContact C-N 3.28Å; L334-I336 PolarHBondContact O-N 3.29Å; L334-Y337 PolarHBondContact O-N 2.9Å; L334-Y337 VanDerWaalsContact O-N 3.16Å; L334-H338 PolarHBondContact O-CD2 2.65Å; L334-H338 PolarHBondContact O-N 3.07Å; L334-N346 HydrophobicContact CD1-CB 4.18Å
335	S	91.1	Very high	89.3	Confident	7 Å²	7	58.9 Å²	58.9	5%	0.049	31%	0.311	C	S	.	.	H	α-helix	trans	-57.1	-39.7	174.1	166.9	0	0	0	0	112.3	N331 F332 K340 P341 G342 E343	N331-S335 WeakPolarHBondContact O-CB 3.42Å; N331-S335 PolarHBondContact O-N 3.49Å; F332-S335 PolarHBondContact O-N 2.78Å; S335-K340 CarbonylContact O-C 3.59Å; S335-K340 PolarHBondContact O-N 3.44Å; S335-K340 PolarHBondContact OG-O 2.96Å; S335-P341 WeakPolarHBondContact OG-CA 3.4Å; S335-G342 PolarHBondContact OG-N 3.03Å; S335-E343 PolarHBondContact OG-O 3.22Å
336	I	90.9	Very high	88.7	Confident	80 Å²	80	58.9 Å²	58.9	41%	0.41	31%	0.312	S	S	.	.	H	α-helix	trans	-67.8	-48.5	173.2	-68.7	167.6	0	0	0	111.1	F332 F333 L334 H338 N339	F332-I336 HydrophobicContact CD1-CD1 3.99Å; F332-I336 HydrophobicContact CE1-CD1 3.51Å; F332-I336 HydrophobicContact CE2-CD1 4.3Å; F332-I336 HydrophobicContact CZ-CD1 3.7Å; F332-I336 WeakPolarHBondContact O-CG1 3.47Å; F332-I336 PolarHBondContact O-N 3Å; F333-I336 PolarHBondContact O-N 2.97Å; L334-I336 VanDerWaalsContact C-N 3.28Å; L334-I336 PolarHBondContact O-N 3.29Å; I336-H338 PolarHBondContact O-N 3.1Å; I336-N339 WeakPolarHBondContact O-CA 3.46Å; I336-N339 PolarHBondContact O-N 3.36Å
337	Y	89.9	Confident	88.1	Confident	64 Å²	64	61 Å²	61	25%	0.251	33%	0.325	S	S	.	.	H	α-helix	trans	-61.5	-40.1	-177.6	168.4	-101.9	0	0	0	113.1	I138 E141 Q142 F333 L334 N339	I138-Y337 HydrophobicContact CB-CE2 4.45Å; I138-Y337 HydrophobicContact CD1-CD1 4.19Å; I138-Y337 HydrophobicContact CD1-CD2 3.7Å; I138-Y337 HydrophobicContact CD1-CE2 4.1Å; I138-Y337 HydrophobicContact CD1-CG 3.74Å; I138-Y337 HydrophobicContact CG1-CD1 3.97Å; I138-Y337 HydrophobicContact CG1-CD2 4.03Å; I138-Y337 HydrophobicContact CG1-CE1 3.92Å; I138-Y337 HydrophobicContact CG1-CE2 3.98Å; I138-Y337 HydrophobicContact CG1-CG 4.02Å; I138-Y337 HydrophobicContact CG2-CD2 4.35Å; I138-Y337 HydrophobicContact CG2-CE2 3.69Å; E141-Y337 WeakPolarHBondContact OE2-CE1 3.27Å; E141-Y337 VanDerWaalsContact OE2-CZ 3.27Å; E141-Y337 PolarHBondContact OE2-OH 2.55Å; Q142-Y337 PolarHBondContact NE2-OH 3.21Å; F333-Y337 WeakPolarHBondContact O-CB 3.5Å; F333-Y337 PolarHBondContact O-N 3.48Å; L334-Y337 PolarHBondContact O-N 2.9Å; L334-Y337 VanDerWaalsContact O-N 3.16Å; Y337-N339 PolarHBondContact O-N 2.98Å; Y337-N339 VanDerWaalsContact O-N 3.16Å; Y337-N339 PolarHBondContact O-ND2 3.45Å
338	H	87.3	Confident	87.7	Confident	73 Å²	73	60.3 Å²	60.3	34%	0.338	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.8	11.3	173.7	-59.8	-57.3	0	0	0	113.9	E141 L334 I336 K340 N346	E141-H338 IonicContact OE1-CE1 2.92Å; L334-H338 PolarHBondContact O-CD2 2.65Å; L334-H338 PolarHBondContact O-N 3.07Å; I336-H338 PolarHBondContact O-N 3.1Å; H338-K340 PolarHBondContact O-N 2.66Å; H338-N346 PolarHBondContact NE2-ND2 3.06Å
339	N	85.7	Confident	87.4	Confident	142 Å²	142	55.2 Å²	55.2	76%	0.759	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.3	26.6	178.9	-60.8	-86.5	0	0	0	114.8	I336 Y337 P341	I336-N339 WeakPolarHBondContact O-CA 3.46Å; I336-N339 PolarHBondContact O-N 3.36Å; Y337-N339 PolarHBondContact O-N 2.98Å; Y337-N339 VanDerWaalsContact O-N 3.16Å; Y337-N339 PolarHBondContact O-ND2 3.45Å; N339-P341 WeakPolarHBondContact O-CD 3.44Å
340	K	85.4	Confident	87	Confident	112 Å²	112	55.1 Å²	55.1	49%	0.487	30%	0.3	S	S	.	.			trans	-122.5	60.7	176.3	-63.6	-160.6	-172.6	178.4	0	111.8	S335 H338 G342 E343	S335-K340 CarbonylContact O-C 3.59Å; S335-K340 PolarHBondContact O-N 3.44Å; S335-K340 PolarHBondContact OG-O 2.96Å; H338-K340 PolarHBondContact O-N 2.66Å; K340-G342 PolarHBondContact O-N 3.13Å; K340-E343 HydrophobicContact CB-CB 4.11Å; K340-E343 HydrophobicContact CD-CB 4.36Å; K340-E343 WeakPolarHBondContact CD-OE2 3.29Å; K340-E343 WeakPolarHBondContact CE-OE2 3.48Å; K340-E343 IonicContact NZ-OE1 3.27Å; K340-E343 PolarHBondContact NZ-OE1 2.97Å; K340-E343 IonicContact NZ-OE2 2.82Å; K340-E343 PolarHBondContact NZ-OE2 3.37Å; K340-E343 PolarHBondContact O-N 2.79Å
341	P	77.9	Confident	86.7	Confident	106 Å²	106	57.2 Å²	57.2	69%	0.688	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60	114.1	-174.2	25.7	-35.1	0	0	0	111.4	S335 N339	S335-P341 WeakPolarHBondContact OG-CA 3.4Å; N339-P341 WeakPolarHBondContact O-CD 3.44Å
342	G	75.1	Confident	86.4	Confident	63 Å²	63	56.6 Å²	56.6	65%	0.649	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	109.3	-16.7	-178.6	0	0	0	0	0	115	S335 K340 L344	S335-G342 PolarHBondContact OG-N 3.03Å; K340-G342 PolarHBondContact O-N 3.13Å; G342-L344 PolarHBondContact O-N 2.93Å; G342-L344 VanDerWaalsContact O-N 3.12Å
343	E	82.9	Confident	86	Confident	90 Å²	90	52.7 Å²	52.7	42%	0.421	29%	0.294	S	S	.	.			trans	-79.4	93.3	169.1	-163.7	-172.3	132.4	0	0	109.5	S335 K340 S345	S335-E343 PolarHBondContact OG-O 3.22Å; K340-E343 HydrophobicContact CB-CB 4.11Å; K340-E343 HydrophobicContact CD-CB 4.36Å; K340-E343 WeakPolarHBondContact CD-OE2 3.29Å; K340-E343 WeakPolarHBondContact CE-OE2 3.48Å; K340-E343 IonicContact NZ-OE1 3.27Å; K340-E343 PolarHBondContact NZ-OE1 2.97Å; K340-E343 IonicContact NZ-OE2 2.82Å; K340-E343 PolarHBondContact NZ-OE2 3.37Å; K340-E343 PolarHBondContact O-N 2.79Å; E343-S345 PolarHBondContact O-N 3.08Å; E343-S345 PolarHBondContact OE1-OG 3.38Å
344	L	83.1	Confident	85.5	Confident	90 Å²	90	58.4 Å²	58.4	47%	0.471	31%	0.313	S	S	.	.			trans	-77.8	48.6	-178.2	-73.3	165.8	0	0	0	112.8	N331 G342	N331-L344 HydrophobicContact CB-CD2 4.05Å; N331-L344 VanDerWaalsContact ND2-C 3.32Å; N331-L344 PolarHBondContact ND2-O 3.48Å; N331-L344 VanDerWaalsContact OD1-CA 3.23Å; N331-L344 WeakPolarHBondContact OD1-CA 3.28Å; N331-L344 PolarHBondContact OD1-O 3.34Å; G342-L344 PolarHBondContact O-N 2.93Å; G342-L344 VanDerWaalsContact O-N 3.12Å
345	S	80.6	Confident	85.1	Confident	53 Å²	53	58.3 Å²	58.3	37%	0.371	31%	0.313	S	S	.	.			trans	-83.2	-11.3	-171.1	49.8	0	0	0	0	115.9	N331 E343 P347 N351	N331-S345 PolarHBondContact OD1-N 3.23Å; E343-S345 PolarHBondContact O-N 3.08Å; E343-S345 PolarHBondContact OE1-OG 3.38Å; S345-P347 VanDerWaalsContact O-CD 3.28Å; S345-P347 WeakPolarHBondContact O-CD 3.37Å; S345-N351 PolarHBondContact O-ND2 3.39Å
346	N	83.6	Confident	84.1	Confident	40 Å²	40	64.6 Å²	64.6	21%	0.214	34%	0.341	C	S	.	.			trans	-118.5	79.9	-175	-72.6	-14.7	0	0	0	111.7	N331 L334 H338 G348	N331-N346 WeakPolarHBondContact CA-O 3.07Å; N331-N346 WeakPolarHBondContact CB-O 3.46Å; N331-N346 VanDerWaalsContact CG-C 3.42Å; N331-N346 PolarHBondContact OD1-N 2.92Å; N331-N346 VanDerWaalsContact OD1-N 3.1Å; N331-N346 PolarHBondContact OD1-O 2.89Å; L334-N346 HydrophobicContact CD1-CB 4.18Å; H338-N346 PolarHBondContact NE2-ND2 3.06Å; N346-G348 VanDerWaalsContact C-N 3.33Å; N346-G348 PolarHBondContact O-N 3.44Å
347	P	85.6	Confident	83	Confident	43 Å²	43	64.4 Å²	64.4	28%	0.279	35%	0.347	S	S	.	.	S	Bend	trans	-71.8	-24.5	-177.4	29.9	-36.1	0	0	0	113.9	G294 T327 S345	G294-P347 WeakPolarHBondContact CA-O 3.38Å; T327-P347 HydrophobicContact CG2-CB 4.2Å; T327-P347 WeakPolarHBondContact CG2-O 3.42Å; S345-P347 VanDerWaalsContact O-CD 3.28Å; S345-P347 WeakPolarHBondContact O-CD 3.37Å
348	G	88.1	Confident	81.9	Confident	4 Å²	4	69.8 Å²	69.8	4%	0.041	37%	0.374	C	S	.	.	S	Bend	trans	-140.2	165.3	-179.6	0	0	0	0	0	112.2	A291 N346 I350	A291-G348 WeakPolarHBondContact O-CA 3.36Å; N346-G348 VanDerWaalsContact C-N 3.33Å; N346-G348 PolarHBondContact O-N 3.44Å; G348-I350 PolarHBondContact O-N 3.19Å
349	L	87.9	Confident	81	Confident	11 Å²	11	69 Å²	69	6%	0.058	38%	0.38	C	S	.	.	S	Bend	trans	-61.9	-26.3	173.3	-71	-179.7	0	0	0	113.4	A133 D137 K238 E239 M242 A291 A292 L330	A133-L349 HydrophobicContact CB-CD1 4Å; A133-L349 HydrophobicContact CB-CD2 4.15Å; A133-L349 HydrophobicContact CB-CG 4.16Å; D137-L349 HydrophobicContact CB-CD2 3.57Å; K238-L349 HydrophobicContact CG-CD1 4.43Å; E239-L349 VanDerWaalsContact OE2-CB 3.26Å; E239-L349 WeakPolarHBondContact OE2-CB 3.46Å; E239-L349 WeakPolarHBondContact OE2-CD1 3.27Å; M242-L349 HydrophobicContact CG-CD1 3.67Å; M242-L349 HydrophobicContact SD-CD1 4.3Å; A291-L349 PolarHBondContact O-N 3.07Å; A292-L349 PolarHBondContact O-N 3.47Å; L330-L349 HydrophobicContact CD1-CD2 4.19Å; L330-L349 HydrophobicContact CD2-CD2 4.24Å; L330-L349 HydrophobicContact CD2-CG 4.09Å
350	I	88.4	Confident	80.4	Confident	5 Å²	5	63 Å²	63	3%	0.026	35%	0.348	C	S	.	.	S	Bend	trans	-113.7	136.1	159.2	-172.3	160.5	0	0	0	110.5	A292 F293 G348 F352 E464 I508	A292-I350 PolarHBondContact O-N 2.82Å; F293-I350 HydrophobicContact CD1-CG2 3.69Å; F293-I350 HydrophobicContact CE1-CG2 4.24Å; G348-I350 PolarHBondContact O-N 3.19Å; I350-F352 HydrophobicContact CD1-CD1 4.01Å; I350-F352 HydrophobicContact CD1-CE1 3.6Å; I350-F352 HydrophobicContact CG1-CD1 3.97Å; I350-F352 HydrophobicContact CG1-CE1 3.91Å; I350-E464 HydrophobicContact CB-CG 4.48Å; I350-E464 HydrophobicContact CD1-CB 3.91Å; I350-E464 HydrophobicContact CD1-CG 4.23Å; I350-E464 HydrophobicContact CG1-CB 4.11Å; I350-I508 HydrophobicContact CB-CD1 4.47Å; I350-I508 HydrophobicContact CD1-CD1 3.6Å; I350-I508 HydrophobicContact CG2-CD1 4.29Å
351	N	88.8	Confident	80.2	Confident	43 Å²	43	64.5 Å²	64.5	23%	0.23	36%	0.357	C	S	.	.			trans	-128.3	113	176.3	176.6	-10.4	0	0	0	107.6	S345 G353	S345-N351 PolarHBondContact O-ND2 3.39Å; N351-G353 PolarHBondContact O-N 2.94Å; N351-G353 PolarHBondContact OD1-N 2.83Å
352	F	85.9	Confident	80.6	Confident	1 Å²	1	61.9 Å²	61.9	0%	0.004	33%	0.334	C	S	.	.			trans	-75.3	-8.2	-176.6	-61.8	-36.9	0	0	0	113.8	I350 F355 V467 F471 H472 L511 M564 A567 T568	I350-F352 HydrophobicContact CD1-CD1 4.01Å; I350-F352 HydrophobicContact CD1-CE1 3.6Å; I350-F352 HydrophobicContact CG1-CD1 3.97Å; I350-F352 HydrophobicContact CG1-CE1 3.91Å; F352-F355 HydrophobicContact CB-CE2 3.83Å; F352-F355 HydrophobicContact CB-CZ 4.3Å; F352-F355 WeakPolarHBondContact O-CE2 3.25Å; F352-V467 HydrophobicContact CD1-CG1 4.23Å; F352-V467 HydrophobicContact CE1-CG1 4.17Å; F352-F471 HydrophobicContact CB-CD2 4.14Å; F352-F471 HydrophobicContact CB-CE2 4.13Å; F352-F471 HydrophobicContact CD1-CD2 4.33Å; F352-F471 AromaticContact CD1-CE2 3.66Å; F352-F471 HydrophobicContact CD1-CE2 3.66Å; F352-F471 HydrophobicContact CD2-CE2 4.49Å; F352-F471 HydrophobicContact CE1-CE2 4.11Å; F352-F471 HydrophobicContact CG-CD2 4.39Å; F352-F471 AromaticContact CG-CE2 3.88Å; F352-F471 HydrophobicContact CG-CE2 3.88Å; F352-H472 PolarHBondContact O-CD2 2.83Å; F352-H472 VanDerWaalsContact O-CD2 3.29Å; F352-H472 PolarHBondContact O-NE2 2.83Å; F352-L511 HydrophobicContact CE1-CD1 4.15Å; F352-L511 HydrophobicContact CZ-CD1 3.97Å; F352-M564 HydrophobicContact CE2-CE 3.93Å; F352-M564 HydrophobicContact CE2-SD 3.79Å; F352-M564 HydrophobicContact CZ-CE 4.26Å; F352-M564 HydrophobicContact CZ-SD 4.04Å; F352-A567 HydrophobicContact CD2-CB 3.46Å; F352-A567 VanDerWaalsContact CD2-CB 3.46Å; F352-A567 HydrophobicContact CE2-CB 3.55Å; F352-A567 HydrophobicContact CG-CB 4.4Å; F352-T568 HydrophobicContact CD2-CG2 4.04Å
353	G	84.3	Confident	81.2	Confident	11 Å²	11	62 Å²	62	11%	0.113	32%	0.319	C	S	.	.			trans	84.5	-179.1	-171.2	0	0	0	0	0	113	N351 F355	N351-G353 PolarHBondContact O-N 2.94Å; N351-G353 PolarHBondContact OD1-N 2.83Å; G353-F355 WeakPolarHBondContact O-CD2 3.28Å; G353-F355 WeakPolarHBondContact O-CE2 3.35Å
354	R	83.9	Confident	81.5	Confident	186 Å²	186	64.8 Å²	64.8	70%	0.702	34%	0.336	S	S	*	.			trans	-95.6	132.4	-177.2	-56.9	-164.6	-165.1	170.6	0.6	111.4	E356 H472	R354-E356 HydrophobicContact CB-CG 4.19Å; R354-E356 WeakPolarHBondContact CD-OE2 3.42Å; R354-E356 IonicContact NH1-OE2 2.67Å; R354-H472 PolarHBondContact O-CE1 2.98Å; R354-H472 VanDerWaalsContact O-CE1 3.26Å
355	F	81.9	Confident	81.7	Confident	1 Å²	1	65.9 Å²	65.9	0%	0.004	34%	0.335	C	S	.	.			trans	-106.8	51.9	178.5	-64.6	-101.5	0	0	0	110.3	F352 G353 M360 F471 H472 L543 T568 N570	F352-F355 HydrophobicContact CB-CE2 3.83Å; F352-F355 HydrophobicContact CB-CZ 4.3Å; F352-F355 WeakPolarHBondContact O-CE2 3.25Å; G353-F355 WeakPolarHBondContact O-CD2 3.28Å; G353-F355 WeakPolarHBondContact O-CE2 3.35Å; F355-M360 HydrophobicContact CD1-SD 4.04Å; F355-F471 HydrophobicContact CE1-CB 4.13Å; F355-F471 HydrophobicContact CE1-CG 4.42Å; F355-F471 HydrophobicContact CZ-CB 3.9Å; F355-F471 AromaticContact CZ-CD2 3.72Å; F355-F471 HydrophobicContact CZ-CD2 3.72Å; F355-F471 HydrophobicContact CZ-CE2 4.46Å; F355-F471 HydrophobicContact CZ-CG 4.01Å; F355-H472 AromaticContact CE1-CE1 3.91Å; F355-H472 AromaticContact CE1-NE2 3.98Å; F355-H472 AromaticContact CE2-CE1 3.93Å; F355-H472 AromaticContact CE2-NE2 3.62Å; F355-H472 AromaticContact CZ-CE1 3.8Å; F355-H472 AromaticContact CZ-NE2 3.45Å; F355-H472 WeakPolarHBondContact CZ-NE2 3.35Å; F355-L543 HydrophobicContact CD1-CD2 4.13Å; F355-L543 HydrophobicContact CE1-CB 4.45Å; F355-L543 HydrophobicContact CE1-CD2 4.05Å; F355-T568 HydrophobicContact CD2-CG2 3.82Å; F355-T568 HydrophobicContact CE2-CG2 3.71Å; F355-T568 HydrophobicContact CG-CG2 4.46Å; F355-T568 HydrophobicContact CZ-CG2 4.25Å; F355-N570 HydrophobicContact CB-CB 4.37Å; F355-N570 PolarHBondContact O-ND2 3.31Å
356	E	68.1	Low	82.2	Confident	138 Å²	138	63.4 Å²	63.4	65%	0.645	32%	0.317	S	S	*	.			trans	-106.1	1.8	-171.9	-63.4	176.6	149	0	0	113.4	R354	R354-E356 HydrophobicContact CB-CG 4.19Å; R354-E356 WeakPolarHBondContact CD-OE2 3.42Å; R354-E356 IonicContact NH1-OE2 2.67Å
357	S	69.3	Low	82.6	Confident	76 Å²	76	62.8 Å²	62.8	53%	0.531	31%	0.314	S	S	.	.	S	Bend	trans	-80.5	146.2	-179.5	-53.9	0	0	0	0	112.2	A359 M360	S357-A359 PolarHBondContact O-N 3.09Å; S357-A359 VanDerWaalsContact O-N 3.17Å; S357-M360 WeakPolarHBondContact O-CA 3.35Å; S357-M360 WeakPolarHBondContact O-CB 3.49Å; S357-M360 PolarHBondContact O-N 3.04Å
358	E	66.3	Low	83.1	Confident	178 Å²	178	64.5 Å²	64.5	83%	0.832	33%	0.325	S	S	*	.	G	3₁₀ helix	trans	-54.8	-36.1	177.5	-61.5	177.7	168.7	0	0	113.1	M360 E361	E358-M360 PolarHBondContact O-N 3.49Å; E358-M360 VanDerWaalsContact O-N 3.17Å; E358-E361 PolarHBondContact O-N 2.74Å; E358-E361 VanDerWaalsContact O-N 3.13Å
359	A	68.1	Low	83.3	Confident	56 Å²	56	67.5 Å²	67.5	46%	0.463	34%	0.34	S	S	.	.	G	3₁₀ helix	trans	-64.3	-16.1	175.1	0	0	0	0	0	114.4	S357	S357-A359 PolarHBondContact O-N 3.09Å; S357-A359 VanDerWaalsContact O-N 3.17Å
360	M	72.9	Confident	83.7	Confident	15 Å²	15	67 Å²	67	7%	0.074	34%	0.337	C	S	.	.	G	3₁₀ helix	trans	-95.3	8.5	177.2	-64.6	-72.8	171	0	0	112.6	F355 S357 E358 D537 K540 Y573	F355-M360 HydrophobicContact CD1-SD 4.04Å; S357-M360 WeakPolarHBondContact O-CA 3.35Å; S357-M360 WeakPolarHBondContact O-CB 3.49Å; S357-M360 PolarHBondContact O-N 3.04Å; E358-M360 PolarHBondContact O-N 3.49Å; E358-M360 VanDerWaalsContact O-N 3.17Å; M360-D537 VanDerWaalsContact CE-OD2 3.25Å; M360-D537 WeakPolarHBondContact CE-OD2 3.38Å; M360-K540 HydrophobicContact SD-CB 4.26Å; M360-Y573 WeakPolarHBondContact O-CE2 3.4Å; M360-Y573 VanDerWaalsContact O-CZ 3.27Å; M360-Y573 PolarHBondContact O-OH 3.08Å
361	E	81.5	Confident	84.1	Confident	144 Å²	144	70 Å²	70	67%	0.673	35%	0.352	S	S	*	.			trans	-74.9	150.4	167.1	-63.2	-163.4	163.8	0	0	111.3	E358 K540	E358-E361 PolarHBondContact O-N 2.74Å; E358-E361 VanDerWaalsContact O-N 3.13Å; E361-K540 PolarHBondContact O-NZ 3.37Å
362	Y	86.4	Confident	84.5	Confident	52 Å²	52	70.3 Å²	70.3	20%	0.204	36%	0.361	C	S	.	.			trans	-119.1	144.9	177.1	78.2	-95.5	0	0	0	111.5	E366 I367 F370 T572 P576	Y362-E366 WeakPolarHBondContact CA-OE1 3.36Å; Y362-I367 HydrophobicContact CE2-CD1 4.44Å; Y362-I367 HydrophobicContact CE2-CG1 4.45Å; Y362-F370 HydrophobicContact CD2-CE2 4.1Å; Y362-F370 HydrophobicContact CG-CE2 4.15Å; Y362-T572 HydrophobicContact CE1-CG2 3.9Å; Y362-T572 WeakPolarHBondContact CE1-O 3.44Å; Y362-T572 PolarHBondContact OH-O 3.41Å; Y362-P576 HydrophobicContact CD1-CG 3.83Å; Y362-P576 HydrophobicContact CD2-CG 4.04Å; Y362-P576 HydrophobicContact CE1-CG 3.47Å; Y362-P576 VanDerWaalsContact CE1-CG 3.47Å; Y362-P576 HydrophobicContact CE2-CG 3.74Å; Y362-P576 HydrophobicContact CG-CG 4.11Å; Y362-P576 VanDerWaalsContact CZ-CG 3.46Å
363	N	88.5	Confident	85	Confident	66 Å²	66	70.8 Å²	70.8	35%	0.353	36%	0.363	S	S	.	.			trans	-100.7	156.9	-179.4	-63.6	-97.4	0	0	0	111.6	Y365 E366	N363-Y365 HydrophobicContact CB-CD1 3.58Å; N363-Y365 HydrophobicContact CB-CD2 4.43Å; N363-Y365 HydrophobicContact CB-CE1 3.18Å; N363-Y365 HydrophobicContact CB-CE2 4.11Å; N363-Y365 HydrophobicContact CB-CG 4.19Å; N363-Y365 VanDerWaalsContact CB-CZ 3.47Å; N363-Y365 PolarHBondContact ND2-OH 3.49Å; N363-Y365 PolarHBondContact O-N 3.41Å; N363-Y365 VanDerWaalsContact O-N 3.17Å; N363-E366 HydrophobicContact CB-CG 4.25Å; N363-E366 PolarHBondContact N-OE1 3.19Å; N363-E366 PolarHBondContact ND2-OE1 3.14Å; N363-E366 VanDerWaalsContact ND2-OE1 3.07Å; N363-E366 WeakPolarHBondContact O-CB 3.22Å; N363-E366 PolarHBondContact O-N 2.9Å
364	L	88.6	Confident	85.6	Confident	147 Å²	147	70.2 Å²	70.2	77%	0.77	36%	0.358	S	S	*	.	G	3₁₀ helix	trans	-56.5	-34.9	179.1	-164.3	80.6	0	0	0	112.8	E366 I367	L364-E366 PolarHBondContact O-N 3.12Å; L364-I367 HydrophobicContact CD1-CD1 3.86Å; L364-I367 HydrophobicContact CG-CD1 4.46Å; L364-I367 PolarHBondContact O-N 2.85Å
365	Y	88.2	Confident	86.3	Confident	114 Å²	114	63.2 Å²	63.2	45%	0.447	34%	0.34	S	S	.	.	G	3₁₀ helix	trans	-72.1	-10.7	179.4	62.8	-102.9	0	0	0	114	N363 P368 W535	N363-Y365 HydrophobicContact CB-CD1 3.58Å; N363-Y365 HydrophobicContact CB-CD2 4.43Å; N363-Y365 HydrophobicContact CB-CE1 3.18Å; N363-Y365 HydrophobicContact CB-CE2 4.11Å; N363-Y365 HydrophobicContact CB-CG 4.19Å; N363-Y365 VanDerWaalsContact CB-CZ 3.47Å; N363-Y365 PolarHBondContact ND2-OH 3.49Å; N363-Y365 PolarHBondContact O-N 3.41Å; N363-Y365 VanDerWaalsContact O-N 3.17Å; Y365-P368 WeakPolarHBondContact O-CD 3.45Å; Y365-W535 AromaticContact CE2-CD2 3.83Å; Y365-W535 HydrophobicContact CE2-CD2 3.83Å; Y365-W535 AromaticContact CE2-CE2 3.94Å; Y365-W535 AromaticContact CE2-CE3 3.76Å; Y365-W535 HydrophobicContact CE2-CE3 3.76Å; Y365-W535 AromaticContact CE2-CH2 3.99Å; Y365-W535 HydrophobicContact CE2-CH2 3.99Å; Y365-W535 HydrophobicContact CE2-CZ2 4.04Å; Y365-W535 AromaticContact CE2-CZ3 3.84Å; Y365-W535 HydrophobicContact CE2-CZ3 3.84Å
366	E	90.3	Very high	87	Confident	0 Å²	0	67.1 Å²	67.1	0%	0	36%	0.36	C	S	.	.	G	3₁₀ helix	trans	-84.7	-19.1	175.7	-57.8	-179.1	-118.8	0	0	112.2	Y362 N363 L364 L369 F370 W535 K540 Y541	Y362-E366 WeakPolarHBondContact CA-OE1 3.36Å; N363-E366 HydrophobicContact CB-CG 4.25Å; N363-E366 PolarHBondContact N-OE1 3.19Å; N363-E366 PolarHBondContact ND2-OE1 3.14Å; N363-E366 VanDerWaalsContact ND2-OE1 3.07Å; N363-E366 WeakPolarHBondContact O-CB 3.22Å; N363-E366 PolarHBondContact O-N 2.9Å; L364-E366 PolarHBondContact O-N 3.12Å; E366-L369 WeakPolarHBondContact O-CA 3.45Å; E366-L369 WeakPolarHBondContact O-CB 3.34Å; E366-L369 PolarHBondContact O-N 3.31Å; E366-F370 HydrophobicContact CB-CD2 4.46Å; E366-F370 HydrophobicContact CB-CE1 4.23Å; E366-F370 HydrophobicContact CB-CE2 3.79Å; E366-F370 HydrophobicContact CB-CZ 3.66Å; E366-F370 WeakPolarHBondContact O-CG 3.47Å; E366-F370 PolarHBondContact O-N 3.26Å; E366-W535 HydrophobicContact CG-CE3 4.23Å; E366-W535 HydrophobicContact CG-CZ3 4.19Å; E366-K540 VanDerWaalsContact CD-NZ 3.27Å; E366-K540 IonicContact OE1-NZ 3.01Å; E366-K540 PolarHBondContact OE1-NZ 3.49Å; E366-K540 WeakPolarHBondContact OE2-CE 3.48Å; E366-K540 IonicContact OE2-NZ 3.07Å; E366-K540 PolarHBondContact OE2-NZ 3.12Å; E366-Y541 PolarHBondContact OE2-OH 3.38Å
367	I	92.9	Very high	88.4	Confident	27 Å²	27	60.6 Å²	60.6	14%	0.138	33%	0.329	C	S	.	.	H	α-helix	trans	-57.4	-41.8	-177.4	-60.9	175.7	0	0	0	112.9	Y362 L364 L369 F370 I371 L579	Y362-I367 HydrophobicContact CE2-CD1 4.44Å; Y362-I367 HydrophobicContact CE2-CG1 4.45Å; L364-I367 HydrophobicContact CD1-CD1 3.86Å; L364-I367 HydrophobicContact CG-CD1 4.46Å; L364-I367 PolarHBondContact O-N 2.85Å; I367-L369 VanDerWaalsContact C-N 3.29Å; I367-L369 PolarHBondContact O-N 3.23Å; I367-F370 PolarHBondContact O-N 3.2Å; I367-I371 HydrophobicContact CG2-CD1 4.03Å; I367-I371 WeakPolarHBondContact O-CG1 3.4Å; I367-I371 PolarHBondContact O-N 2.88Å; I367-L579 HydrophobicContact CG2-CD1 3.73Å
368	P	94.4	Very high	89.8	Confident	80 Å²	80	57 Å²	57	52%	0.519	30%	0.304	S	S	.	.	H	α-helix	trans	-61.9	-32.5	172.7	-24.2	35.8	0	0	0	113.9	Y365 A372	Y365-P368 WeakPolarHBondContact O-CD 3.45Å; P368-A372 PolarHBondContact O-N 3.26Å
369	L	93.1	Very high	91.3	Very high	66 Å²	66	49.8 Å²	49.8	35%	0.346	28%	0.277	S	S	.	.	H	α-helix	trans	-70.4	-42.4	175.4	-59.5	175	0	0	0	110.6	E366 I367 I371 A372 M373 L525	E366-L369 WeakPolarHBondContact O-CA 3.45Å; E366-L369 WeakPolarHBondContact O-CB 3.34Å; E366-L369 PolarHBondContact O-N 3.31Å; I367-L369 VanDerWaalsContact C-N 3.29Å; I367-L369 PolarHBondContact O-N 3.23Å; L369-I371 VanDerWaalsContact C-N 3.34Å; L369-I371 PolarHBondContact O-N 3.03Å; L369-A372 PolarHBondContact O-N 2.95Å; L369-M373 WeakPolarHBondContact O-CG 3.26Å; L369-M373 PolarHBondContact O-N 3.14Å; L369-L525 HydrophobicContact CD1-CD1 4.47Å; L369-L525 HydrophobicContact CD1-CD2 3.91Å
370	F	95.6	Very high	92.7	Very high	1 Å²	1	50 Å²	50	0%	0.004	27%	0.27	C	S	.	.	H	α-helix	trans	-60.9	-41.7	173.8	-56.2	-32.7	0	0	0	111.8	Y362 E366 I367 A372 M373 G374 K540 Y541 I544 P576 V580	Y362-F370 HydrophobicContact CD2-CE2 4.1Å; Y362-F370 HydrophobicContact CG-CE2 4.15Å; E366-F370 HydrophobicContact CB-CD2 4.46Å; E366-F370 HydrophobicContact CB-CE1 4.23Å; E366-F370 HydrophobicContact CB-CE2 3.79Å; E366-F370 HydrophobicContact CB-CZ 3.66Å; E366-F370 WeakPolarHBondContact O-CG 3.47Å; E366-F370 PolarHBondContact O-N 3.26Å; I367-F370 PolarHBondContact O-N 3.2Å; F370-A372 PolarHBondContact O-N 3.33Å; F370-M373 PolarHBondContact O-N 2.86Å; F370-G374 PolarHBondContact O-N 3.46Å; F370-K540 HydrophobicContact CZ-CD 4.32Å; F370-K540 HydrophobicContact CZ-CG 4.41Å; F370-Y541 HydrophobicContact CD1-CD1 4.31Å; F370-Y541 HydrophobicContact CD1-CE1 4.12Å; F370-Y541 AromaticContact CE1-CD1 3.86Å; F370-Y541 HydrophobicContact CE1-CD1 3.86Å; F370-Y541 AromaticContact CE1-CE1 3.49Å; F370-Y541 HydrophobicContact CE1-CE1 3.49Å; F370-Y541 VanDerWaalsContact CE1-CE1 3.49Å; F370-Y541 HydrophobicContact CZ-CE1 4.43Å; F370-I544 HydrophobicContact CB-CG2 4.23Å; F370-I544 HydrophobicContact CD1-CB 4.29Å; F370-I544 HydrophobicContact CD1-CD1 4.29Å; F370-I544 HydrophobicContact CD1-CG1 3.83Å; F370-I544 HydrophobicContact CD1-CG2 3.89Å; F370-I544 HydrophobicContact CE1-CG1 3.88Å; F370-I544 HydrophobicContact CG-CD1 4.35Å; F370-I544 HydrophobicContact CG-CG1 4.39Å; F370-I544 HydrophobicContact CG-CG2 4.34Å; F370-P576 HydrophobicContact CD2-CB 3.82Å; F370-P576 HydrophobicContact CD2-CG 4.25Å; F370-P576 HydrophobicContact CE2-CB 4.08Å; F370-P576 HydrophobicContact CE2-CG 4.17Å; F370-V580 HydrophobicContact CB-CG2 3.79Å; F370-V580 WeakPolarHBondContact O-CG2 3.12Å
371	I	96.9	Very high	93.8	Very high	68 Å²	68	49.2 Å²	49.2	35%	0.349	27%	0.267	S	S	.	.	H	α-helix	trans	-60.3	-42.8	173.5	-74.7	166.9	0	0	0	111.6	I367 L369 G374 A375 L579 T583	I367-I371 HydrophobicContact CG2-CD1 4.03Å; I367-I371 WeakPolarHBondContact O-CG1 3.4Å; I367-I371 PolarHBondContact O-N 2.88Å; L369-I371 VanDerWaalsContact C-N 3.34Å; L369-I371 PolarHBondContact O-N 3.03Å; I371-G374 PolarHBondContact O-N 3.02Å; I371-A375 PolarHBondContact O-N 3.27Å; I371-L579 HydrophobicContact CG1-CB 4.48Å; I371-T583 HydrophobicContact CG2-CG2 4.17Å
372	A	96.8	Very high	94.6	Very high	49 Å²	49	42.7 Å²	42.7	41%	0.405	24%	0.237	S	C	.	.	H	α-helix	trans	-65.1	-40	175.6	0	0	0	0	0	112.4	P368 L369 F370 A375 I376	P368-A372 PolarHBondContact O-N 3.26Å; L369-A372 PolarHBondContact O-N 2.95Å; F370-A372 PolarHBondContact O-N 3.33Å; A372-A375 PolarHBondContact O-N 3.11Å; A372-I376 WeakPolarHBondContact O-CG1 3.45Å; A372-I376 PolarHBondContact O-N 3.3Å
373	M	96.9	Very high	95.1	Very high	11 Å²	11	44.8 Å²	44.8	5%	0.054	25%	0.247	C	C	.	.	H	α-helix	trans	-63.8	-38.7	172.5	-69	179	75	0	0	112	L369 F370 A375 I376 G377 W517 C521 Y541 I544	L369-M373 WeakPolarHBondContact O-CG 3.26Å; L369-M373 PolarHBondContact O-N 3.14Å; F370-M373 PolarHBondContact O-N 2.86Å; M373-A375 PolarHBondContact O-N 3.06Å; M373-I376 PolarHBondContact O-N 3.5Å; M373-G377 PolarHBondContact O-N 3.36Å; M373-W517 HydrophobicContact CB-CH2 4.06Å; M373-W517 HydrophobicContact CB-CZ3 4.08Å; M373-W517 HydrophobicContact CE-CE3 4.28Å; M373-W517 HydrophobicContact CE-CH2 4.25Å; M373-W517 HydrophobicContact CE-CZ3 3.57Å; M373-W517 HydrophobicContact CG-CZ3 4.14Å; M373-W517 WeakPolarHBondContact O-CH2 3.28Å; M373-C521 HydrophobicContact CE-CB 4.22Å; M373-Y541 WeakPolarHBondContact CE-O 3.39Å; M373-Y541 HydrophobicContact SD-CD1 3.8Å; M373-I544 HydrophobicContact CB-CG2 4.2Å; M373-I544 HydrophobicContact CE-CG2 4.23Å; M373-I544 HydrophobicContact SD-CG2 4.04Å
374	G	97.5	Very high	95.5	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-57.5	-46.5	171.9	0	0	0	0	0	112.3	F370 I371 I376 G377 G378 A584	F370-G374 PolarHBondContact O-N 3.46Å; I371-G374 PolarHBondContact O-N 3.02Å; G374-I376 PolarHBondContact O-N 3.04Å; G374-G377 PolarHBondContact O-N 3.06Å; G374-G378 PolarHBondContact O-N 3.21Å; G374-A584 WeakPolarHBondContact O-CA 3.35Å; G374-A584 VanDerWaalsContact O-CB 3.31Å; G374-A584 WeakPolarHBondContact O-CB 3.25Å
375	A	97.9	Very high	95.9	Very high	39 Å²	39	34.7 Å²	34.7	32%	0.322	19%	0.194	S	C	.	.	H	α-helix	trans	-61.2	-41.6	174.6	0	0	0	0	0	113	I371 A372 M373 G378 G379 V587	I371-A375 PolarHBondContact O-N 3.27Å; A372-A375 PolarHBondContact O-N 3.11Å; M373-A375 PolarHBondContact O-N 3.06Å; A375-G378 PolarHBondContact O-N 2.92Å; A375-G379 PolarHBondContact O-N 3.14Å; A375-V587 HydrophobicContact CB-CG2 4.03Å
376	I	97.5	Very high	96.3	Very high	83 Å²	83	34 Å²	34	43%	0.426	19%	0.194	S	C	.	.	H	α-helix	trans	-62.3	-48.7	175.4	-68.7	165.2	0	0	0	110.9	A372 M373 G374 G378 G379 L380 W517	A372-I376 WeakPolarHBondContact O-CG1 3.45Å; A372-I376 PolarHBondContact O-N 3.3Å; M373-I376 PolarHBondContact O-N 3.5Å; G374-I376 PolarHBondContact O-N 3.04Å; I376-G378 VanDerWaalsContact C-N 3.33Å; I376-G378 PolarHBondContact O-N 2.95Å; I376-G379 PolarHBondContact O-N 2.95Å; I376-L380 HydrophobicContact CG2-CD1 3.83Å; I376-L380 HydrophobicContact CG2-CG 4.32Å; I376-L380 WeakPolarHBondContact O-CB 3.42Å; I376-L380 WeakPolarHBondContact O-CG 3.15Å; I376-L380 PolarHBondContact O-N 3.3Å; I376-W517 HydrophobicContact CB-CH2 4.44Å; I376-W517 HydrophobicContact CG2-CH2 4.22Å; I376-W517 HydrophobicContact CG2-CZ2 4.47Å; I376-W517 HydrophobicContact CG2-CZ3 4.23Å
377	G	97.1	Very high	96.6	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-63.2	-35.9	177.4	0	0	0	0	0	113.4	M373 G374 G381	M373-G377 PolarHBondContact O-N 3.36Å; G374-G377 PolarHBondContact O-N 3.06Å; G377-G381 PolarHBondContact O-N 2.97Å
378	G	97.4	Very high	96.7	Very high	0 Å²	0	35 Å²	35	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-61.3	-47.4	171.6	0	0	0	0	0	112.8	G374 A375 I376 G381 A382 A584	G374-G378 PolarHBondContact O-N 3.21Å; A375-G378 PolarHBondContact O-N 2.92Å; I376-G378 VanDerWaalsContact C-N 3.33Å; I376-G378 PolarHBondContact O-N 2.95Å; G378-G381 PolarHBondContact O-N 2.81Å; G378-A382 WeakPolarHBondContact O-CB 3.21Å; G378-A382 PolarHBondContact O-N 3.34Å; G378-A584 VanDerWaalsContact CA-O 3.23Å; G378-A584 WeakPolarHBondContact CA-O 3.3Å
379	G	97.8	Very high	96.7	Very high	27 Å²	27	35.2 Å²	35.2	28%	0.278	19%	0.19	S	C	.	.	H	α-helix	trans	-64.8	-47.2	176.3	0	0	0	0	0	113.3	A375 I376 G381 A382 F383	A375-G379 PolarHBondContact O-N 3.14Å; I376-G379 PolarHBondContact O-N 2.95Å; G379-G381 VanDerWaalsContact C-N 3.31Å; G379-G381 PolarHBondContact O-N 2.88Å; G379-A382 PolarHBondContact O-N 2.91Å; G379-F383 WeakPolarHBondContact O-CB 3.46Å; G379-F383 PolarHBondContact O-N 2.97Å
380	L	97.5	Very high	96.8	Very high	60 Å²	60	39.4 Å²	39.4	31%	0.314	20%	0.201	S	C	.	.	H	α-helix	trans	-63.7	-36.5	176.3	-69.6	176.1	0	0	0	112.1	I376 F383 F384	I376-L380 HydrophobicContact CG2-CD1 3.83Å; I376-L380 HydrophobicContact CG2-CG 4.32Å; I376-L380 WeakPolarHBondContact O-CB 3.42Å; I376-L380 WeakPolarHBondContact O-CG 3.15Å; I376-L380 PolarHBondContact O-N 3.3Å; L380-F383 PolarHBondContact O-N 3.46Å; L380-F384 WeakPolarHBondContact O-CB 3.47Å; L380-F384 PolarHBondContact O-N 3.13Å
381	G	97.3	Very high	96.8	Very high	0 Å²	0	41 Å²	41	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-70.4	-39.8	175.6	0	0	0	0	0	113.4	G377 G378 G379 F384 N385 G552	G377-G381 PolarHBondContact O-N 2.97Å; G378-G381 PolarHBondContact O-N 2.81Å; G379-G381 VanDerWaalsContact C-N 3.31Å; G379-G381 PolarHBondContact O-N 2.88Å; G381-F384 WeakPolarHBondContact O-CB 3.43Å; G381-F384 PolarHBondContact O-N 3.46Å; G381-N385 VanDerWaalsContact O-CG 3.26Å; G381-N385 PolarHBondContact O-N 2.83Å; G381-N385 PolarHBondContact O-OD1 3.29Å; G381-G552 CarbonylContact C-O 3.25Å; G381-G552 WeakPolarHBondContact CA-O 3.4Å
382	A	97.2	Very high	96.6	Very high	6 Å²	6	38.4 Å²	38.4	5%	0.05	20%	0.197	C	C	.	.	H	α-helix	trans	-63.3	-40.5	170.9	0	0	0	0	0	112.1	G378 G379 N385 F386 F591 Q592	G378-A382 WeakPolarHBondContact O-CB 3.21Å; G378-A382 PolarHBondContact O-N 3.34Å; G379-A382 PolarHBondContact O-N 2.91Å; A382-N385 PolarHBondContact O-N 3.24Å; A382-F386 WeakPolarHBondContact O-CB 3.4Å; A382-F386 PolarHBondContact O-N 2.87Å; A382-F591 HydrophobicContact CB-CB 3.73Å; A382-F591 HydrophobicContact CB-CD2 4.41Å; A382-F591 HydrophobicContact CB-CG 4.49Å; A382-Q592 HydrophobicContact CB-CB 4.4Å
383	F	97.4	Very high	96.5	Very high	96 Å²	96	38.1 Å²	38.1	42%	0.421	19%	0.188	S	C	.	.	H	α-helix	trans	-63.3	-42.5	174.1	-177.9	-121.7	0	0	0	112.2	G379 L380 N385 F386 L387 F491	G379-F383 WeakPolarHBondContact O-CB 3.46Å; G379-F383 PolarHBondContact O-N 2.97Å; L380-F383 PolarHBondContact O-N 3.46Å; F383-N385 PolarHBondContact O-N 3.45Å; F383-F386 PolarHBondContact O-N 3.45Å; F383-L387 HydrophobicContact CD1-CD1 4.23Å; F383-L387 HydrophobicContact CD2-CG 4.47Å; F383-L387 HydrophobicContact CE1-CD1 3.74Å; F383-L387 HydrophobicContact CE2-CD1 4.22Å; F383-L387 HydrophobicContact CE2-CD2 4.22Å; F383-L387 HydrophobicContact CE2-CG 4.13Å; F383-L387 HydrophobicContact CZ-CD1 3.74Å; F383-L387 HydrophobicContact CZ-CD2 4.29Å; F383-L387 HydrophobicContact CZ-CG 4.15Å; F383-L387 WeakPolarHBondContact O-CG 3.17Å; F383-L387 PolarHBondContact O-N 3.17Å; F383-F491 AromaticContact CD1-CE1 3.85Å; F383-F491 HydrophobicContact CD1-CE1 3.85Å; F383-F491 AromaticContact CD1-CZ 3.71Å; F383-F491 HydrophobicContact CD1-CZ 3.71Å; F383-F491 AromaticContact CE1-CE1 3.94Å; F383-F491 HydrophobicContact CE1-CE1 3.94Å; F383-F491 HydrophobicContact CE1-CZ 4.28Å
384	F	97.7	Very high	96.3	Very high	1 Å²	1	42.7 Å²	42.7	0%	0.004	21%	0.208	C	C	.	.	H	α-helix	trans	-58	-46.9	172.4	-173.4	-89.8	0	0	0	111.6	L380 G381 F386 L387 N388 F491 A494 C495 V506 I553 L595	L380-F384 WeakPolarHBondContact O-CB 3.47Å; L380-F384 PolarHBondContact O-N 3.13Å; G381-F384 WeakPolarHBondContact O-CB 3.43Å; G381-F384 PolarHBondContact O-N 3.46Å; F384-F386 PolarHBondContact O-N 3.27Å; F384-L387 PolarHBondContact O-N 3.04Å; F384-N388 VanDerWaalsContact CD1-ND2 3.27Å; F384-N388 WeakPolarHBondContact CD1-ND2 3.35Å; F384-N388 WeakPolarHBondContact CE1-ND2 3.11Å; F384-N388 WeakPolarHBondContact O-CB 3.28Å; F384-N388 PolarHBondContact O-N 2.82Å; F384-N388 PolarHBondContact O-ND2 2.67Å; F384-F491 HydrophobicContact CB-CE2 3.9Å; F384-F491 HydrophobicContact CB-CZ 3.8Å; F384-F491 HydrophobicContact CD2-CD2 4.2Å; F384-F491 HydrophobicContact CD2-CE1 4.5Å; F384-F491 AromaticContact CD2-CE2 3.79Å; F384-F491 HydrophobicContact CD2-CE2 3.79Å; F384-F491 AromaticContact CD2-CZ 3.95Å; F384-F491 HydrophobicContact CD2-CZ 3.95Å; F384-F491 HydrophobicContact CG-CE2 4.33Å; F384-F491 HydrophobicContact CG-CZ 4.39Å; F384-A494 HydrophobicContact CE2-CB 4.22Å; F384-C495 HydrophobicContact CD2-CB 3.93Å; F384-C495 VanDerWaalsContact CE2-CA 3.48Å; F384-C495 HydrophobicContact CE2-CB 3.62Å; F384-C495 HydrophobicContact CZ-CB 4.29Å; F384-V506 HydrophobicContact CE1-CG2 4.25Å; F384-V506 HydrophobicContact CZ-CG2 4.28Å; F384-I553 HydrophobicContact CB-CD1 4.2Å; F384-I553 HydrophobicContact CB-CG1 4.13Å; F384-I553 HydrophobicContact CD1-CD1 3.69Å; F384-I553 HydrophobicContact CD1-CG1 3.86Å; F384-I553 HydrophobicContact CD1-CG2 4.01Å; F384-I553 HydrophobicContact CD2-CD1 4.21Å; F384-I553 HydrophobicContact CE1-CD1 4.05Å; F384-I553 HydrophobicContact CE1-CG2 4.16Å; F384-I553 HydrophobicContact CG-CD1 3.78Å; F384-I553 HydrophobicContact CG-CG1 4.11Å; F384-I553 HydrophobicContact CZ-CD1 4.45Å; F384-L595 HydrophobicContact CE1-CD2 4.11Å
385	N	96.5	Very high	96.2	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-66.4	-36.5	178.9	-67.1	-0.2	0	0	0	112.1	G381 A382 F383 N388 Y389 I553 Q592 E593 L595	G381-N385 VanDerWaalsContact O-CG 3.26Å; G381-N385 PolarHBondContact O-N 2.83Å; G381-N385 PolarHBondContact O-OD1 3.29Å; A382-N385 PolarHBondContact O-N 3.24Å; F383-N385 PolarHBondContact O-N 3.45Å; N385-N388 PolarHBondContact O-N 2.88Å; N385-Y389 PolarHBondContact O-N 3.36Å; N385-I553 PolarHBondContact ND2-O 3.26Å; N385-Q592 HydrophobicContact CB-CG 3.85Å; N385-E593 PolarHBondContact ND2-O 2.86Å; N385-L595 PolarHBondContact ND2-N 3.32Å
386	F	96.7	Very high	95.8	Very high	100 Å²	100	46.6 Å²	46.6	44%	0.439	22%	0.221	S	C	.	.	H	α-helix	trans	-63.8	-46.7	174.1	178.2	-94.5	0	0	0	112.2	A382 F383 F384 N388 Y389 W390	A382-F386 WeakPolarHBondContact O-CB 3.4Å; A382-F386 PolarHBondContact O-N 2.87Å; F383-F386 PolarHBondContact O-N 3.45Å; F384-F386 PolarHBondContact O-N 3.27Å; F386-N388 PolarHBondContact O-N 3.05Å; F386-Y389 WeakPolarHBondContact O-CB 3.3Å; F386-Y389 PolarHBondContact O-N 2.89Å; F386-W390 AromaticContact CE1-CD1 3.78Å; F386-W390 AromaticContact CE1-NE1 3.68Å; F386-W390 AromaticContact CE2-NE1 3.4Å; F386-W390 AromaticContact CZ-CD1 3.76Å; F386-W390 AromaticContact CZ-NE1 3.16Å; F386-W390 VanDerWaalsContact O-CD1 3.3Å; F386-W390 PolarHBondContact O-N 3.35Å
387	L	96.4	Very high	95.5	Very high	48 Å²	48	50.6 Å²	50.6	25%	0.251	23%	0.231	S	C	.	.	H	α-helix	trans	-62.6	-42.8	175.7	-68.3	177	0	0	0	111.8	F383 F384 Y389 W390 L391 F491 F492 C495	F383-L387 HydrophobicContact CD1-CD1 4.23Å; F383-L387 HydrophobicContact CD2-CG 4.47Å; F383-L387 HydrophobicContact CE1-CD1 3.74Å; F383-L387 HydrophobicContact CE2-CD1 4.22Å; F383-L387 HydrophobicContact CE2-CD2 4.22Å; F383-L387 HydrophobicContact CE2-CG 4.13Å; F383-L387 HydrophobicContact CZ-CD1 3.74Å; F383-L387 HydrophobicContact CZ-CD2 4.29Å; F383-L387 HydrophobicContact CZ-CG 4.15Å; F383-L387 WeakPolarHBondContact O-CG 3.17Å; F383-L387 PolarHBondContact O-N 3.17Å; F384-L387 PolarHBondContact O-N 3.04Å; L387-Y389 VanDerWaalsContact C-N 3.32Å; L387-Y389 PolarHBondContact O-N 2.98Å; L387-W390 PolarHBondContact O-N 3.48Å; L387-L391 WeakPolarHBondContact O-CB 3.3Å; L387-L391 PolarHBondContact O-N 3.37Å; L387-F491 HydrophobicContact CD1-CE1 4.11Å; L387-F492 HydrophobicContact CD1-CD1 4.3Å; L387-F492 HydrophobicContact CD1-CE1 3.92Å; L387-C495 VanDerWaalsContact CB-SG 3.5Å
388	N	95.3	Very high	95.4	Very high	0 Å²	0	57.1 Å²	57.1	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-61.7	-36.3	176.1	-86	-86.1	0	0	0	113.2	F384 N385 F386 T392 C495 Y498 L595	F384-N388 VanDerWaalsContact CD1-ND2 3.27Å; F384-N388 WeakPolarHBondContact CD1-ND2 3.35Å; F384-N388 WeakPolarHBondContact CE1-ND2 3.11Å; F384-N388 WeakPolarHBondContact O-CB 3.28Å; F384-N388 PolarHBondContact O-N 2.82Å; F384-N388 PolarHBondContact O-ND2 2.67Å; N385-N388 PolarHBondContact O-N 2.88Å; F386-N388 PolarHBondContact O-N 3.05Å; N388-T392 VanDerWaalsContact O-CB 3.28Å; N388-T392 WeakPolarHBondContact O-CB 2.84Å; N388-T392 PolarHBondContact O-N 3.17Å; N388-T392 PolarHBondContact O-OG1 2.9Å; N388-C495 PolarHBondContact ND2-SG 3.34Å; N388-C495 PolarHBondContact OD1-O 3.17Å; N388-Y498 VanDerWaalsContact OD1-CD1 3.3Å; N388-Y498 WeakPolarHBondContact OD1-CD1 3.37Å; N388-L595 HydrophobicContact CB-CD1 3.85Å
389	Y	94.5	Very high	95.1	Very high	84 Å²	84	58 Å²	58	33%	0.329	26%	0.262	S	S	.	.	H	α-helix	trans	-58.3	-53.2	175.6	176	-112	0	0	0	111.6	N385 F386 L387 T392 I393 L598 L602	N385-Y389 PolarHBondContact O-N 3.36Å; F386-Y389 WeakPolarHBondContact O-CB 3.3Å; F386-Y389 PolarHBondContact O-N 2.89Å; L387-Y389 VanDerWaalsContact C-N 3.32Å; L387-Y389 PolarHBondContact O-N 2.98Å; Y389-T392 PolarHBondContact O-N 2.74Å; Y389-I393 HydrophobicContact CD1-CD1 4.14Å; Y389-I393 HydrophobicContact CD2-CD1 4.1Å; Y389-I393 HydrophobicContact CE1-CD1 3.65Å; Y389-I393 HydrophobicContact CE2-CD1 3.61Å; Y389-I393 HydrophobicContact CE2-CG1 4.5Å; Y389-I393 HydrophobicContact CG-CD1 4.35Å; Y389-I393 WeakPolarHBondContact O-CG1 3.21Å; Y389-I393 PolarHBondContact O-N 3.31Å; Y389-L598 HydrophobicContact CD2-CD1 3.71Å; Y389-L598 HydrophobicContact CD2-CG 4.35Å; Y389-L598 HydrophobicContact CE2-CD1 4.33Å; Y389-L598 HydrophobicContact CG-CD1 4.46Å; Y389-L602 HydrophobicContact CD2-CD1 4.16Å; Y389-L602 HydrophobicContact CD2-CD2 4.33Å; Y389-L602 HydrophobicContact CE2-CD2 4.03Å
390	W	95.4	Very high	94.7	Very high	154 Å²	154	62 Å²	62	58%	0.583	27%	0.273	S	S	*	.	H	α-helix	trans	-64	-42.3	179.1	-74.7	100.8	0	0	0	112.4	F386 L387 T392 I393 F394	F386-W390 AromaticContact CE1-CD1 3.78Å; F386-W390 AromaticContact CE1-NE1 3.68Å; F386-W390 AromaticContact CE2-NE1 3.4Å; F386-W390 AromaticContact CZ-CD1 3.76Å; F386-W390 AromaticContact CZ-NE1 3.16Å; F386-W390 VanDerWaalsContact O-CD1 3.3Å; F386-W390 PolarHBondContact O-N 3.35Å; L387-W390 PolarHBondContact O-N 3.48Å; W390-T392 VanDerWaalsContact C-N 3.35Å; W390-T392 PolarHBondContact O-N 2.9Å; W390-I393 PolarHBondContact O-N 2.81Å; W390-F394 WeakPolarHBondContact O-CB 3.29Å; W390-F394 PolarHBondContact O-N 3Å
391	L	94.6	Very high	94.6	Very high	35 Å²	35	66.3 Å²	66.3	18%	0.183	29%	0.285	C	S	.	.	H	α-helix	trans	-61.5	-41.6	176.4	-179.2	65.9	0	0	0	112.1	L387 F394 R395 C495	L387-L391 WeakPolarHBondContact O-CB 3.3Å; L387-L391 PolarHBondContact O-N 3.37Å; L391-F394 WeakPolarHBondContact O-CB 3.27Å; L391-F394 PolarHBondContact O-N 3.21Å; L391-R395 WeakPolarHBondContact O-CG 3.34Å; L391-R395 PolarHBondContact O-N 3.26Å; L391-C495 WeakPolarHBondContact CD2-O 3.07Å
392	T	93.6	Very high	94.4	Very high	14 Å²	14	68.4 Å²	68.4	9%	0.086	30%	0.299	C	S	.	.	H	α-helix	trans	-70.6	-39.3	179.5	-57.5	0	0	0	0	111.5	N388 Y389 W390 F394 R395 I396 H599 L602	N388-T392 VanDerWaalsContact O-CB 3.28Å; N388-T392 WeakPolarHBondContact O-CB 2.84Å; N388-T392 PolarHBondContact O-N 3.17Å; N388-T392 PolarHBondContact O-OG1 2.9Å; Y389-T392 PolarHBondContact O-N 2.74Å; W390-T392 VanDerWaalsContact C-N 3.35Å; W390-T392 PolarHBondContact O-N 2.9Å; T392-F394 VanDerWaalsContact C-N 3.33Å; T392-F394 PolarHBondContact O-N 3.02Å; T392-R395 PolarHBondContact O-N 3.27Å; T392-I396 HydrophobicContact CG2-CD1 3.95Å; T392-I396 HydrophobicContact CG2-CG1 4.47Å; T392-I396 VanDerWaalsContact O-CG1 3.28Å; T392-I396 WeakPolarHBondContact O-CG1 3.19Å; T392-I396 PolarHBondContact O-N 3.41Å; T392-H599 PolarHBondContact OG1-NE2 3.28Å; T392-L602 HydrophobicContact CG2-CD1 3.82Å
393	I	93.3	Very high	94.3	Very high	42 Å²	42	71.8 Å²	71.8	22%	0.215	32%	0.322	C	S	.	.	H	α-helix	trans	-61.1	-41.7	171.6	-73.8	174	0	0	0	111.4	Y389 W390 I396 R397 L602	Y389-I393 HydrophobicContact CD1-CD1 4.14Å; Y389-I393 HydrophobicContact CD2-CD1 4.1Å; Y389-I393 HydrophobicContact CE1-CD1 3.65Å; Y389-I393 HydrophobicContact CE2-CD1 3.61Å; Y389-I393 HydrophobicContact CE2-CG1 4.5Å; Y389-I393 HydrophobicContact CG-CD1 4.35Å; Y389-I393 WeakPolarHBondContact O-CG1 3.21Å; Y389-I393 PolarHBondContact O-N 3.31Å; W390-I393 PolarHBondContact O-N 2.81Å; I393-I396 PolarHBondContact O-N 3.3Å; I393-R397 WeakPolarHBondContact O-CB 3.49Å; I393-R397 PolarHBondContact O-N 2.96Å; I393-L602 HydrophobicContact CD1-CD2 4.48Å; I393-L602 HydrophobicContact CG1-CD2 4.1Å
394	F	94.6	Very high	94.2	Very high	108 Å²	108	71 Å²	71	47%	0.474	32%	0.321	S	S	.	.	H	α-helix	trans	-60.4	-46.7	174.6	177.5	-91.5	0	0	0	111.6	W390 L391 T392 R397 Y398 V399	W390-F394 WeakPolarHBondContact O-CB 3.29Å; W390-F394 PolarHBondContact O-N 3Å; L391-F394 WeakPolarHBondContact O-CB 3.27Å; L391-F394 PolarHBondContact O-N 3.21Å; T392-F394 VanDerWaalsContact C-N 3.33Å; T392-F394 PolarHBondContact O-N 3.02Å; F394-R397 PolarHBondContact O-N 3.49Å; F394-Y398 AromaticContact CD2-CD2 3.42Å; F394-Y398 HydrophobicContact CD2-CD2 3.42Å; F394-Y398 VanDerWaalsContact CD2-CD2 3.42Å; F394-Y398 AromaticContact CD2-CE2 3.77Å; F394-Y398 HydrophobicContact CD2-CE2 3.77Å; F394-Y398 HydrophobicContact CD2-CG 4.46Å; F394-Y398 AromaticContact CE2-CD2 3.47Å; F394-Y398 HydrophobicContact CE2-CD2 3.47Å; F394-Y398 VanDerWaalsContact CE2-CD2 3.47Å; F394-Y398 AromaticContact CE2-CE2 3.92Å; F394-Y398 HydrophobicContact CE2-CE2 3.92Å; F394-Y398 HydrophobicContact CE2-CG 4.17Å; F394-Y398 HydrophobicContact CG-CD2 4.03Å; F394-Y398 HydrophobicContact CZ-CD2 4.14Å; F394-Y398 HydrophobicContact CZ-CG 4.48Å; F394-Y398 WeakPolarHBondContact O-CD2 3.45Å; F394-Y398 PolarHBondContact O-N 2.98Å; F394-V399 HydrophobicContact CD1-CG2 4.34Å; F394-V399 HydrophobicContact CE1-CG2 3.97Å
395	R	93.8	Very high	94.1	Very high	17 Å²	17	73.4 Å²	73.4	6%	0.064	33%	0.332	C	S	.	.	H	α-helix	trans	-61.5	-45.3	176.6	-75.6	178.1	176.1	141.6	-1.7	113.3	L391 T392 R397 V399 E408 W496 Y498 G499	L391-R395 WeakPolarHBondContact O-CG 3.34Å; L391-R395 PolarHBondContact O-N 3.26Å; T392-R395 PolarHBondContact O-N 3.27Å; R395-R397 VanDerWaalsContact C-N 3.26Å; R395-R397 PolarHBondContact O-N 3.47Å; R395-V399 HydrophobicContact CB-CB 4.4Å; R395-V399 HydrophobicContact CG-CB 4.32Å; R395-V399 HydrophobicContact CG-CG2 4.31Å; R395-V399 CarbonylContact O-C 3.21Å; R395-V399 VanDerWaalsContact O-C 3.25Å; R395-V399 WeakPolarHBondContact O-CA 3.4Å; R395-V399 PolarHBondContact O-N 2.74Å; R395-E408 IonicContact CZ-OE1 3.71Å; R395-E408 IonicContact CZ-OE2 2.75Å; R395-E408 VanDerWaalsContact NE-CD 3.31Å; R395-E408 IonicContact NE-OE1 3.51Å; R395-E408 PolarHBondContact NE-OE1 3.43Å; R395-E408 IonicContact NE-OE2 3.5Å; R395-E408 PolarHBondContact NE-OE2 2.89Å; R395-E408 IonicContact NH2-OE1 2.71Å; R395-E408 PolarHBondContact NH2-OE1 3.18Å; R395-E408 IonicContact NH2-OE2 2.66Å; R395-W496 PolarHBondContact NH2-O 2.74Å; R395-Y498 PolarHBondContact NH1-O 3.5Å; R395-G499 VanDerWaalsContact NH1-C 3.32Å
396	I	90.3	Very high	94.1	Very high	103 Å²	103	74 Å²	74	53%	0.528	34%	0.336	S	S	.	.	H	α-helix	trans	-59.5	-38.5	177	-70.2	167.1	0	0	0	110.9	T392 I393	T392-I396 HydrophobicContact CG2-CD1 3.95Å; T392-I396 HydrophobicContact CG2-CG1 4.47Å; T392-I396 VanDerWaalsContact O-CG1 3.28Å; T392-I396 WeakPolarHBondContact O-CG1 3.19Å; T392-I396 PolarHBondContact O-N 3.41Å; I393-I396 PolarHBondContact O-N 3.3Å
397	R	92.3	Very high	94.1	Very high	168 Å²	168	74.7 Å²	74.7	63%	0.634	34%	0.342	S	S	*	.	H	α-helix	trans	-80.3	-39.8	-177.8	-171.7	171.9	-65.5	169.8	2.8	114.3	I393 F394 R395	I393-R397 WeakPolarHBondContact O-CB 3.49Å; I393-R397 PolarHBondContact O-N 2.96Å; F394-R397 PolarHBondContact O-N 3.49Å; R395-R397 VanDerWaalsContact C-N 3.26Å; R395-R397 PolarHBondContact O-N 3.47Å
398	Y	93.4	Very high	94.1	Very high	136 Å²	136	73.7 Å²	73.7	53%	0.533	34%	0.336	S	S	.	.	H	α-helix	trans	-116.6	-37.8	-170	-58.9	-75.4	0	0	0	114	F394 H400	F394-Y398 AromaticContact CD2-CD2 3.42Å; F394-Y398 HydrophobicContact CD2-CD2 3.42Å; F394-Y398 VanDerWaalsContact CD2-CD2 3.42Å; F394-Y398 AromaticContact CD2-CE2 3.77Å; F394-Y398 HydrophobicContact CD2-CE2 3.77Å; F394-Y398 HydrophobicContact CD2-CG 4.46Å; F394-Y398 AromaticContact CE2-CD2 3.47Å; F394-Y398 HydrophobicContact CE2-CD2 3.47Å; F394-Y398 VanDerWaalsContact CE2-CD2 3.47Å; F394-Y398 AromaticContact CE2-CE2 3.92Å; F394-Y398 HydrophobicContact CE2-CE2 3.92Å; F394-Y398 HydrophobicContact CE2-CG 4.17Å; F394-Y398 HydrophobicContact CG-CD2 4.03Å; F394-Y398 HydrophobicContact CZ-CD2 4.14Å; F394-Y398 HydrophobicContact CZ-CG 4.48Å; F394-Y398 WeakPolarHBondContact O-CD2 3.45Å; F394-Y398 PolarHBondContact O-N 2.98Å; Y398-H400 VanDerWaalsContact C-N 3.35Å; Y398-H400 PolarHBondContact O-N 2.7Å
399	V	92.3	Very high	94.1	Very high	19 Å²	19	73.7 Å²	73.7	12%	0.115	34%	0.336	C	S	.	.			trans	-100.3	44.6	-173	-158.7	0	0	0	0	111.2	F394 R395 L404 Q405 E408	F394-V399 HydrophobicContact CD1-CG2 4.34Å; F394-V399 HydrophobicContact CE1-CG2 3.97Å; R395-V399 HydrophobicContact CB-CB 4.4Å; R395-V399 HydrophobicContact CG-CB 4.32Å; R395-V399 HydrophobicContact CG-CG2 4.31Å; R395-V399 CarbonylContact O-C 3.21Å; R395-V399 VanDerWaalsContact O-C 3.25Å; R395-V399 WeakPolarHBondContact O-CA 3.4Å; R395-V399 PolarHBondContact O-N 2.74Å; V399-L404 HydrophobicContact CG1-CB 3.98Å; V399-Q405 HydrophobicContact CG1-CG 4.08Å; V399-Q405 WeakPolarHBondContact O-CG 3.44Å; V399-Q405 PolarHBondContact O-NE2 2.99Å; V399-E408 HydrophobicContact CG1-CB 4.39Å
400	H	89.3	Confident	94.3	Very high	110 Å²	110	72.4 Å²	72.4	51%	0.509	33%	0.334	S	S	.	.			trans	-88.9	-5.5	-172.2	87.9	94.2	0	0	0	114.6	Y398	Y398-H400 VanDerWaalsContact C-N 3.35Å; Y398-H400 PolarHBondContact O-N 2.7Å
401	R	94.3	Very high	94.3	Very high	151 Å²	151	69.5 Å²	69.5	57%	0.57	33%	0.329	S	S	*	.	S	Bend	trans	-97.8	136.8	-178.5	-62.6	-70.1	-178.5	159.4	0.4	110.4	C403 L404 Q405	R401-C403 VanDerWaalsContact C-N 3.3Å; R401-C403 PolarHBondContact O-N 2.94Å; R401-L404 HydrophobicContact CB-CB 4.38Å; R401-L404 HydrophobicContact CB-CD1 4.07Å; R401-L404 HydrophobicContact CB-CG 4.1Å; R401-L404 HydrophobicContact CG-CD1 4.31Å; R401-L404 PolarHBondContact O-N 2.93Å; R401-Q405 WeakPolarHBondContact O-CG 3.36Å; R401-Q405 PolarHBondContact O-N 2.85Å
402	P	93.3	Very high	94.4	Very high	45 Å²	45	67.9 Å²	67.9	29%	0.292	32%	0.321	S	S	.	.	H	α-helix	trans	-62	-34.1	-174.3	24.5	-34.6	0	0	0	113.2	A187 F188 Q405 V406	A187-P402 HydrophobicContact CB-CB 3.97Å; F188-P402 HydrophobicContact CD1-CB 4.27Å; F188-P402 HydrophobicContact CD1-CG 4.26Å; F188-P402 HydrophobicContact CD2-CB 4.22Å; F188-P402 HydrophobicContact CE1-CB 4.02Å; F188-P402 HydrophobicContact CE1-CG 3.81Å; F188-P402 HydrophobicContact CE2-CB 3.97Å; F188-P402 HydrophobicContact CG-CB 4.38Å; F188-P402 HydrophobicContact CZ-CB 3.87Å; F188-P402 HydrophobicContact CZ-CG 4Å; P402-Q405 PolarHBondContact O-N 3.03Å; P402-V406 WeakPolarHBondContact O-CG2 3.23Å; P402-V406 PolarHBondContact O-N 3.12Å
403	C	95.4	Very high	94.6	Very high	77 Å²	77	67.2 Å²	67.2	52%	0.52	32%	0.316	S	S	.	.	H	α-helix	trans	-63.7	-41.4	173.9	-169.7	0	0	0	0	112.5	R401 Q405 V406 M407	R401-C403 VanDerWaalsContact C-N 3.3Å; R401-C403 PolarHBondContact O-N 2.94Å; C403-Q405 VanDerWaalsContact C-N 3.32Å; C403-V406 PolarHBondContact O-N 2.95Å; C403-M407 WeakPolarHBondContact O-CG 3.14Å; C403-M407 PolarHBondContact O-N 3.16Å
404	L	95.4	Very high	94.7	Very high	79 Å²	79	66.1 Å²	66.1	41%	0.414	31%	0.314	S	S	.	.	H	α-helix	trans	-68.5	-34.1	177.5	-63.7	178.2	0	0	0	111.5	V399 R401 M407 E408	V399-L404 HydrophobicContact CG1-CB 3.98Å; R401-L404 HydrophobicContact CB-CB 4.38Å; R401-L404 HydrophobicContact CB-CD1 4.07Å; R401-L404 HydrophobicContact CB-CG 4.1Å; R401-L404 HydrophobicContact CG-CD1 4.31Å; R401-L404 PolarHBondContact O-N 2.93Å; L404-M407 PolarHBondContact O-N 3.02Å; L404-E408 WeakPolarHBondContact O-CB 3.48Å; L404-E408 PolarHBondContact O-N 2.92Å
405	Q	95.2	Very high	94.8	Very high	51 Å²	51	62.9 Å²	62.9	24%	0.238	30%	0.303	C	S	.	.	H	α-helix	trans	-67.5	-40	176.7	-68.1	170.3	-12.4	0	0	112.4	V399 R401 P402 C403 E408 A409 A501	V399-Q405 HydrophobicContact CG1-CG 4.08Å; V399-Q405 WeakPolarHBondContact O-CG 3.44Å; V399-Q405 PolarHBondContact O-NE2 2.99Å; R401-Q405 WeakPolarHBondContact O-CG 3.36Å; R401-Q405 PolarHBondContact O-N 2.85Å; P402-Q405 PolarHBondContact O-N 3.03Å; C403-Q405 VanDerWaalsContact C-N 3.32Å; Q405-E408 PolarHBondContact O-N 3.21Å; Q405-A409 PolarHBondContact O-N 3.16Å; Q405-A501 HydrophobicContact CB-CB 3.75Å; Q405-A501 HydrophobicContact CG-CB 4.41Å
406	V	96.8	Very high	94.9	Very high	12 Å²	12	62.7 Å²	62.7	7%	0.073	30%	0.303	C	S	.	.	H	α-helix	trans	-65	-43.7	171.9	174.6	0	0	0	0	110.6	M180 I184 A187 F188 P402 C403 E408 A409 M410	M180-V406 HydrophobicContact CG-CG1 4.24Å; I184-V406 HydrophobicContact CG1-CG1 3.97Å; I184-V406 HydrophobicContact CG1-CG2 3.95Å; A187-V406 HydrophobicContact CB-CG2 4.18Å; F188-V406 HydrophobicContact CE2-CG2 4.15Å; P402-V406 WeakPolarHBondContact O-CG2 3.23Å; P402-V406 PolarHBondContact O-N 3.12Å; C403-V406 PolarHBondContact O-N 2.95Å; V406-E408 PolarHBondContact O-N 3.44Å; V406-A409 PolarHBondContact O-N 2.9Å; V406-M410 HydrophobicContact CG1-CG 4.42Å; V406-M410 HydrophobicContact CG1-SD 4Å; V406-M410 VanDerWaalsContact O-CG 3.3Å; V406-M410 WeakPolarHBondContact O-CG 3.35Å; V406-M410 PolarHBondContact O-N 3.41Å
407	M	96.3	Very high	95.1	Very high	116 Å²	116	57.8 Å²	57.8	57%	0.571	28%	0.278	S	S	*	.	H	α-helix	trans	-62	-39.8	175.6	-72	179.7	71.7	0	0	112.6	C403 L404 M410 L411	C403-M407 WeakPolarHBondContact O-CG 3.14Å; C403-M407 PolarHBondContact O-N 3.16Å; L404-M407 PolarHBondContact O-N 3.02Å; M407-M410 PolarHBondContact O-N 2.94Å; M407-L411 WeakPolarHBondContact O-CB 3.39Å; M407-L411 PolarHBondContact O-N 3.49Å
408	E	96.6	Very high	95.2	Very high	26 Å²	26	51.8 Å²	51.8	12%	0.121	26%	0.26	C	S	.	.	H	α-helix	trans	-62.6	-47.2	174.4	-165.3	-168.1	175.8	0	0	110.9	R395 V399 L404 Q405 V406 M410 L411 V412 W496 L500	R395-E408 IonicContact CZ-OE1 3.71Å; R395-E408 IonicContact CZ-OE2 2.75Å; R395-E408 VanDerWaalsContact NE-CD 3.31Å; R395-E408 IonicContact NE-OE1 3.51Å; R395-E408 PolarHBondContact NE-OE1 3.43Å; R395-E408 IonicContact NE-OE2 3.5Å; R395-E408 PolarHBondContact NE-OE2 2.89Å; R395-E408 IonicContact NH2-OE1 2.71Å; R395-E408 PolarHBondContact NH2-OE1 3.18Å; R395-E408 IonicContact NH2-OE2 2.66Å; V399-E408 HydrophobicContact CG1-CB 4.39Å; L404-E408 WeakPolarHBondContact O-CB 3.48Å; L404-E408 PolarHBondContact O-N 2.92Å; Q405-E408 PolarHBondContact O-N 3.21Å; V406-E408 PolarHBondContact O-N 3.44Å; E408-M410 PolarHBondContact O-N 3.5Å; E408-L411 WeakPolarHBondContact O-CB 3.36Å; E408-L411 PolarHBondContact O-N 3.02Å; E408-L411 VanDerWaalsContact O-N 3.16Å; E408-V412 WeakPolarHBondContact O-CG2 3.31Å; E408-V412 PolarHBondContact O-N 3.35Å; E408-W496 PolarHBondContact OE1-NE1 3.47Å; E408-L500 HydrophobicContact CB-CD2 4.23Å; E408-L500 HydrophobicContact CG-CD2 3.8Å
409	A	96.6	Very high	95.3	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-61.8	-42	178.7	0	0	0	0	0	112.2	V179 Q405 V406 L411 V412 A413 L500 V502	V179-A409 HydrophobicContact CG1-CB 3.67Å; V179-A409 WeakPolarHBondContact CG1-O 3.43Å; Q405-A409 PolarHBondContact O-N 3.16Å; V406-A409 PolarHBondContact O-N 2.9Å; A409-L411 VanDerWaalsContact C-N 3.34Å; A409-L411 PolarHBondContact O-N 3.12Å; A409-V412 PolarHBondContact O-N 2.97Å; A409-A413 WeakPolarHBondContact O-CB 3.5Å; A409-A413 PolarHBondContact O-N 3.32Å; A409-L500 HydrophobicContact CB-CD1 4.49Å; A409-L500 HydrophobicContact CB-CD2 4.4Å; A409-V502 HydrophobicContact CB-CG1 4.33Å
410	M	97	Very high	95.3	Very high	58 Å²	58	46.3 Å²	46.3	29%	0.286	24%	0.242	S	C	.	.	H	α-helix	trans	-63.3	-37.6	174.2	-71	175	72.6	0	0	112.8	S176 M180 V406 M407 E408 A414	S176-M410 PolarHBondContact OG-O 3.47Å; M180-M410 HydrophobicContact CB-CE 4.15Å; M180-M410 HydrophobicContact CB-CG 3.85Å; M180-M410 HydrophobicContact CB-SD 3.75Å; M180-M410 HydrophobicContact CG-CE 4.24Å; M180-M410 HydrophobicContact CG-CG 4.41Å; M180-M410 HydrophobicContact CG-SD 3.69Å; M180-M410 HydrophobicContact SD-CE 3.88Å; M180-M410 HydrophobicContact SD-SD 3.98Å; V406-M410 HydrophobicContact CG1-CG 4.42Å; V406-M410 HydrophobicContact CG1-SD 4Å; V406-M410 VanDerWaalsContact O-CG 3.3Å; V406-M410 WeakPolarHBondContact O-CG 3.35Å; V406-M410 PolarHBondContact O-N 3.41Å; M407-M410 PolarHBondContact O-N 2.94Å; E408-M410 PolarHBondContact O-N 3.5Å; M410-A414 WeakPolarHBondContact O-CB 3.33Å; M410-A414 PolarHBondContact O-N 3.07Å
411	L	96.8	Very high	95.4	Very high	93 Å²	93	41.7 Å²	41.7	49%	0.487	22%	0.22	S	C	.	.	H	α-helix	trans	-67.7	-45.9	176.7	177.4	62.6	0	0	0	111.5	M407 E408 A409 A413 A414 V415	M407-L411 WeakPolarHBondContact O-CB 3.39Å; M407-L411 PolarHBondContact O-N 3.49Å; E408-L411 WeakPolarHBondContact O-CB 3.36Å; E408-L411 PolarHBondContact O-N 3.02Å; E408-L411 VanDerWaalsContact O-N 3.16Å; A409-L411 VanDerWaalsContact C-N 3.34Å; A409-L411 PolarHBondContact O-N 3.12Å; L411-A413 VanDerWaalsContact C-N 3.33Å; L411-A413 PolarHBondContact O-N 2.87Å; L411-A414 PolarHBondContact O-N 3.04Å; L411-V415 HydrophobicContact CD1-CG2 4.13Å; L411-V415 WeakPolarHBondContact O-CG2 3.1Å; L411-V415 PolarHBondContact O-N 2.99Å
412	V	97.1	Very high	95.2	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-61.6	-43.3	176	178.2	0	0	0	0	110.3	L234 E408 A409 A414 V415 T416 W496 L500	L234-V412 HydrophobicContact CD2-CB 4.45Å; L234-V412 HydrophobicContact CD2-CG1 4.02Å; E408-V412 WeakPolarHBondContact O-CG2 3.31Å; E408-V412 PolarHBondContact O-N 3.35Å; A409-V412 PolarHBondContact O-N 2.97Å; V412-A414 VanDerWaalsContact C-N 3.31Å; V412-A414 PolarHBondContact O-N 3.03Å; V412-V415 PolarHBondContact O-N 3.31Å; V412-T416 WeakPolarHBondContact O-CB 3.2Å; V412-T416 PolarHBondContact O-N 3.46Å; V412-T416 PolarHBondContact O-OG1 3.35Å; V412-W496 HydrophobicContact CG2-CD2 3.71Å; V412-W496 VanDerWaalsContact CG2-CE2 3.49Å; V412-W496 HydrophobicContact CG2-CE3 4.17Å; V412-W496 HydrophobicContact CG2-CG 4.14Å; V412-W496 HydrophobicContact CG2-CH2 4.24Å; V412-W496 HydrophobicContact CG2-CZ2 3.78Å; V412-W496 HydrophobicContact CG2-CZ3 4.41Å; V412-L500 HydrophobicContact CB-CD1 3.93Å; V412-L500 HydrophobicContact CG1-CD1 4.04Å; V412-L500 HydrophobicContact CG2-CD1 4.08Å; V412-L500 HydrophobicContact CG2-CD2 4.2Å
413	A	96.5	Very high	95.1	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-58.6	-40.7	175.7	0	0	0	0	0	113.3	N175 V179 L234 A409 L411 A417	N175-A413 HydrophobicContact CB-CB 4.44Å; V179-A413 HydrophobicContact CB-CB 3.89Å; V179-A413 HydrophobicContact CG1-CB 4.19Å; V179-A413 HydrophobicContact CG2-CB 3.66Å; L234-A413 HydrophobicContact CD2-CB 4Å; A409-A413 WeakPolarHBondContact O-CB 3.5Å; A409-A413 PolarHBondContact O-N 3.32Å; L411-A413 VanDerWaalsContact C-N 3.33Å; L411-A413 PolarHBondContact O-N 2.87Å; A413-A417 PolarHBondContact O-N 2.93Å
414	A	96.7	Very high	94.8	Very high	19 Å²	19	34.2 Å²	34.2	16%	0.157	18%	0.182	C	C	.	.	H	α-helix	trans	-67.3	-46.5	175.8	0	0	0	0	0	111.7	V172 M410 L411 V412 A417 T418	V172-A414 HydrophobicContact CG1-CB 3.77Å; M410-A414 WeakPolarHBondContact O-CB 3.33Å; M410-A414 PolarHBondContact O-N 3.07Å; L411-A414 PolarHBondContact O-N 3.04Å; V412-A414 VanDerWaalsContact C-N 3.31Å; V412-A414 PolarHBondContact O-N 3.03Å; A414-A417 PolarHBondContact O-N 3.43Å; A414-T418 WeakPolarHBondContact O-CG2 3.2Å; A414-T418 PolarHBondContact O-N 2.66Å
415	V	96.8	Very high	94.4	Very high	40 Å²	40	35.3 Å²	35.3	24%	0.242	18%	0.181	C	C	.	.	H	α-helix	trans	-66.7	-37.3	179.1	176.6	0	0	0	0	111.6	L411 V412 A417 T418 V419 W496	L411-V415 HydrophobicContact CD1-CG2 4.13Å; L411-V415 WeakPolarHBondContact O-CG2 3.1Å; L411-V415 PolarHBondContact O-N 2.99Å; V412-V415 PolarHBondContact O-N 3.31Å; V415-A417 VanDerWaalsContact C-N 3.33Å; V415-A417 PolarHBondContact O-N 2.75Å; V415-T418 WeakPolarHBondContact CA-OG1 3.26Å; V415-T418 PolarHBondContact O-N 3.02Å; V415-T418 PolarHBondContact O-OG1 2.92Å; V415-V419 HydrophobicContact CG1-CG2 3.94Å; V415-V419 WeakPolarHBondContact O-CB 3.33Å; V415-V419 VanDerWaalsContact O-CG2 3.28Å; V415-V419 WeakPolarHBondContact O-CG2 3.42Å; V415-V419 PolarHBondContact O-N 2.69Å; V415-W496 HydrophobicContact CB-CZ3 4.2Å; V415-W496 HydrophobicContact CG1-CZ3 4.04Å; V415-W496 HydrophobicContact CG2-CH2 4.4Å; V415-W496 HydrophobicContact CG2-CZ3 4.34Å
416	T	95.3	Very high	94	Very high	13 Å²	13	40.1 Å²	40.1	8%	0.08	20%	0.202	C	C	.	.	H	α-helix	trans	-60	-43.9	173.4	-58.1	0	0	0	0	111.1	G233 V412 A420 L493	G233-T416 VanDerWaalsContact O-CG2 3.3Å; G233-T416 WeakPolarHBondContact O-CG2 3.38Å; V412-T416 WeakPolarHBondContact O-CB 3.2Å; V412-T416 PolarHBondContact O-N 3.46Å; V412-T416 PolarHBondContact O-OG1 3.35Å; T416-A420 VanDerWaalsContact O-CB 3.25Å; T416-A420 WeakPolarHBondContact O-CB 3.36Å; T416-A420 PolarHBondContact O-N 3.09Å; T416-L493 HydrophobicContact CG2-CD1 4.45Å
417	A	94.5	Very high	93.5	Very high	0 Å²	0	40 Å²	40	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-66.2	-43	175.7	0	0	0	0	0	112.7	W171 V172 A413 A414 V415 F421	W171-A417 HydrophobicContact CD2-CB 4.16Å; W171-A417 HydrophobicContact CG-CB 4.09Å; V172-A417 HydrophobicContact CG2-CB 3.94Å; A413-A417 PolarHBondContact O-N 2.93Å; A414-A417 PolarHBondContact O-N 3.43Å; V415-A417 VanDerWaalsContact C-N 3.33Å; V415-A417 PolarHBondContact O-N 2.75Å; A417-F421 WeakPolarHBondContact O-CB 3.46Å; A417-F421 PolarHBondContact O-N 3.37Å
418	T	94.6	Very high	92.7	Very high	42 Å²	42	40.3 Å²	40.3	26%	0.258	21%	0.21	S	C	.	.	H	α-helix	trans	-68.5	-42.5	179.8	64.6	0	0	0	0	112.4	L168 V172 A414 V415 F421 I422	L168-T418 HydrophobicContact CD1-CG2 4Å; V172-T418 HydrophobicContact CG2-CG2 3.71Å; A414-T418 WeakPolarHBondContact O-CG2 3.2Å; A414-T418 PolarHBondContact O-N 2.66Å; V415-T418 WeakPolarHBondContact CA-OG1 3.26Å; V415-T418 PolarHBondContact O-N 3.02Å; V415-T418 PolarHBondContact O-OG1 2.92Å; T418-F421 PolarHBondContact O-N 2.89Å; T418-I422 VanDerWaalsContact O-CB 3.3Å; T418-I422 WeakPolarHBondContact O-CB 3.46Å; T418-I422 WeakPolarHBondContact O-CD1 3.2Å; T418-I422 WeakPolarHBondContact O-CG1 3.37Å; T418-I422 PolarHBondContact O-N 3.02Å
419	V	94.1	Very high	92	Very high	39 Å²	39	40.4 Å²	40.4	24%	0.236	21%	0.211	C	C	.	.	H	α-helix	trans	-62.4	-47.5	175.9	171.8	0	0	0	0	110.4	V415 F421 I422 M423 T489 L493	V415-V419 HydrophobicContact CG1-CG2 3.94Å; V415-V419 WeakPolarHBondContact O-CB 3.33Å; V415-V419 VanDerWaalsContact O-CG2 3.28Å; V415-V419 WeakPolarHBondContact O-CG2 3.42Å; V415-V419 PolarHBondContact O-N 2.69Å; V419-F421 PolarHBondContact O-N 2.77Å; V419-I422 PolarHBondContact O-N 3.5Å; V419-M423 HydrophobicContact CG1-CG 4.23Å; V419-M423 VanDerWaalsContact O-CB 3.26Å; V419-M423 WeakPolarHBondContact O-CB 3.45Å; V419-M423 WeakPolarHBondContact O-CG 3.37Å; V419-M423 PolarHBondContact O-N 2.95Å; V419-T489 HydrophobicContact CG1-CG2 4.39Å; V419-L493 HydrophobicContact CB-CD1 4.49Å; V419-L493 HydrophobicContact CG1-CD1 4.14Å
420	A	92	Very high	91.4	Very high	2 Å²	2	42.1 Å²	42.1	2%	0.017	22%	0.223	C	C	.	.	H	α-helix	trans	-59.7	-43.9	177.5	0	0	0	0	0	112.2	W171 T416 M423 I424 F459	W171-A420 HydrophobicContact CH2-CB 3.5Å; W171-A420 VanDerWaalsContact CH2-CB 3.5Å; W171-A420 HydrophobicContact CZ2-CB 4.08Å; W171-A420 HydrophobicContact CZ3-CB 4.15Å; T416-A420 VanDerWaalsContact O-CB 3.25Å; T416-A420 WeakPolarHBondContact O-CB 3.36Å; T416-A420 PolarHBondContact O-N 3.09Å; A420-M423 PolarHBondContact O-N 3.49Å; A420-I424 WeakPolarHBondContact O-CD1 3.17Å; A420-I424 WeakPolarHBondContact O-CG1 3.07Å; A420-I424 PolarHBondContact O-N 3Å; A420-F459 HydrophobicContact CB-CB 4.1Å; A420-F459 HydrophobicContact CB-CD1 3.61Å; A420-F459 HydrophobicContact CB-CD2 4.24Å; A420-F459 HydrophobicContact CB-CE1 3.99Å; A420-F459 HydrophobicContact CB-CG 3.76Å; A420-F459 HydrophobicContact CB-CZ 4.45Å
421	F	91.7	Very high	90.6	Very high	13 Å²	13	42 Å²	42	6%	0.057	22%	0.222	C	C	.	.	H	α-helix	trans	-66.6	-43.5	177.6	-170	-93.3	0	0	0	113.2	I155 L164 L168 W171 A417 T418 V419 M423 I424 Y425	I155-F421 HydrophobicContact CD1-CE2 4.26Å; I155-F421 HydrophobicContact CG1-CE2 4.46Å; L164-F421 HydrophobicContact CB-CZ 4.21Å; L164-F421 HydrophobicContact CD2-CZ 4.48Å; L168-F421 HydrophobicContact CB-CD1 4.03Å; L168-F421 HydrophobicContact CB-CE1 4.05Å; L168-F421 HydrophobicContact CB-CG 4.3Å; L168-F421 HydrophobicContact CB-CZ 4.33Å; L168-F421 HydrophobicContact CD1-CB 3.76Å; L168-F421 HydrophobicContact CD1-CD1 3.99Å; L168-F421 HydrophobicContact CD1-CG 3.88Å; L168-F421 HydrophobicContact CD2-CD1 4.19Å; L168-F421 HydrophobicContact CG-CD1 4.3Å; W171-F421 HydrophobicContact CE3-CB 3.93Å; W171-F421 AromaticContact CE3-CD2 3.94Å; W171-F421 HydrophobicContact CE3-CD2 3.94Å; W171-F421 HydrophobicContact CE3-CG 4.41Å; W171-F421 HydrophobicContact CZ3-CB 3.75Å; W171-F421 HydrophobicContact CZ3-CD2 4.05Å; W171-F421 HydrophobicContact CZ3-CG 4.43Å; A417-F421 WeakPolarHBondContact O-CB 3.46Å; A417-F421 PolarHBondContact O-N 3.37Å; T418-F421 PolarHBondContact O-N 2.89Å; V419-F421 PolarHBondContact O-N 2.77Å; F421-M423 VanDerWaalsContact C-N 3.32Å; F421-M423 PolarHBondContact O-N 3Å; F421-I424 PolarHBondContact O-N 3.16Å; F421-Y425 VanDerWaalsContact O-CB 3.29Å; F421-Y425 WeakPolarHBondContact O-CB 3.35Å; F421-Y425 PolarHBondContact O-N 3.01Å
422	I	91.7	Very high	89.8	Confident	84 Å²	84	41.6 Å²	41.6	43%	0.431	23%	0.225	S	C	.	.	H	α-helix	trans	-60.4	-44.5	176.5	-74.7	166.1	0	0	0	110.4	T418 V419 Y425 F426	T418-I422 VanDerWaalsContact O-CB 3.3Å; T418-I422 WeakPolarHBondContact O-CB 3.46Å; T418-I422 WeakPolarHBondContact O-CD1 3.2Å; T418-I422 WeakPolarHBondContact O-CG1 3.37Å; T418-I422 PolarHBondContact O-N 3.02Å; V419-I422 PolarHBondContact O-N 3.5Å; I422-Y425 PolarHBondContact O-N 3.09Å; I422-F426 HydrophobicContact CG2-CD2 3.84Å; I422-F426 HydrophobicContact CG2-CE2 3.97Å; I422-F426 VanDerWaalsContact O-CD2 3.28Å; I422-F426 WeakPolarHBondContact O-CD2 3.18Å; I422-F426 PolarHBondContact O-N 3.02Å; I422-F426 VanDerWaalsContact O-N 3.08Å
423	M	89.4	Confident	88.6	Confident	30 Å²	30	45 Å²	45	15%	0.148	24%	0.243	C	C	.	.	H	α-helix	trans	-60.1	-49.5	176.9	-76.3	-65.9	-72.6	0	0	111.5	V419 A420 F421 Y425 F426 S427 M455 F459 L485 T489	V419-M423 HydrophobicContact CG1-CG 4.23Å; V419-M423 VanDerWaalsContact O-CB 3.26Å; V419-M423 WeakPolarHBondContact O-CB 3.45Å; V419-M423 WeakPolarHBondContact O-CG 3.37Å; V419-M423 PolarHBondContact O-N 2.95Å; A420-M423 PolarHBondContact O-N 3.49Å; F421-M423 VanDerWaalsContact C-N 3.32Å; F421-M423 PolarHBondContact O-N 3Å; M423-Y425 VanDerWaalsContact C-N 3.35Å; M423-Y425 PolarHBondContact O-N 3.5Å; M423-F426 PolarHBondContact O-N 3.4Å; M423-S427 WeakPolarHBondContact O-CB 3.48Å; M423-S427 PolarHBondContact O-N 3.27Å; M423-S427 VanDerWaalsContact O-N 3.1Å; M423-M455 HydrophobicContact CB-CG 4.42Å; M423-M455 HydrophobicContact CB-SD 3.63Å; M423-M455 HydrophobicContact CE-CE 3.52Å; M423-M455 HydrophobicContact CE-SD 3.63Å; M423-M455 HydrophobicContact SD-SD 4.49Å; M423-F459 HydrophobicContact CB-CE2 3.94Å; M423-F459 HydrophobicContact CG-CE2 4.34Å; M423-L485 HydrophobicContact CE-CB 3.53Å; M423-T489 HydrophobicContact CE-CG2 4.38Å; M423-T489 HydrophobicContact SD-CG2 4.32Å
424	I	89.4	Confident	87	Confident	2 Å²	2	46.9 Å²	46.9	1%	0.01	26%	0.261	C	S	.	.	H	α-helix	trans	-61.1	-41.9	176	-65.8	164.1	0	0	0	111.6	W171 A420 F421 F426 S427 L443 L445 N453 M455 A456 F459 F460	W171-I424 HydrophobicContact CH2-CD1 4.23Å; W171-I424 HydrophobicContact CZ3-CD1 4.35Å; A420-I424 WeakPolarHBondContact O-CD1 3.17Å; A420-I424 WeakPolarHBondContact O-CG1 3.07Å; A420-I424 PolarHBondContact O-N 3Å; F421-I424 PolarHBondContact O-N 3.16Å; I424-F426 PolarHBondContact O-N 3.48Å; I424-S427 PolarHBondContact O-N 2.94Å; I424-L443 HydrophobicContact CG2-CD2 4.24Å; I424-L445 HydrophobicContact CG2-CD2 3.88Å; I424-N453 PolarHBondContact O-ND2 3.22Å; I424-M455 HydrophobicContact CG1-CG 4.36Å; I424-A456 HydrophobicContact CD1-CB 4.19Å; I424-A456 HydrophobicContact CG1-CB 4.24Å; I424-A456 HydrophobicContact CG2-CB 4.1Å; I424-F459 HydrophobicContact CD1-CB 4.18Å; I424-F460 HydrophobicContact CD1-CD2 3.68Å; I424-F460 HydrophobicContact CD1-CE2 3.72Å
425	Y	88.1	Confident	84.9	Confident	101 Å²	101	51.7 Å²	51.7	40%	0.396	29%	0.291	S	S	.	.	H	α-helix	trans	-64	-36.5	-178.9	-177.6	-83.2	0	0	0	113.3	L164 F421 I422 M423 F446	L164-Y425 HydrophobicContact CD1-CD2 4.32Å; L164-Y425 HydrophobicContact CD1-CE2 4.01Å; F421-Y425 VanDerWaalsContact O-CB 3.29Å; F421-Y425 WeakPolarHBondContact O-CB 3.35Å; F421-Y425 PolarHBondContact O-N 3.01Å; I422-Y425 PolarHBondContact O-N 3.09Å; M423-Y425 VanDerWaalsContact C-N 3.35Å; M423-Y425 PolarHBondContact O-N 3.5Å; Y425-F446 AromaticContact CD2-CE2 3.76Å; Y425-F446 HydrophobicContact CD2-CE2 3.76Å; Y425-F446 HydrophobicContact CD2-CZ 4.32Å; Y425-F446 AromaticContact CE2-CE2 3.64Å; Y425-F446 HydrophobicContact CE2-CE2 3.64Å; Y425-F446 AromaticContact CE2-CZ 3.79Å; Y425-F446 HydrophobicContact CE2-CZ 3.79Å; Y425-F446 HydrophobicContact CG-CE2 4.4Å
426	F	87.3	Confident	82.7	Confident	153 Å²	153	56.3 Å²	56.3	67%	0.671	32%	0.315	S	S	*	.	H	α-helix	trans	-91.3	-3.4	178	-71.8	-63.3	0	0	0	114.2	I422 M423 I424 T428	I422-F426 HydrophobicContact CG2-CD2 3.84Å; I422-F426 HydrophobicContact CG2-CE2 3.97Å; I422-F426 VanDerWaalsContact O-CD2 3.28Å; I422-F426 WeakPolarHBondContact O-CD2 3.18Å; I422-F426 PolarHBondContact O-N 3.02Å; I422-F426 VanDerWaalsContact O-N 3.08Å; M423-F426 PolarHBondContact O-N 3.4Å; I424-F426 PolarHBondContact O-N 3.48Å; F426-T428 PolarHBondContact O-N 3.45Å
427	S	84.7	Confident	80.6	Confident	9 Å²	9	62.6 Å²	62.6	6%	0.063	34%	0.343	C	S	.	.			trans	-77.5	116.6	176.8	176	0	0	0	0	111	M423 I424 D429 N453 M455	M423-S427 WeakPolarHBondContact O-CB 3.48Å; M423-S427 PolarHBondContact O-N 3.27Å; M423-S427 VanDerWaalsContact O-N 3.1Å; I424-S427 PolarHBondContact O-N 2.94Å; S427-D429 VanDerWaalsContact C-N 3.32Å; S427-N453 VanDerWaalsContact CB-OD1 3.31Å; S427-N453 WeakPolarHBondContact CB-OD1 3.32Å; S427-N453 PolarHBondContact O-ND2 3.12Å; S427-N453 PolarHBondContact OG-OD1 3.18Å; S427-M455 WeakPolarHBondContact OG-CB 3.43Å
428	T	80.4	Confident	78.7	Confident	122 Å²	122	68 Å²	68	75%	0.748	38%	0.376	S	S	*	.			trans	-87.2	0.5	173.4	51.2	0	0	0	0	113.6	F426 C430	F426-T428 PolarHBondContact O-N 3.45Å; T428-C430 PolarHBondContact O-N 3Å
429	D	82.3	Confident	77.2	Confident	28 Å²	28	67.5 Å²	67.5	15%	0.15	37%	0.371	C	S	.	.			trans	-88.7	94.2	-168.1	-69.8	1.4	0	0	0	110.9	S427 S454 N479 T482	S427-D429 VanDerWaalsContact C-N 3.32Å; D429-S454 PolarHBondContact O-N 2.7Å; D429-N479 PolarHBondContact OD1-ND2 3.44Å; D429-N479 WeakPolarHBondContact OD2-CB 3.29Å; D429-N479 PolarHBondContact OD2-ND2 3.38Å; D429-T482 HydrophobicContact CB-CG2 4.16Å; D429-T482 WeakPolarHBondContact OD2-CB 3.45Å; D429-T482 WeakPolarHBondContact OD2-CG2 3.42Å; D429-T482 PolarHBondContact OD2-OG1 3.09Å
430	C	83.6	Confident	75.6	Confident	36 Å²	36	70.5 Å²	70.5	24%	0.243	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	142.1	177	-57.7	0	0	0	0	111.2	T428 C447 E451 Y452	T428-C430 PolarHBondContact O-N 3Å; C430-C447 HydrophobicContact CB-CB 3.66Å; C430-C447 WeakPolarHBondContact CB-SG 3.37Å; C430-C447 WeakPolarHBondContact SG-CA 3.33Å; C430-C447 WeakPolarHBondContact SG-CB 3.35Å; C430-C447 CovalentContact SG-SG 2.03Å; C430-C447 PolarHBondContact SG-SG 2.94Å; C430-E451 HydrophobicContact CB-CB 4.21Å; C430-E451 WeakPolarHBondContact CB-OE2 3.28Å; C430-Y452 CarbonylContact C-O 3.59Å; C430-Y452 WeakPolarHBondContact CA-O 3.14Å
431	Q	80.4	Confident	74.5	Confident	56 Å²	56	72.9 Å²	72.9	26%	0.262	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	145.1	175.9	-71.9	-73.7	-31.8	0	0	109.7	E451 Y452 S454	Q431-E451 CarbonylContact O-C 3.2Å; Q431-E451 WeakPolarHBondContact O-CA 3.21Å; Q431-E451 WeakPolarHBondContact O-CB 3.36Å; Q431-Y452 HydrophobicContact CB-CD1 4.29Å; Q431-Y452 HydrophobicContact CB-CE1 3.72Å; Q431-Y452 HydrophobicContact CB-CE2 4.36Å; Q431-Y452 PolarHBondContact N-O 2.86Å; Q431-Y452 WeakPolarHBondContact O-CD1 3.26Å; Q431-Y452 PolarHBondContact O-N 3.29Å; Q431-S454 WeakPolarHBondContact CG-OG 3.15Å
432	P	80.4	Confident	73.8	Confident	85 Å²	85	73.5 Å²	73.5	55%	0.552	40%	0.397	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-69.1	143.3	177.6	29.2	-35	0	0	0	111.5	G434 Y452	P432-G434 PolarHBondContact O-N 2.76Å; P432-G434 VanDerWaalsContact O-N 3.16Å; P432-Y452 WeakPolarHBondContact O-CE1 3.31Å
433	L	70.6	Confident	73.3	Confident	72 Å²	72	69.6 Å²	69.6	38%	0.377	38%	0.376	S	S	.	.	P	Polyproline II helix	trans	-61.1	116.6	168.3	-119.7	72.5	0	0	0	109.4	P442 G450 Y452	L433-P442 HydrophobicContact CD1-CB 3.76Å; L433-P442 HydrophobicContact CD1-CG 4.23Å; L433-G450 PolarHBondContact N-O 3.06Å; L433-Y452 HydrophobicContact CD1-CD1 3.67Å; L433-Y452 HydrophobicContact CD1-CG 4.21Å
434	G	64.1	Low	72.9	Confident	38 Å²	38	71.8 Å²	71.8	39%	0.392	39%	0.386	S	S	.	.	P	Polyproline II helix	trans	-66.8	151.3	171.7	0	0	0	0	0	111.8	P432 D436 H437	P432-G434 PolarHBondContact O-N 2.76Å; P432-G434 VanDerWaalsContact O-N 3.16Å; G434-D436 PolarHBondContact O-N 2.89Å; G434-D436 VanDerWaalsContact O-N 3.15Å; G434-H437 PolarHBondContact O-N 3.07Å
435	P	51.6	Low	72.5	Confident	120 Å²	120	71.8 Å²	71.8	78%	0.779	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63	-23.2	-174.1	26	-35.4	0	0	0	114	H437	P435-H437 VanDerWaalsContact C-N 3.32Å; P435-H437 PolarHBondContact O-N 2.98Å
436	D	51.6	Low	72.2	Confident	138 Å²	138	72.9 Å²	72.9	74%	0.738	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.7	3.1	-177.2	-64.1	-50.9	0	0	0	114.6	G434 T438	G434-D436 PolarHBondContact O-N 2.89Å; G434-D436 VanDerWaalsContact O-N 3.15Å; D436-T438 VanDerWaalsContact C-N 3.27Å; D436-T438 HydrophobicContact CB-CG2 4.02Å; D436-T438 PolarHBondContact O-N 2.64Å; D436-T438 VanDerWaalsContact O-N 3.14Å
437	H	50.8	Low	72	Confident	144 Å²	144	66.3 Å²	66.3	67%	0.667	37%	0.366	S	S	*	.			trans	48.6	41.5	176.5	-71.4	-75	0	0	0	114.5	G434 P435 E439	G434-H437 PolarHBondContact O-N 3.07Å; P435-H437 VanDerWaalsContact C-N 3.32Å; P435-H437 PolarHBondContact O-N 2.98Å; H437-E439 PolarHBondContact O-N 3.2Å; H437-E439 VanDerWaalsContact O-N 3.09Å
438	T	55	Low	71.9	Confident	114 Å²	114	68.6 Å²	68.6	70%	0.699	39%	0.385	S	S	*	.			trans	-66	-14	-169.9	53.7	0	0	0	0	115.8	D436	D436-T438 VanDerWaalsContact C-N 3.27Å; D436-T438 HydrophobicContact CB-CG2 4.02Å; D436-T438 PolarHBondContact O-N 2.64Å; D436-T438 VanDerWaalsContact O-N 3.14Å
439	E	61.3	Low	71.9	Confident	31 Å²	31	70 Å²	70	15%	0.145	39%	0.388	C	S	.	.			trans	-112.4	126.5	-179.8	-65.3	-66.5	168.4	0	0	109.7	H437 P442 T457 N461 S469	H437-E439 PolarHBondContact O-N 3.2Å; H437-E439 VanDerWaalsContact O-N 3.09Å; E439-P442 WeakPolarHBondContact O-CD 3.46Å; E439-T457 HydrophobicContact CG-CG2 3.95Å; E439-T457 WeakPolarHBondContact OE1-CG2 3.44Å; E439-T457 WeakPolarHBondContact OE2-CG2 3.48Å; E439-N461 PolarHBondContact OE2-ND2 3.39Å; E439-S469 PolarHBondContact OE1-OG 2.85Å
440	E	60.3	Low	71.6	Confident	102 Å²	102	70.9 Å²	70.9	48%	0.477	40%	0.404	S	S	.	.	S	Bend	trans	-73.9	-33.5	-177.8	-79.6	178.1	-160	0	0	113.4	P442 R465	E440-P442 WeakPolarHBondContact O-CD 3.33Å; E440-R465 IonicContact OE1-CZ 3.63Å; E440-R465 VanDerWaalsContact OE1-CZ 3.29Å; E440-R465 IonicContact OE1-NH1 2.72Å; E440-R465 PolarHBondContact OE1-NH1 2.93Å; E440-R465 VanDerWaalsContact OE1-NH1 3.1Å; E440-R465 IonicContact OE1-NH2 2.76Å; E440-R465 PolarHBondContact OE1-NH2 3.08Å; E440-R465 IonicContact OE2-CZ 2.67Å; E440-R465 IonicContact OE2-NH1 2.7Å; E440-R465 PolarHBondContact OE2-NH1 2.85Å; E440-R465 IonicContact OE2-NH2 3.6Å
441	Y	69.1	Low	71.6	Confident	52 Å²	52	72.3 Å²	72.3	20%	0.204	41%	0.408	C	S	.	.	S	Bend	trans	-121.2	51.9	-173.2	-53.5	-79.9	0	0	0	113.1	L443	Y441-L443 PolarHBondContact O-N 3.23Å
442	P	78.3	Confident	71.7	Confident	27 Å²	27	71 Å²	71	18%	0.175	40%	0.4	C	S	.	.			trans	-61.4	131	177.7	26.3	-33.7	0	0	0	109.2	K152 L433 E439 E440	K152-P442 VanDerWaalsContact CE-O 3.24Å; K152-P442 WeakPolarHBondContact CE-O 3.22Å; K152-P442 PolarHBondContact NZ-O 3.46Å; L433-P442 HydrophobicContact CD1-CB 3.76Å; L433-P442 HydrophobicContact CD1-CG 4.23Å; E439-P442 WeakPolarHBondContact O-CD 3.46Å; E440-P442 WeakPolarHBondContact O-CD 3.33Å
443	L	80.1	Confident	71.9	Confident	2 Å²	2	67 Å²	67	1%	0.01	37%	0.374	C	S	.	.			trans	-114	107.3	-177.8	-169	70.8	0	0	0	108.9	K152 I155 I424 Y441 L445 N453 A456 F460	K152-L443 HydrophobicContact CG-CD1 4.2Å; I155-L443 HydrophobicContact CB-CD1 4.21Å; I155-L443 HydrophobicContact CD1-CD1 4.34Å; I155-L443 HydrophobicContact CD1-CD2 4.12Å; I155-L443 HydrophobicContact CG2-CD1 3.93Å; I155-L443 HydrophobicContact CG2-CD2 4.49Å; I424-L443 HydrophobicContact CG2-CD2 4.24Å; Y441-L443 PolarHBondContact O-N 3.23Å; L443-L445 PolarHBondContact O-N 3.1Å; L443-N453 PolarHBondContact O-N 3.17Å; L443-N453 VanDerWaalsContact O-N 3.09Å; L443-A456 HydrophobicContact CB-CB 3.74Å; L443-A456 HydrophobicContact CD2-CB 3.88Å; L443-A456 HydrophobicContact CG-CB 4.4Å; L443-F460 HydrophobicContact CD2-CD2 4.36Å; L443-F460 HydrophobicContact CD2-CE2 4.13Å; L443-F460 HydrophobicContact CD2-CZ 4.44Å
444	Q	81.4	Confident	72.4	Confident	75 Å²	75	63.8 Å²	63.8	35%	0.35	36%	0.358	S	S	.	.			trans	-80.8	109.6	168.1	-172.4	-176.9	-13.8	0	0	107.5	C447 A448 D449 E451	Q444-C447 HydrophobicContact CG-CB 4.34Å; Q444-C447 PolarHBondContact NE2-O 3.43Å; Q444-A448 PolarHBondContact NE2-O 2.92Å; Q444-D449 PolarHBondContact NE2-OD1 3.26Å; Q444-E451 WeakPolarHBondContact CB-O 3.4Å; Q444-E451 WeakPolarHBondContact CG-O 3.48Å
445	L	81.1	Confident	73.3	Confident	3 Å²	3	62.4 Å²	62.4	2%	0.016	34%	0.341	C	S	.	.	S	Bend	trans	-139.5	115.2	173.5	-175.8	75.8	0	0	0	107.5	I155 T159 L164 I424 L443 C447	I155-L445 HydrophobicContact CG2-CD1 4.11Å; T159-L445 HydrophobicContact CG2-CD1 4.17Å; T159-L445 WeakPolarHBondContact OG1-CD1 3.25Å; L164-L445 HydrophobicContact CD1-CD1 4.17Å; L164-L445 HydrophobicContact CD2-CD1 4.04Å; I424-L445 HydrophobicContact CG2-CD2 3.88Å; L443-L445 PolarHBondContact O-N 3.1Å; L445-C447 PolarHBondContact O-N 3.14Å; L445-C447 VanDerWaalsContact O-N 3.13Å
446	F	82.2	Confident	74.7	Confident	124 Å²	124	56.8 Å²	56.8	54%	0.544	31%	0.305	S	S	.	.	S	Bend	trans	56.3	17.6	-174.2	-49.8	-57.3	0	0	0	115.9	L164 Y425	L164-F446 HydrophobicContact CD1-CE2 4.35Å; L164-F446 HydrophobicContact CD1-CZ 3.74Å; Y425-F446 AromaticContact CD2-CE2 3.76Å; Y425-F446 HydrophobicContact CD2-CE2 3.76Å; Y425-F446 HydrophobicContact CD2-CZ 4.32Å; Y425-F446 AromaticContact CE2-CE2 3.64Å; Y425-F446 HydrophobicContact CE2-CE2 3.64Å; Y425-F446 AromaticContact CE2-CZ 3.79Å; Y425-F446 HydrophobicContact CE2-CZ 3.79Å; Y425-F446 HydrophobicContact CG-CE2 4.4Å
447	C	83.4	Confident	76.1	Confident	14 Å²	14	50.5 Å²	50.5	10%	0.095	27%	0.272	C	S	.	.	S	Bend	trans	-103.6	160.7	173	-60.9	0	0	0	0	111.7	C430 Q444 L445 E451	C430-C447 HydrophobicContact CB-CB 3.66Å; C430-C447 WeakPolarHBondContact CB-SG 3.37Å; C430-C447 WeakPolarHBondContact SG-CA 3.33Å; C430-C447 WeakPolarHBondContact SG-CB 3.35Å; C430-C447 CovalentContact SG-SG 2.03Å; C430-C447 PolarHBondContact SG-SG 2.94Å; Q444-C447 HydrophobicContact CG-CB 4.34Å; Q444-C447 PolarHBondContact NE2-O 3.43Å; L445-C447 PolarHBondContact O-N 3.14Å; L445-C447 VanDerWaalsContact O-N 3.13Å; C447-E451 HydrophobicContact CB-CB 3.78Å
448	A	82.4	Confident	77.6	Confident	57 Å²	57	44.6 Å²	44.6	47%	0.471	25%	0.247	S	C	.	.	P	Polyproline II helix	trans	-69.3	164.5	178.4	0	0	0	0	0	112.3	Q444 G450 E451	Q444-A448 PolarHBondContact NE2-O 2.92Å; A448-G450 PolarHBondContact O-N 2.79Å; A448-E451 HydrophobicContact CB-CG 4.33Å; A448-E451 WeakPolarHBondContact CB-OE2 3.29Å; A448-E451 PolarHBondContact N-OE2 3.27Å; A448-E451 WeakPolarHBondContact O-CB 3.41Å; A448-E451 PolarHBondContact O-N 3.27Å
449	D	79	Confident	79.1	Confident	151 Å²	151	40.1 Å²	40.1	81%	0.807	22%	0.219	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.8	119.4	-178.9	-65.7	-37.1	0	0	0	111.3	Q444	Q444-D449 PolarHBondContact NE2-OD1 3.26Å
450	G	77.5	Confident	80.1	Confident	47 Å²	47	38.8 Å²	38.8	49%	0.485	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	98	-1.3	-171.4	0	0	0	0	0	114.7	L433 A448	L433-G450 PolarHBondContact N-O 3.06Å; A448-G450 PolarHBondContact O-N 2.79Å
451	E	83.7	Confident	81.2	Confident	67 Å²	67	34.5 Å²	34.5	31%	0.313	19%	0.192	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	155.9	174.4	-63	178.7	158.4	0	0	112.7	C430 Q431 Q444 C447 A448	C430-E451 HydrophobicContact CB-CB 4.21Å; C430-E451 WeakPolarHBondContact CB-OE2 3.28Å; Q431-E451 CarbonylContact O-C 3.2Å; Q431-E451 WeakPolarHBondContact O-CA 3.21Å; Q431-E451 WeakPolarHBondContact O-CB 3.36Å; Q444-E451 WeakPolarHBondContact CB-O 3.4Å; Q444-E451 WeakPolarHBondContact CG-O 3.48Å; C447-E451 HydrophobicContact CB-CB 3.78Å; A448-E451 HydrophobicContact CB-CG 4.33Å; A448-E451 WeakPolarHBondContact CB-OE2 3.29Å; A448-E451 PolarHBondContact N-OE2 3.27Å; A448-E451 WeakPolarHBondContact O-CB 3.41Å; A448-E451 PolarHBondContact O-N 3.27Å
452	Y	82.6	Confident	82	Confident	28 Å²	28	33.3 Å²	33.3	11%	0.11	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	154	173.5	71	-81.6	0	0	0	111.1	C430 Q431 P432 L433 T457	C430-Y452 CarbonylContact C-O 3.59Å; C430-Y452 WeakPolarHBondContact CA-O 3.14Å; Q431-Y452 HydrophobicContact CB-CD1 4.29Å; Q431-Y452 HydrophobicContact CB-CE1 3.72Å; Q431-Y452 HydrophobicContact CB-CE2 4.36Å; Q431-Y452 PolarHBondContact N-O 2.86Å; Q431-Y452 WeakPolarHBondContact O-CD1 3.26Å; Q431-Y452 PolarHBondContact O-N 3.29Å; P432-Y452 WeakPolarHBondContact O-CE1 3.31Å; L433-Y452 HydrophobicContact CD1-CD1 3.67Å; L433-Y452 HydrophobicContact CD1-CG 4.21Å; Y452-T457 VanDerWaalsContact CD2-OG1 3.25Å; Y452-T457 WeakPolarHBondContact CD2-OG1 3.46Å; Y452-T457 VanDerWaalsContact CE2-OG1 3.23Å; Y452-T457 WeakPolarHBondContact CE2-OG1 3.29Å
453	N	83.8	Confident	82.4	Confident	1 Å²	1	33 Å²	33	1%	0.005	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83	117.8	179.1	-167.1	-52.4	0	0	0	110.8	I424 S427 L443 M455 A456 T457	I424-N453 PolarHBondContact O-ND2 3.22Å; S427-N453 VanDerWaalsContact CB-OD1 3.31Å; S427-N453 WeakPolarHBondContact CB-OD1 3.32Å; S427-N453 PolarHBondContact O-ND2 3.12Å; S427-N453 PolarHBondContact OG-OD1 3.18Å; L443-N453 PolarHBondContact O-N 3.17Å; L443-N453 VanDerWaalsContact O-N 3.09Å; N453-M455 PolarHBondContact O-N 3.39Å; N453-M455 VanDerWaalsContact O-N 3.16Å; N453-M455 WeakPolarHBondContact OD1-CB 3.39Å; N453-M455 PolarHBondContact OD1-N 3.4Å; N453-M455 VanDerWaalsContact OD1-N 3.16Å; N453-A456 HydrophobicContact CB-CB 4.23Å; N453-A456 WeakPolarHBondContact O-CB 3.2Å; N453-A456 PolarHBondContact O-N 3.11Å; N453-T457 PolarHBondContact O-N 2.81Å
454	S	80.7	Confident	82.8	Confident	5 Å²	5	33.6 Å²	33.6	4%	0.035	19%	0.191	C	C	.	.	H	α-helix	trans	-60.3	-29	-175.9	-62.3	0	0	0	0	113.7	D429 Q431 T457 A458	D429-S454 PolarHBondContact O-N 2.7Å; Q431-S454 WeakPolarHBondContact CG-OG 3.15Å; S454-T457 PolarHBondContact O-N 3.43Å; S454-A458 PolarHBondContact O-N 3.24Å
455	M	83.2	Confident	83	Confident	8 Å²	8	33.7 Å²	33.7	4%	0.039	19%	0.189	C	C	.	.	H	α-helix	trans	-75.4	-25.6	177.7	-172.8	160.3	-82.7	0	0	112.4	M423 I424 S427 N453 A458 F459 T482	M423-M455 HydrophobicContact CB-CG 4.42Å; M423-M455 HydrophobicContact CB-SD 3.63Å; M423-M455 HydrophobicContact CE-CE 3.52Å; M423-M455 HydrophobicContact CE-SD 3.63Å; M423-M455 HydrophobicContact SD-SD 4.49Å; I424-M455 HydrophobicContact CG1-CG 4.36Å; S427-M455 WeakPolarHBondContact OG-CB 3.43Å; N453-M455 PolarHBondContact O-N 3.39Å; N453-M455 VanDerWaalsContact O-N 3.16Å; N453-M455 WeakPolarHBondContact OD1-CB 3.39Å; N453-M455 PolarHBondContact OD1-N 3.4Å; N453-M455 VanDerWaalsContact OD1-N 3.16Å; M455-A458 PolarHBondContact O-N 2.87Å; M455-F459 HydrophobicContact CG-CD2 4.19Å; M455-F459 HydrophobicContact CG-CE2 4.32Å; M455-T482 HydrophobicContact CE-CG2 3.61Å; M455-T482 VanDerWaalsContact CE-O 3.26Å; M455-T482 WeakPolarHBondContact CE-O 3.37Å
456	A	82.3	Confident	83.4	Confident	2 Å²	2	33.8 Å²	33.8	2%	0.017	19%	0.19	C	C	.	.	H	α-helix	trans	-66.7	-44.4	170.8	0	0	0	0	0	110.7	I424 L443 N453 A458 F459 F460	I424-A456 HydrophobicContact CD1-CB 4.19Å; I424-A456 HydrophobicContact CG1-CB 4.24Å; I424-A456 HydrophobicContact CG2-CB 4.1Å; L443-A456 HydrophobicContact CB-CB 3.74Å; L443-A456 HydrophobicContact CD2-CB 3.88Å; L443-A456 HydrophobicContact CG-CB 4.4Å; N453-A456 HydrophobicContact CB-CB 4.23Å; N453-A456 WeakPolarHBondContact O-CB 3.2Å; N453-A456 PolarHBondContact O-N 3.11Å; A456-A458 PolarHBondContact O-N 3.36Å; A456-A458 VanDerWaalsContact O-N 3.13Å; A456-F459 PolarHBondContact O-N 3.48Å; A456-F460 WeakPolarHBondContact O-CB 3.45Å; A456-F460 PolarHBondContact O-N 3.43Å
457	T	79.9	Confident	83.8	Confident	7 Å²	7	27.9 Å²	27.9	4%	0.043	16%	0.164	C	C	.	.	H	α-helix	trans	-57.2	-29.2	177.5	-54	0	0	0	0	113.3	E439 Y452 N453 S454 N461	E439-T457 HydrophobicContact CG-CG2 3.95Å; E439-T457 WeakPolarHBondContact OE1-CG2 3.44Å; E439-T457 WeakPolarHBondContact OE2-CG2 3.48Å; Y452-T457 VanDerWaalsContact CD2-OG1 3.25Å; Y452-T457 WeakPolarHBondContact CD2-OG1 3.46Å; Y452-T457 VanDerWaalsContact CE2-OG1 3.23Å; Y452-T457 WeakPolarHBondContact CE2-OG1 3.29Å; N453-T457 PolarHBondContact O-N 2.81Å; S454-T457 PolarHBondContact O-N 3.43Å; T457-N461 PolarHBondContact O-ND2 3.01Å
458	A	82.9	Confident	84.1	Confident	19 Å²	19	32.9 Å²	32.9	16%	0.157	18%	0.181	C	C	.	.	H	α-helix	trans	-74.2	-33.9	175.3	0	0	0	0	0	114	S454 M455 A456 S466 F486	S454-A458 PolarHBondContact O-N 3.24Å; M455-A458 PolarHBondContact O-N 2.87Å; A456-A458 PolarHBondContact O-N 3.36Å; A456-A458 VanDerWaalsContact O-N 3.13Å; A458-S466 PolarHBondContact O-OG 3.37Å; A458-F486 HydrophobicContact CB-CD2 3.8Å; A458-F486 HydrophobicContact CB-CE2 3.72Å; A458-F486 HydrophobicContact CB-CG 4.3Å; A458-F486 HydrophobicContact CB-CZ 4.15Å
459	F	85.8	Confident	84.4	Confident	21 Å²	21	30.7 Å²	30.7	9%	0.092	16%	0.162	C	C	.	.	H	α-helix	trans	-106.3	-23.8	-172.8	-81.2	-66.1	0	0	0	115.7	A420 M423 I424 M455 A456 F486 Y490	A420-F459 HydrophobicContact CB-CB 4.1Å; A420-F459 HydrophobicContact CB-CD1 3.61Å; A420-F459 HydrophobicContact CB-CD2 4.24Å; A420-F459 HydrophobicContact CB-CE1 3.99Å; A420-F459 HydrophobicContact CB-CG 3.76Å; A420-F459 HydrophobicContact CB-CZ 4.45Å; M423-F459 HydrophobicContact CB-CE2 3.94Å; M423-F459 HydrophobicContact CG-CE2 4.34Å; I424-F459 HydrophobicContact CD1-CB 4.18Å; M455-F459 HydrophobicContact CG-CD2 4.19Å; M455-F459 HydrophobicContact CG-CE2 4.32Å; A456-F459 PolarHBondContact O-N 3.48Å; F459-F486 HydrophobicContact CD1-CE2 4.12Å; F459-F486 HydrophobicContact CD2-CD2 4.14Å; F459-F486 HydrophobicContact CD2-CE2 4.36Å; F459-F486 HydrophobicContact CE1-CD2 4.14Å; F459-F486 AromaticContact CE1-CE2 3.93Å; F459-F486 HydrophobicContact CE1-CE2 3.93Å; F459-F486 AromaticContact CE2-CD2 3.68Å; F459-F486 HydrophobicContact CE2-CD2 3.68Å; F459-F486 HydrophobicContact CE2-CE2 4.19Å; F459-F486 HydrophobicContact CG-CE2 4.33Å; F459-F486 AromaticContact CZ-CD2 3.68Å; F459-F486 HydrophobicContact CZ-CD2 3.68Å; F459-F486 AromaticContact CZ-CE2 3.96Å; F459-F486 HydrophobicContact CZ-CE2 3.96Å; F459-Y490 HydrophobicContact CE1-CD2 4.41Å
460	F	83.5	Confident	84.9	Confident	3 Å²	3	23.7 Å²	23.7	1%	0.013	12%	0.124	C	C	.	.	S	Bend	trans	-91.8	-8.5	179.9	-98.2	-101.3	0	0	0	114	Y148 I151 I155 W171 I424 L443 A456	Y148-F460 AromaticContact CD1-CD1 3.69Å; Y148-F460 HydrophobicContact CD1-CD1 3.69Å; Y148-F460 HydrophobicContact CD1-CE1 4.07Å; Y148-F460 HydrophobicContact CD1-CG 4.42Å; Y148-F460 HydrophobicContact CE1-CD1 4.39Å; Y148-F460 HydrophobicContact CG-CD1 4.41Å; I151-F460 HydrophobicContact CB-CE1 4.11Å; I151-F460 HydrophobicContact CB-CZ 4.49Å; I151-F460 HydrophobicContact CG2-CE1 3.68Å; I151-F460 HydrophobicContact CG2-CZ 3.58Å; I155-F460 HydrophobicContact CD1-CE1 4.39Å; I155-F460 HydrophobicContact CD1-CE2 4.32Å; I155-F460 HydrophobicContact CD1-CZ 3.63Å; W171-F460 HydrophobicContact CE3-CE2 4.21Å; W171-F460 HydrophobicContact CE3-CZ 4.22Å; W171-F460 AromaticContact CH2-CD2 3.95Å; W171-F460 HydrophobicContact CH2-CD2 3.95Å; W171-F460 AromaticContact CH2-CE2 3.38Å; W171-F460 HydrophobicContact CH2-CE2 3.38Å; W171-F460 HydrophobicContact CH2-CZ 4.04Å; W171-F460 HydrophobicContact CZ2-CD2 4.44Å; W171-F460 HydrophobicContact CZ2-CE2 4Å; W171-F460 HydrophobicContact CZ2-CZ 4.35Å; W171-F460 HydrophobicContact CZ3-CD2 4.47Å; W171-F460 AromaticContact CZ3-CE2 3.51Å; W171-F460 HydrophobicContact CZ3-CE2 3.51Å; W171-F460 AromaticContact CZ3-CZ 3.98Å; W171-F460 HydrophobicContact CZ3-CZ 3.98Å; I424-F460 HydrophobicContact CD1-CD2 3.68Å; I424-F460 HydrophobicContact CD1-CE2 3.72Å; L443-F460 HydrophobicContact CD2-CD2 4.36Å; L443-F460 HydrophobicContact CD2-CE2 4.13Å; L443-F460 HydrophobicContact CD2-CZ 4.44Å; A456-F460 WeakPolarHBondContact O-CB 3.45Å; A456-F460 PolarHBondContact O-N 3.43Å
461	N	83.4	Confident	85.5	Confident	11 Å²	11	21.5 Å²	21.5	6%	0.059	10%	0.101	C	C	.	.	S	Bend	trans	-88.2	168.5	172.6	-86.8	-44.5	0	0	0	112.1	E439 T457 R465	E439-N461 PolarHBondContact OE2-ND2 3.39Å; T457-N461 PolarHBondContact O-ND2 3.01Å; N461-R465 HydrophobicContact CB-CB 4.48Å
462	T	85.1	Confident	85.7	Confident	28 Å²	28	21.5 Å²	21.5	17%	0.172	10%	0.101	C	C	.	.			trans	-74.6	144.6	167.2	83	0	0	0	0	109.7	E464 R465 S466	T462-E464 WeakPolarHBondContact CB-OE2 3.4Å; T462-E464 PolarHBondContact O-N 3.47Å; T462-E464 VanDerWaalsContact O-N 3.11Å; T462-E464 PolarHBondContact OG1-OE2 3.02Å; T462-R465 PolarHBondContact O-N 3.24Å; T462-S466 PolarHBondContact O-N 3.03Å; T462-S466 PolarHBondContact O-OG 3.39Å
463	P	86.9	Confident	85.8	Confident	21 Å²	21	21.5 Å²	21.5	14%	0.136	10%	0.103	C	C	.	.	H	α-helix	trans	-56.8	-30.9	-175.1	-29.3	37.7	0	0	0	114.7	S466 V467 I508 L512	P463-S466 PolarHBondContact O-N 2.92Å; P463-V467 WeakPolarHBondContact O-CG2 3.49Å; P463-V467 PolarHBondContact O-N 3.02Å; P463-I508 HydrophobicContact CB-CG2 3.64Å; P463-L512 HydrophobicContact CB-CD2 3.99Å
464	E	87.1	Confident	85.6	Confident	13 Å²	13	25.6 Å²	25.6	6%	0.061	13%	0.13	C	C	.	.	H	α-helix	trans	-65.8	-40.3	176.6	-47.9	85.2	168.1	0	0	111.6	K238 I350 T462 R468 I508	K238-E464 WeakPolarHBondContact CE-OE1 3.47Å; K238-E464 IonicContact NZ-OE1 3.51Å; I350-E464 HydrophobicContact CB-CG 4.48Å; I350-E464 HydrophobicContact CD1-CB 3.91Å; I350-E464 HydrophobicContact CD1-CG 4.23Å; I350-E464 HydrophobicContact CG1-CB 4.11Å; T462-E464 WeakPolarHBondContact CB-OE2 3.4Å; T462-E464 PolarHBondContact O-N 3.47Å; T462-E464 VanDerWaalsContact O-N 3.11Å; T462-E464 PolarHBondContact OG1-OE2 3.02Å; E464-R468 PolarHBondContact O-N 2.96Å; E464-I508 HydrophobicContact CG-CG1 4.45Å; E464-I508 HydrophobicContact CG-CG2 4.29Å
465	R	85.5	Confident	85.3	Confident	78 Å²	78	30.1 Å²	30.1	29%	0.294	16%	0.157	S	C	.	.	H	α-helix	trans	-71	-40.3	175.1	-68.9	176.7	172.8	-168.9	-4.9	111.2	E440 N461 T462 V467 R468 S469	E440-R465 IonicContact OE1-CZ 3.63Å; E440-R465 VanDerWaalsContact OE1-CZ 3.29Å; E440-R465 IonicContact OE1-NH1 2.72Å; E440-R465 PolarHBondContact OE1-NH1 2.93Å; E440-R465 VanDerWaalsContact OE1-NH1 3.1Å; E440-R465 IonicContact OE1-NH2 2.76Å; E440-R465 PolarHBondContact OE1-NH2 3.08Å; E440-R465 IonicContact OE2-CZ 2.67Å; E440-R465 IonicContact OE2-NH1 2.7Å; E440-R465 PolarHBondContact OE2-NH1 2.85Å; E440-R465 IonicContact OE2-NH2 3.6Å; N461-R465 HydrophobicContact CB-CB 4.48Å; T462-R465 PolarHBondContact O-N 3.24Å; R465-V467 VanDerWaalsContact C-N 3.32Å; R465-V467 PolarHBondContact O-N 3.32Å; R465-R468 PolarHBondContact O-N 3.46Å; R465-S469 WeakPolarHBondContact O-CB 3.23Å; R465-S469 PolarHBondContact O-N 2.86Å
466	S	89.4	Confident	84.9	Confident	5 Å²	5	32.7 Å²	32.7	4%	0.035	19%	0.186	C	C	.	.	H	α-helix	trans	-60.3	-39.4	174.1	-57.9	0	0	0	0	112.2	A458 T462 P463 L470	A458-S466 PolarHBondContact O-OG 3.37Å; T462-S466 PolarHBondContact O-N 3.03Å; T462-S466 PolarHBondContact O-OG 3.39Å; P463-S466 PolarHBondContact O-N 2.92Å; S466-L470 WeakPolarHBondContact O-CB 3.21Å; S466-L470 VanDerWaalsContact O-CG 3.32Å; S466-L470 WeakPolarHBondContact O-CG 3.38Å; S466-L470 PolarHBondContact O-N 3.3Å
467	V	91.6	Very high	84.7	Confident	0 Å²	0	33.3 Å²	33.3	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-60.2	-49.5	171.9	167.9	0	0	0	0	111.2	F352 P463 R465 S469 L470 F471 I508 L511 L512	F352-V467 HydrophobicContact CD1-CG1 4.23Å; F352-V467 HydrophobicContact CE1-CG1 4.17Å; P463-V467 WeakPolarHBondContact O-CG2 3.49Å; P463-V467 PolarHBondContact O-N 3.02Å; R465-V467 VanDerWaalsContact C-N 3.32Å; R465-V467 PolarHBondContact O-N 3.32Å; V467-S469 PolarHBondContact O-N 2.94Å; V467-L470 PolarHBondContact O-N 2.95Å; V467-F471 HydrophobicContact CG1-CD2 3.99Å; V467-F471 HydrophobicContact CG1-CE1 4.23Å; V467-F471 HydrophobicContact CG1-CE2 3.4Å; V467-F471 VanDerWaalsContact CG1-CE2 3.4Å; V467-F471 HydrophobicContact CG1-CZ 3.54Å; V467-F471 WeakPolarHBondContact O-CG 3.42Å; V467-F471 PolarHBondContact O-N 3.4Å; V467-F471 VanDerWaalsContact O-N 3.08Å; V467-I508 HydrophobicContact CG2-CG2 4.44Å; V467-L511 HydrophobicContact CG2-CB 4.25Å; V467-L512 HydrophobicContact CG2-CB 3.76Å; V467-L512 HydrophobicContact CG2-CD1 4.03Å; V467-L512 HydrophobicContact CG2-CG 4.43Å
468	R	89.7	Confident	84.7	Confident	119 Å²	119	34 Å²	34	45%	0.449	19%	0.192	S	C	.	.	H	α-helix	trans	-63.9	-39.3	179.5	-177.1	176.9	170.7	167.9	-6.3	112.9	E464 R465 F471 H472	E464-R468 PolarHBondContact O-N 2.96Å; R465-R468 PolarHBondContact O-N 3.46Å; R468-F471 PolarHBondContact O-N 2.95Å; R468-H472 PolarHBondContact O-CD2 3.36Å; R468-H472 PolarHBondContact O-N 2.88Å
469	S	87.9	Confident	84.9	Confident	10 Å²	10	36.5 Å²	36.5	7%	0.07	20%	0.202	C	C	.	.	H	α-helix	trans	-63.7	-41.3	176.1	-162.5	0	0	0	0	110.5	E439 R465 V467 F471 H472 N473 Y478	E439-S469 PolarHBondContact OE1-OG 2.85Å; R465-S469 WeakPolarHBondContact O-CB 3.23Å; R465-S469 PolarHBondContact O-N 2.86Å; V467-S469 PolarHBondContact O-N 2.94Å; S469-F471 VanDerWaalsContact C-N 3.32Å; S469-F471 PolarHBondContact O-N 3.46Å; S469-H472 PolarHBondContact O-N 3Å; S469-N473 WeakPolarHBondContact O-CB 3.24Å; S469-N473 PolarHBondContact O-N 3.4Å; S469-N473 PolarHBondContact O-ND2 3.48Å; S469-N473 PolarHBondContact O-OD1 3.32Å; S469-N473 PolarHBondContact OG-ND2 3.33Å; S469-N473 PolarHBondContact OG-OD1 3.46Å; S469-Y478 PolarHBondContact OG-OH 3.48Å
470	L	89.7	Confident	85	Confident	5 Å²	5	37.9 Å²	37.9	3%	0.026	22%	0.215	C	C	.	.	H	α-helix	trans	-67.3	-25.2	172.8	-72.6	168	0	0	0	114.4	S466 V467 Y478 L483 L512 A515 A516 R519	S466-L470 WeakPolarHBondContact O-CB 3.21Å; S466-L470 VanDerWaalsContact O-CG 3.32Å; S466-L470 WeakPolarHBondContact O-CG 3.38Å; S466-L470 PolarHBondContact O-N 3.3Å; V467-L470 PolarHBondContact O-N 2.95Å; L470-Y478 HydrophobicContact CD2-CD2 4.35Å; L470-Y478 HydrophobicContact CD2-CE2 3.98Å; L470-L483 HydrophobicContact CD2-CD1 3.81Å; L470-L512 HydrophobicContact CD1-CD1 3.58Å; L470-A515 HydrophobicContact CB-CB 4.12Å; L470-A515 HydrophobicContact CD1-CB 3.99Å; L470-A516 HydrophobicContact CD1-CB 4.18Å; L470-R519 WeakPolarHBondContact O-CD 3.48Å; L470-R519 PolarHBondContact O-NH1 3.14Å
471	F	90.3	Very high	85.3	Confident	1 Å²	1	43.1 Å²	43.1	0%	0.004	24%	0.242	C	C	.	.	H	α-helix	trans	-80.3	-40.1	175.2	-66.2	-18.8	0	0	0	113.3	F352 F355 V467 R468 S469 A515 G539 A542 L543 A546	F352-F471 HydrophobicContact CB-CD2 4.14Å; F352-F471 HydrophobicContact CB-CE2 4.13Å; F352-F471 HydrophobicContact CD1-CD2 4.33Å; F352-F471 AromaticContact CD1-CE2 3.66Å; F352-F471 HydrophobicContact CD1-CE2 3.66Å; F352-F471 HydrophobicContact CD2-CE2 4.49Å; F352-F471 HydrophobicContact CE1-CE2 4.11Å; F352-F471 HydrophobicContact CG-CD2 4.39Å; F352-F471 AromaticContact CG-CE2 3.88Å; F352-F471 HydrophobicContact CG-CE2 3.88Å; F355-F471 HydrophobicContact CE1-CB 4.13Å; F355-F471 HydrophobicContact CE1-CG 4.42Å; F355-F471 HydrophobicContact CZ-CB 3.9Å; F355-F471 AromaticContact CZ-CD2 3.72Å; F355-F471 HydrophobicContact CZ-CD2 3.72Å; F355-F471 HydrophobicContact CZ-CE2 4.46Å; F355-F471 HydrophobicContact CZ-CG 4.01Å; V467-F471 HydrophobicContact CG1-CD2 3.99Å; V467-F471 HydrophobicContact CG1-CE1 4.23Å; V467-F471 HydrophobicContact CG1-CE2 3.4Å; V467-F471 VanDerWaalsContact CG1-CE2 3.4Å; V467-F471 HydrophobicContact CG1-CZ 3.54Å; V467-F471 WeakPolarHBondContact O-CG 3.42Å; V467-F471 PolarHBondContact O-N 3.4Å; V467-F471 VanDerWaalsContact O-N 3.08Å; R468-F471 PolarHBondContact O-N 2.95Å; S469-F471 VanDerWaalsContact C-N 3.32Å; S469-F471 PolarHBondContact O-N 3.46Å; F471-A515 HydrophobicContact CD1-CB 4.31Å; F471-A515 HydrophobicContact CE1-CB 3.71Å; F471-A515 HydrophobicContact CZ-CB 4.49Å; F471-G539 VanDerWaalsContact O-CA 3.28Å; F471-G539 WeakPolarHBondContact O-CA 3.34Å; F471-A542 HydrophobicContact CD1-CB 3.79Å; F471-A542 HydrophobicContact CE1-CB 4.18Å; F471-L543 HydrophobicContact CE1-CB 4.38Å; F471-L543 HydrophobicContact CE2-CD1 4.37Å; F471-L543 HydrophobicContact CZ-CD1 4.18Å; F471-A546 HydrophobicContact CE1-CB 3.97Å; F471-A546 HydrophobicContact CZ-CB 3.85Å
472	H	87.4	Confident	85.6	Confident	67 Å²	67	43.1 Å²	43.1	31%	0.31	24%	0.242	S	C	.	.	H	α-helix	trans	-111.3	-12.4	-167.9	-67	-73.4	0	0	0	116.2	F352 R354 F355 R468 S469	F352-H472 PolarHBondContact O-CD2 2.83Å; F352-H472 VanDerWaalsContact O-CD2 3.29Å; F352-H472 PolarHBondContact O-NE2 2.83Å; R354-H472 PolarHBondContact O-CE1 2.98Å; R354-H472 VanDerWaalsContact O-CE1 3.26Å; F355-H472 AromaticContact CE1-CE1 3.91Å; F355-H472 AromaticContact CE1-NE2 3.98Å; F355-H472 AromaticContact CE2-CE1 3.93Å; F355-H472 AromaticContact CE2-NE2 3.62Å; F355-H472 AromaticContact CZ-CE1 3.8Å; F355-H472 AromaticContact CZ-NE2 3.45Å; F355-H472 WeakPolarHBondContact CZ-NE2 3.35Å; R468-H472 PolarHBondContact O-CD2 3.36Å; R468-H472 PolarHBondContact O-N 2.88Å; S469-H472 PolarHBondContact O-N 3Å
473	N	84.5	Confident	85.8	Confident	28 Å²	28	42 Å²	42	15%	0.15	24%	0.235	C	C	.	.	S	Bend	trans	-65.7	144.3	177.4	-72	1	0	0	0	111.1	S469 T477 Y478 R519	S469-N473 WeakPolarHBondContact O-CB 3.24Å; S469-N473 PolarHBondContact O-N 3.4Å; S469-N473 PolarHBondContact O-ND2 3.48Å; S469-N473 PolarHBondContact O-OD1 3.32Å; S469-N473 PolarHBondContact OG-ND2 3.33Å; S469-N473 PolarHBondContact OG-OD1 3.46Å; N473-T477 HydrophobicContact CB-CG2 4.34Å; N473-Y478 HydrophobicContact CB-CE2 4.12Å; N473-Y478 PolarHBondContact ND2-OH 2.95Å; N473-R519 PolarHBondContact O-NH1 2.95Å; N473-R519 PolarHBondContact O-NH2 3.01Å
474	P	80	Confident	86.1	Confident	86 Å²	86	42.1 Å²	42.1	56%	0.558	24%	0.24	S	C	*	.	P	Polyproline II helix	trans	-67.9	171.6	-175.5	27.3	-34.6	0	0	0	113.7	T477 R519	P474-T477 PolarHBondContact O-OG1 3.3Å; P474-T477 VanDerWaalsContact O-OG1 3.1Å; P474-R519 PolarHBondContact O-NH2 3.47Å
475	T	75.7	Confident	86.4	Confident	101 Å²	101	45.2 Å²	45.2	62%	0.62	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.3	139.8	172	42.7	0	0	0	0	111	T477 P538	T475-T477 PolarHBondContact O-N 3.35Å; T475-P538 HydrophobicContact CG2-CG 4.05Å
476	G	74.1	Confident	86.8	Confident	62 Å²	62	41.8 Å²	41.8	64%	0.639	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	88.2	-15.7	178.6	0	0	0	0	0	117.1	Y478	G476-Y478 VanDerWaalsContact C-N 3.25Å; G476-Y478 PolarHBondContact O-N 2.85Å
477	T	77.5	Confident	87	Confident	15 Å²	15	42.4 Å²	42.4	9%	0.092	25%	0.247	C	C	.	.	S	Bend	trans	-62.7	-26.8	-178.1	-47.8	0	0	0	0	114.5	N473 P474 T475	N473-T477 HydrophobicContact CB-CG2 4.34Å; P474-T477 PolarHBondContact O-OG1 3.3Å; P474-T477 VanDerWaalsContact O-OG1 3.1Å; T475-T477 PolarHBondContact O-N 3.35Å
478	Y	81	Confident	87.2	Confident	22 Å²	22	47.1 Å²	47.1	9%	0.086	27%	0.272	C	S	.	.	S	Bend	trans	-122.4	130.9	-179.3	-65.4	-80.9	0	0	0	110.6	S469 L470 N473 G476	S469-Y478 PolarHBondContact OG-OH 3.48Å; L470-Y478 HydrophobicContact CD2-CD2 4.35Å; L470-Y478 HydrophobicContact CD2-CE2 3.98Å; N473-Y478 HydrophobicContact CB-CE2 4.12Å; N473-Y478 PolarHBondContact ND2-OH 2.95Å; G476-Y478 VanDerWaalsContact C-N 3.25Å; G476-Y478 PolarHBondContact O-N 2.85Å
479	N	86.7	Confident	87.5	Confident	71 Å²	71	43.1 Å²	43.1	38%	0.38	26%	0.261	S	S	.	.			trans	-79	141.3	171.2	174.2	8.9	0	0	0	110.2	D429 L481 T482 L483	D429-N479 PolarHBondContact OD1-ND2 3.44Å; D429-N479 WeakPolarHBondContact OD2-CB 3.29Å; D429-N479 PolarHBondContact OD2-ND2 3.38Å; N479-L481 PolarHBondContact O-N 2.87Å; N479-L481 PolarHBondContact OD1-N 3.02Å; N479-T482 PolarHBondContact O-N 2.91Å; N479-T482 PolarHBondContact O-OG1 3.23Å; N479-L483 WeakPolarHBondContact O-CB 3.44Å; N479-L483 PolarHBondContact O-N 2.71Å; N479-L483 VanDerWaalsContact O-N 3.12Å
480	S	88.1	Confident	87.8	Confident	50 Å²	50	43.4 Å²	43.4	35%	0.35	26%	0.261	S	S	.	.	H	α-helix	trans	-56.5	-36.3	179.7	-54.3	0	0	0	0	113.2	G484 L520 I523	S480-G484 PolarHBondContact O-N 3.02Å; S480-L520 WeakPolarHBondContact O-CD1 3.1Å; S480-I523 WeakPolarHBondContact OG-CG2 3.19Å
481	L	89.8	Confident	88.2	Confident	113 Å²	113	43.9 Å²	43.9	59%	0.592	26%	0.262	S	S	*	.	H	α-helix	trans	-71.9	-50	-176.3	-175.1	147.9	0	0	0	111.9	N479 L483 G484 L485	N479-L481 PolarHBondContact O-N 2.87Å; N479-L481 PolarHBondContact OD1-N 3.02Å; L481-L483 PolarHBondContact O-N 3.22Å; L481-G484 PolarHBondContact O-N 3.41Å; L481-L485 HydrophobicContact CD2-CD1 3.69Å; L481-L485 HydrophobicContact CD2-CG 4.45Å; L481-L485 HydrophobicContact CG-CD1 4.49Å; L481-L485 WeakPolarHBondContact O-CG 3.47Å; L481-L485 PolarHBondContact O-N 3.03Å
482	T	88.5	Confident	88.5	Confident	10 Å²	10	48.6 Å²	48.6	6%	0.061	28%	0.283	C	S	.	.	H	α-helix	trans	-65.5	-39.3	179	37.2	0	0	0	0	111.8	D429 M455 N479 F486	D429-T482 HydrophobicContact CB-CG2 4.16Å; D429-T482 WeakPolarHBondContact OD2-CB 3.45Å; D429-T482 WeakPolarHBondContact OD2-CG2 3.42Å; D429-T482 PolarHBondContact OD2-OG1 3.09Å; M455-T482 HydrophobicContact CE-CG2 3.61Å; M455-T482 VanDerWaalsContact CE-O 3.26Å; M455-T482 WeakPolarHBondContact CE-O 3.37Å; N479-T482 PolarHBondContact O-N 2.91Å; N479-T482 PolarHBondContact O-OG1 3.23Å; T482-F486 WeakPolarHBondContact O-CB 3.42Å; T482-F486 PolarHBondContact O-N 3.01Å
483	L	90.8	Very high	88.9	Confident	6 Å²	6	45.9 Å²	45.9	3%	0.031	27%	0.271	C	S	.	.	H	α-helix	trans	-67.1	-38.2	175.4	-171.8	61.7	0	0	0	112.8	L470 N479 L481 T487 A516 R519 L520 I523	L470-L483 HydrophobicContact CD2-CD1 3.81Å; N479-L483 WeakPolarHBondContact O-CB 3.44Å; N479-L483 PolarHBondContact O-N 2.71Å; N479-L483 VanDerWaalsContact O-N 3.12Å; L481-L483 PolarHBondContact O-N 3.22Å; L483-T487 WeakPolarHBondContact O-CB 3.34Å; L483-T487 PolarHBondContact O-N 3.26Å; L483-T487 PolarHBondContact O-OG1 3.1Å; L483-A516 HydrophobicContact CD1-CB 3.9Å; L483-A516 WeakPolarHBondContact CD2-O 3.38Å; L483-R519 HydrophobicContact CD2-CB 4.1Å; L483-R519 HydrophobicContact CD2-CG 4.31Å; L483-L520 HydrophobicContact CD2-CB 4.17Å; L483-I523 HydrophobicContact CD2-CD1 4.12Å
484	G	92.8	Very high	89.4	Confident	22 Å²	22	44.7 Å²	44.7	23%	0.227	27%	0.265	C	S	.	.	H	α-helix	trans	-64.7	-45	174.5	0	0	0	0	0	113.1	S480 L481 T487 L488	S480-G484 PolarHBondContact O-N 3.02Å; L481-G484 PolarHBondContact O-N 3.41Å; G484-T487 WeakPolarHBondContact O-CB 3.36Å; G484-T487 PolarHBondContact O-N 3.46Å; G484-L488 PolarHBondContact O-N 3.42Å
485	L	92.9	Very high	90.2	Very high	78 Å²	78	41 Å²	41	41%	0.408	24%	0.241	S	C	.	.	H	α-helix	trans	-66.8	-38.9	176.1	-66.5	175.7	0	0	0	112.3	M423 L481 L488 T489	M423-L485 HydrophobicContact CE-CB 3.53Å; L481-L485 HydrophobicContact CD2-CD1 3.69Å; L481-L485 HydrophobicContact CD2-CG 4.45Å; L481-L485 HydrophobicContact CG-CD1 4.49Å; L481-L485 WeakPolarHBondContact O-CG 3.47Å; L481-L485 PolarHBondContact O-N 3.03Å; L485-L488 PolarHBondContact O-N 2.75Å; L485-T489 WeakPolarHBondContact O-CB 3.09Å; L485-T489 WeakPolarHBondContact O-CG2 3.48Å; L485-T489 PolarHBondContact O-N 3.06Å; L485-T489 PolarHBondContact O-OG1 2.88Å
486	F	93.4	Very high	91.1	Very high	6 Å²	6	40 Å²	40	3%	0.026	23%	0.226	C	C	.	.	H	α-helix	trans	-58.8	-49.8	171.8	173.4	-100.4	0	0	0	111.3	A458 F459 T482 L488 T489 Y490 L512 A516	A458-F486 HydrophobicContact CB-CD2 3.8Å; A458-F486 HydrophobicContact CB-CE2 3.72Å; A458-F486 HydrophobicContact CB-CG 4.3Å; A458-F486 HydrophobicContact CB-CZ 4.15Å; F459-F486 HydrophobicContact CD1-CE2 4.12Å; F459-F486 HydrophobicContact CD2-CD2 4.14Å; F459-F486 HydrophobicContact CD2-CE2 4.36Å; F459-F486 HydrophobicContact CE1-CD2 4.14Å; F459-F486 AromaticContact CE1-CE2 3.93Å; F459-F486 HydrophobicContact CE1-CE2 3.93Å; F459-F486 AromaticContact CE2-CD2 3.68Å; F459-F486 HydrophobicContact CE2-CD2 3.68Å; F459-F486 HydrophobicContact CE2-CE2 4.19Å; F459-F486 HydrophobicContact CG-CE2 4.33Å; F459-F486 AromaticContact CZ-CD2 3.68Å; F459-F486 HydrophobicContact CZ-CD2 3.68Å; F459-F486 AromaticContact CZ-CE2 3.96Å; F459-F486 HydrophobicContact CZ-CE2 3.96Å; T482-F486 WeakPolarHBondContact O-CB 3.42Å; T482-F486 PolarHBondContact O-N 3.01Å; F486-L488 PolarHBondContact O-N 3.49Å; F486-T489 PolarHBondContact O-N 2.93Å; F486-T489 PolarHBondContact O-OG1 2.74Å; F486-Y490 HydrophobicContact CE2-CD2 4.17Å; F486-Y490 HydrophobicContact CZ-CD2 4.13Å; F486-Y490 HydrophobicContact CZ-CG 4.25Å; F486-Y490 WeakPolarHBondContact O-CB 3.48Å; F486-Y490 PolarHBondContact O-N 2.73Å; F486-L512 HydrophobicContact CE1-CD1 4.17Å; F486-L512 HydrophobicContact CE1-CG 4.24Å; F486-L512 HydrophobicContact CZ-CD1 4.32Å; F486-L512 HydrophobicContact CZ-CD2 4.19Å; F486-L512 HydrophobicContact CZ-CG 4.2Å; F486-A516 HydrophobicContact CD1-CB 4.06Å; F486-A516 HydrophobicContact CE1-CB 4.2Å
487	T	95.1	Very high	92.2	Very high	18 Å²	18	37.1 Å²	37.1	11%	0.11	20%	0.196	C	C	.	.	H	α-helix	trans	-54.6	-51	177.6	-56.9	0	0	0	0	111.4	L483 G484 F491 A516 W517	L483-T487 WeakPolarHBondContact O-CB 3.34Å; L483-T487 PolarHBondContact O-N 3.26Å; L483-T487 PolarHBondContact O-OG1 3.1Å; G484-T487 WeakPolarHBondContact O-CB 3.36Å; G484-T487 PolarHBondContact O-N 3.46Å; T487-F491 VanDerWaalsContact O-CB 3.3Å; T487-F491 WeakPolarHBondContact O-CB 3.26Å; T487-F491 PolarHBondContact O-N 3.1Å; T487-A516 VanDerWaalsContact OG1-CB 3.26Å; T487-A516 WeakPolarHBondContact OG1-CB 3.45Å; T487-W517 HydrophobicContact CG2-CB 3.91Å
488	L	95.7	Very high	92.9	Very high	100 Å²	100	37.2 Å²	37.2	52%	0.524	20%	0.195	S	C	.	.	H	α-helix	trans	-65.1	-46.1	-176.1	-174.1	67.3	0	0	0	112.1	G484 L485 F486 F492	G484-L488 PolarHBondContact O-N 3.42Å; L485-L488 PolarHBondContact O-N 2.75Å; F486-L488 PolarHBondContact O-N 3.49Å; L488-F492 HydrophobicContact CD1-CD2 4.44Å; L488-F492 HydrophobicContact CD1-CE2 3.74Å; L488-F492 HydrophobicContact CG-CE2 4.17Å; L488-F492 WeakPolarHBondContact O-CD2 3.43Å; L488-F492 PolarHBondContact O-N 3.09Å
489	T	94.7	Very high	93.3	Very high	35 Å²	35	37.9 Å²	37.9	22%	0.215	21%	0.208	C	C	.	.	H	α-helix	trans	-67.6	-44.7	179.5	51.1	0	0	0	0	111.7	V419 M423 L485 F486 F491 F492 L493	V419-T489 HydrophobicContact CG1-CG2 4.39Å; M423-T489 HydrophobicContact CE-CG2 4.38Å; M423-T489 HydrophobicContact SD-CG2 4.32Å; L485-T489 WeakPolarHBondContact O-CB 3.09Å; L485-T489 WeakPolarHBondContact O-CG2 3.48Å; L485-T489 PolarHBondContact O-N 3.06Å; L485-T489 PolarHBondContact O-OG1 2.88Å; F486-T489 PolarHBondContact O-N 2.93Å; F486-T489 PolarHBondContact O-OG1 2.74Å; T489-F491 PolarHBondContact O-N 3.45Å; T489-F492 PolarHBondContact O-N 3.43Å; T489-L493 VanDerWaalsContact O-CG 3.31Å; T489-L493 WeakPolarHBondContact O-CG 3.34Å; T489-L493 PolarHBondContact O-N 3.29Å
490	Y	95.6	Very high	93.7	Very high	16 Å²	16	34.8 Å²	34.8	6%	0.063	19%	0.191	C	C	.	.	H	α-helix	trans	-68.1	-32.4	179.9	-163	-86.2	0	0	0	112.5	A235 F459 F486 L493 A494 P509 L512 I513	A235-Y490 HydrophobicContact CB-CE1 4.3Å; A235-Y490 HydrophobicContact CB-CE2 4.02Å; F459-Y490 HydrophobicContact CE1-CD2 4.41Å; F486-Y490 HydrophobicContact CE2-CD2 4.17Å; F486-Y490 HydrophobicContact CZ-CD2 4.13Å; F486-Y490 HydrophobicContact CZ-CG 4.25Å; F486-Y490 WeakPolarHBondContact O-CB 3.48Å; F486-Y490 PolarHBondContact O-N 2.73Å; Y490-L493 PolarHBondContact O-N 2.75Å; Y490-A494 HydrophobicContact CD1-CB 4.49Å; Y490-A494 HydrophobicContact CE1-CB 4.36Å; Y490-A494 VanDerWaalsContact O-CB 3.29Å; Y490-A494 WeakPolarHBondContact O-CB 3.38Å; Y490-A494 PolarHBondContact O-N 3.44Å; Y490-P509 HydrophobicContact CE1-CB 4.1Å; Y490-L512 HydrophobicContact CE1-CB 4.38Å; Y490-L512 HydrophobicContact CE1-CD2 4.01Å; Y490-L512 HydrophobicContact CE1-CG 4.32Å; Y490-L512 HydrophobicContact CE2-CD2 4.17Å; Y490-I513 HydrophobicContact CD1-CD1 4.35Å; Y490-I513 HydrophobicContact CD1-CG1 3.8Å; Y490-I513 HydrophobicContact CE1-CG1 4.4Å
491	F	97	Very high	94	Very high	14 Å²	14	33 Å²	33	6%	0.061	18%	0.18	C	C	.	.	H	α-helix	trans	-56.7	-51.2	171.9	177.7	-88	0	0	0	112.1	F383 F384 L387 T487 T489 C495 I513	F383-F491 AromaticContact CD1-CE1 3.85Å; F383-F491 HydrophobicContact CD1-CE1 3.85Å; F383-F491 AromaticContact CD1-CZ 3.71Å; F383-F491 HydrophobicContact CD1-CZ 3.71Å; F383-F491 AromaticContact CE1-CE1 3.94Å; F383-F491 HydrophobicContact CE1-CE1 3.94Å; F383-F491 HydrophobicContact CE1-CZ 4.28Å; F384-F491 HydrophobicContact CB-CE2 3.9Å; F384-F491 HydrophobicContact CB-CZ 3.8Å; F384-F491 HydrophobicContact CD2-CD2 4.2Å; F384-F491 HydrophobicContact CD2-CE1 4.5Å; F384-F491 AromaticContact CD2-CE2 3.79Å; F384-F491 HydrophobicContact CD2-CE2 3.79Å; F384-F491 AromaticContact CD2-CZ 3.95Å; F384-F491 HydrophobicContact CD2-CZ 3.95Å; F384-F491 HydrophobicContact CG-CE2 4.33Å; F384-F491 HydrophobicContact CG-CZ 4.39Å; L387-F491 HydrophobicContact CD1-CE1 4.11Å; T487-F491 VanDerWaalsContact O-CB 3.3Å; T487-F491 WeakPolarHBondContact O-CB 3.26Å; T487-F491 PolarHBondContact O-N 3.1Å; T489-F491 PolarHBondContact O-N 3.45Å; F491-C495 VanDerWaalsContact O-CB 3.29Å; F491-C495 WeakPolarHBondContact O-CB 3.41Å; F491-C495 PolarHBondContact O-N 3.11Å; F491-I513 HydrophobicContact CB-CD1 4.39Å; F491-I513 HydrophobicContact CD2-CD1 4.29Å; F491-I513 HydrophobicContact CD2-CG2 4.09Å
492	F	96.8	Very high	94.3	Very high	100 Å²	100	27.7 Å²	27.7	44%	0.439	15%	0.152	S	C	.	.	H	α-helix	trans	-69.6	-36.8	178.9	-69.6	-63.3	0	0	0	112.6	L387 L488 T489 C495 W496	L387-F492 HydrophobicContact CD1-CD1 4.3Å; L387-F492 HydrophobicContact CD1-CE1 3.92Å; L488-F492 HydrophobicContact CD1-CD2 4.44Å; L488-F492 HydrophobicContact CD1-CE2 3.74Å; L488-F492 HydrophobicContact CG-CE2 4.17Å; L488-F492 WeakPolarHBondContact O-CD2 3.43Å; L488-F492 PolarHBondContact O-N 3.09Å; T489-F492 PolarHBondContact O-N 3.43Å; F492-C495 PolarHBondContact O-N 2.99Å; F492-W496 WeakPolarHBondContact O-CB 3.25Å; F492-W496 PolarHBondContact O-N 3.03Å
493	L	95.8	Very high	94.6	Very high	10 Å²	10	27.2 Å²	27.2	5%	0.052	15%	0.149	C	C	.	.	H	α-helix	trans	-63.8	-44.6	175.4	-71.1	169.9	0	0	0	111.9	T416 V419 T489 Y490 W496 T497	T416-L493 HydrophobicContact CG2-CD1 4.45Å; V419-L493 HydrophobicContact CB-CD1 4.49Å; V419-L493 HydrophobicContact CG1-CD1 4.14Å; T489-L493 VanDerWaalsContact O-CG 3.31Å; T489-L493 WeakPolarHBondContact O-CG 3.34Å; T489-L493 PolarHBondContact O-N 3.29Å; Y490-L493 PolarHBondContact O-N 2.75Å; L493-W496 PolarHBondContact O-N 2.97Å; L493-T497 WeakPolarHBondContact O-CB 3.24Å; L493-T497 PolarHBondContact O-N 3.11Å; L493-T497 PolarHBondContact O-OG1 3.01Å
494	A	95.7	Very high	94.8	Very high	3 Å²	3	27.2 Å²	27.2	3%	0.025	15%	0.15	C	C	.	.	H	α-helix	trans	-63.6	-41	174.4	0	0	0	0	0	111.9	A235 F384 Y490 W496 T497 Y498 P509 I513	A235-A494 HydrophobicContact CB-CB 4.14Å; F384-A494 HydrophobicContact CE2-CB 4.22Å; Y490-A494 HydrophobicContact CD1-CB 4.49Å; Y490-A494 HydrophobicContact CE1-CB 4.36Å; Y490-A494 VanDerWaalsContact O-CB 3.29Å; Y490-A494 WeakPolarHBondContact O-CB 3.38Å; Y490-A494 PolarHBondContact O-N 3.44Å; A494-W496 PolarHBondContact O-N 3.02Å; A494-T497 PolarHBondContact O-N 2.92Å; A494-Y498 PolarHBondContact O-N 3.13Å; A494-P509 HydrophobicContact CB-CB 3.95Å; A494-I513 HydrophobicContact CB-CD1 4Å
495	C	96	Very high	94.8	Very high	8 Å²	8	26.3 Å²	26.3	5%	0.054	14%	0.141	C	C	.	.	H	α-helix	trans	-62.6	-39.2	176.2	-175.7	0	0	0	0	112.5	F384 L387 N388 L391 F491 F492	F384-C495 HydrophobicContact CD2-CB 3.93Å; F384-C495 VanDerWaalsContact CE2-CA 3.48Å; F384-C495 HydrophobicContact CE2-CB 3.62Å; F384-C495 HydrophobicContact CZ-CB 4.29Å; L387-C495 VanDerWaalsContact CB-SG 3.5Å; N388-C495 PolarHBondContact ND2-SG 3.34Å; N388-C495 PolarHBondContact OD1-O 3.17Å; L391-C495 WeakPolarHBondContact CD2-O 3.07Å; F491-C495 VanDerWaalsContact O-CB 3.29Å; F491-C495 WeakPolarHBondContact O-CB 3.41Å; F491-C495 PolarHBondContact O-N 3.11Å; F492-C495 PolarHBondContact O-N 2.99Å
496	W	96	Very high	94.8	Very high	81 Å²	81	22.8 Å²	22.8	31%	0.307	12%	0.123	S	C	.	.	H	α-helix	trans	-77.7	-33.3	177.4	-169.2	15.7	0	0	0	112.1	R395 E408 V412 V415 F492 L493 A494	R395-W496 PolarHBondContact NH2-O 2.74Å; E408-W496 PolarHBondContact OE1-NE1 3.47Å; V412-W496 HydrophobicContact CG2-CD2 3.71Å; V412-W496 VanDerWaalsContact CG2-CE2 3.49Å; V412-W496 HydrophobicContact CG2-CE3 4.17Å; V412-W496 HydrophobicContact CG2-CG 4.14Å; V412-W496 HydrophobicContact CG2-CH2 4.24Å; V412-W496 HydrophobicContact CG2-CZ2 3.78Å; V412-W496 HydrophobicContact CG2-CZ3 4.41Å; V415-W496 HydrophobicContact CB-CZ3 4.2Å; V415-W496 HydrophobicContact CG1-CZ3 4.04Å; V415-W496 HydrophobicContact CG2-CH2 4.4Å; V415-W496 HydrophobicContact CG2-CZ3 4.34Å; F492-W496 WeakPolarHBondContact O-CB 3.25Å; F492-W496 PolarHBondContact O-N 3.03Å; L493-W496 PolarHBondContact O-N 2.97Å; A494-W496 PolarHBondContact O-N 3.02Å
497	T	95.8	Very high	94.8	Very high	2 Å²	2	22.8 Å²	22.8	1%	0.012	12%	0.122	C	C	.	.	H	α-helix	trans	-69.3	-37.4	-179.9	-61.5	0	0	0	0	112.7	L234 V236 L493 A494 L500	L234-T497 HydrophobicContact CB-CG2 3.87Å; L234-T497 HydrophobicContact CD2-CG2 4.39Å; L234-T497 HydrophobicContact CG-CG2 4.5Å; V236-T497 HydrophobicContact CG1-CG2 3.38Å; L493-T497 WeakPolarHBondContact O-CB 3.24Å; L493-T497 PolarHBondContact O-N 3.11Å; L493-T497 PolarHBondContact O-OG1 3.01Å; A494-T497 PolarHBondContact O-N 2.92Å; T497-L500 HydrophobicContact CG2-CD1 4.3Å; T497-L500 WeakPolarHBondContact O-CB 3.35Å; T497-L500 WeakPolarHBondContact O-CG 3.35Å; T497-L500 PolarHBondContact O-N 2.98Å
498	Y	92.4	Very high	94.8	Very high	17 Å²	17	21.9 Å²	21.9	7%	0.067	12%	0.117	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.2	139.1	175	-172.4	-95.2	0	0	0	110.8	N388 R395 A494 V506 L595 H599	N388-Y498 VanDerWaalsContact OD1-CD1 3.3Å; N388-Y498 WeakPolarHBondContact OD1-CD1 3.37Å; R395-Y498 PolarHBondContact NH1-O 3.5Å; A494-Y498 PolarHBondContact O-N 3.13Å; Y498-V506 HydrophobicContact CD2-CB 3.93Å; Y498-V506 HydrophobicContact CD2-CG2 4.09Å; Y498-V506 HydrophobicContact CE2-CB 4.12Å; Y498-V506 HydrophobicContact CE2-CG1 4.46Å; Y498-L595 HydrophobicContact CD1-CD1 4.22Å; Y498-L595 HydrophobicContact CD1-CD2 4.09Å; Y498-L595 HydrophobicContact CD1-CG 4.44Å; Y498-L595 HydrophobicContact CD2-CD2 4.27Å; Y498-L595 HydrophobicContact CE1-CD1 3.88Å; Y498-L595 HydrophobicContact CE1-CD2 3.77Å; Y498-L595 HydrophobicContact CE1-CG 3.82Å; Y498-L595 HydrophobicContact CE2-CD2 3.97Å; Y498-L595 HydrophobicContact CG-CD2 4.31Å; Y498-H599 AromaticContact CE1-CE1 3.56Å; Y498-H599 AromaticContact CE1-ND1 3.95Å; Y498-H599 AromaticContact CE1-NE2 3.65Å
499	G	90.3	Very high	94.8	Very high	36 Å²	36	17.2 Å²	17.2	37%	0.371	9%	0.093	S	C	.	.	T	Hydrogen-bonded Turn	trans	83.5	2.4	-176.2	0	0	0	0	0	116	R395	R395-G499 VanDerWaalsContact NH1-C 3.32Å
500	L	94.6	Very high	94.8	Very high	5 Å²	5	15.6 Å²	15.6	3%	0.026	8%	0.083	C	C	.	.	S	Bend	trans	-68	157.2	167.1	-72.7	174.3	0	0	0	112.2	E408 A409 V412 T497 V502	E408-L500 HydrophobicContact CB-CD2 4.23Å; E408-L500 HydrophobicContact CG-CD2 3.8Å; A409-L500 HydrophobicContact CB-CD1 4.49Å; A409-L500 HydrophobicContact CB-CD2 4.4Å; V412-L500 HydrophobicContact CB-CD1 3.93Å; V412-L500 HydrophobicContact CG1-CD1 4.04Å; V412-L500 HydrophobicContact CG2-CD1 4.08Å; V412-L500 HydrophobicContact CG2-CD2 4.2Å; T497-L500 HydrophobicContact CG2-CD1 4.3Å; T497-L500 WeakPolarHBondContact O-CB 3.35Å; T497-L500 WeakPolarHBondContact O-CG 3.35Å; T497-L500 PolarHBondContact O-N 2.98Å; L500-V502 HydrophobicContact CB-CG2 4.03Å; L500-V502 PolarHBondContact O-N 3.47Å
501	A	94.4	Very high	94.8	Very high	13 Å²	13	14.9 Å²	14.9	11%	0.107	8%	0.08	C	C	.	.	S	Bend	trans	-78.4	58.9	175.6	0	0	0	0	0	112.8	S183 A187 Q405	S183-A501 VanDerWaalsContact CA-O 3.31Å; S183-A501 WeakPolarHBondContact CA-O 3.49Å; S183-A501 WeakPolarHBondContact CB-O 3.49Å; S183-A501 PolarHBondContact OG-O 2.81Å; A187-A501 HydrophobicContact CB-CB 4.27Å; Q405-A501 HydrophobicContact CB-CB 3.75Å; Q405-A501 HydrophobicContact CG-CB 4.41Å
502	V	96	Very high	94.8	Very high	1 Å²	1	14.3 Å²	14.3	1%	0.006	8%	0.078	C	C	.	.	S	Bend	trans	-137.5	163.3	172.7	-67.5	0	0	0	0	108.8	V179 A194 G195 L234 A409 L500 A504	V179-V502 HydrophobicContact CG1-CG1 4.32Å; A194-V502 CarbonylContact C-O 3.6Å; A194-V502 WeakPolarHBondContact CA-O 3.41Å; G195-V502 PolarHBondContact N-O 3.45Å; L234-V502 HydrophobicContact CD1-CG2 4.12Å; A409-V502 HydrophobicContact CB-CG1 4.33Å; L500-V502 HydrophobicContact CB-CG2 4.03Å; L500-V502 PolarHBondContact O-N 3.47Å; V502-A504 HydrophobicContact CG2-CB 4.34Å
503	S	95.9	Very high	94.8	Very high	0 Å²	0	9.6 Å²	9.6	0%	0	6%	0.057	C	C	.	.	B	Isolated β-bridge	trans	-85	130.5	168.7	-151.3	0	0	0	0	110.6	A193 G195 K222 S229	A193-S503 WeakPolarHBondContact O-CB 3.2Å; A193-S503 PolarHBondContact O-OG 3.43Å; G195-S503 PolarHBondContact O-OG 3.3Å; K222-S503 VanDerWaalsContact CE-OG 3.32Å; K222-S503 WeakPolarHBondContact CE-OG 3.44Å; K222-S503 WeakPolarHBondContact CG-OG 3.41Å; K222-S503 PolarHBondContact NZ-OG 3.43Å; S229-S503 WeakPolarHBondContact CB-O 3.38Å; S229-S503 PolarHBondContact OG-O 3.48Å
504	A	93.6	Very high	94.8	Very high	6 Å²	6	9.1 Å²	9.1	5%	0.05	6%	0.055	C	C	.	.			trans	-161	133.3	-167	0	0	0	0	0	112	G195 S196 V236 V502	G195-A504 CarbonylContact C-O 3.57Å; G195-A504 PolarHBondContact O-N 3Å; G195-A504 VanDerWaalsContact O-N 3.13Å; S196-A504 WeakPolarHBondContact CA-O 3.3Å; S196-A504 PolarHBondContact N-O 3.41Å; V236-A504 HydrophobicContact CB-CB 3.87Å; V236-A504 HydrophobicContact CG1-CB 3.48Å; V236-A504 VanDerWaalsContact CG1-CB 3.48Å; V502-A504 HydrophobicContact CG2-CB 4.34Å
505	G	92.6	Very high	94.8	Very high	3 Å²	3	9 Å²	9	3%	0.031	5%	0.053	C	C	.	.	B	Isolated β-bridge	trans	-96.5	143.9	168.4	0	0	0	0	0	112.2	G237	G237-G505 PolarHBondContact N-O 3.45Å; G237-G505 VanDerWaalsContact O-CA 3.26Å; G237-G505 WeakPolarHBondContact O-CA 3.43Å; G237-G505 PolarHBondContact O-N 3.23Å
506	V	94.1	Very high	94.8	Very high	5 Å²	5	8.6 Å²	8.6	3%	0.03	5%	0.051	C	C	.	.	S	Bend	trans	-93.6	-13.4	178	74	0	0	0	0	113.4	F384 Y498 P509 S510 L595 Y596	F384-V506 HydrophobicContact CE1-CG2 4.25Å; F384-V506 HydrophobicContact CZ-CG2 4.28Å; Y498-V506 HydrophobicContact CD2-CB 3.93Å; Y498-V506 HydrophobicContact CD2-CG2 4.09Å; Y498-V506 HydrophobicContact CE2-CB 4.12Å; Y498-V506 HydrophobicContact CE2-CG1 4.46Å; V506-P509 WeakPolarHBondContact O-CD 3.48Å; V506-S510 PolarHBondContact O-N 3.32Å; V506-S510 PolarHBondContact O-OG 2.88Å; V506-L595 HydrophobicContact CB-CD2 4.46Å; V506-L595 HydrophobicContact CG1-CD2 4.12Å; V506-L595 HydrophobicContact CG2-CD2 4.04Å; V506-Y596 HydrophobicContact CG1-CE1 4.12Å; V506-Y596 WeakPolarHBondContact CG1-OH 3.39Å
507	F	93.3	Very high	94.8	Very high	5 Å²	5	5.5 Å²	5.5	2%	0.022	4%	0.039	C	C	.	.	H	α-helix	trans	-54.2	-58	-177.2	-87.6	-96.3	0	0	0	113.4	I198 F293 S510 L511 L550 M556 Y596	I198-F507 HydrophobicContact CD1-CD2 4.29Å; I198-F507 HydrophobicContact CD1-CE2 3.67Å; F293-F507 HydrophobicContact CE1-CB 4.47Å; F293-F507 HydrophobicContact CE1-CD1 4.12Å; F293-F507 HydrophobicContact CE2-CD1 4.4Å; F293-F507 HydrophobicContact CE2-CE1 4.49Å; F293-F507 HydrophobicContact CZ-CB 4.09Å; F293-F507 AromaticContact CZ-CD1 3.53Å; F293-F507 HydrophobicContact CZ-CD1 3.53Å; F293-F507 HydrophobicContact CZ-CD2 4.49Å; F293-F507 HydrophobicContact CZ-CE1 4.03Å; F293-F507 AromaticContact CZ-CG 3.81Å; F293-F507 HydrophobicContact CZ-CG 3.81Å; F507-S510 PolarHBondContact O-N 3.44Å; F507-L511 WeakPolarHBondContact O-CG 3.42Å; F507-L511 PolarHBondContact O-N 3.23Å; F507-L550 HydrophobicContact CD1-CD1 3.7Å; F507-L550 HydrophobicContact CD1-CD2 3.69Å; F507-L550 HydrophobicContact CD1-CG 4.29Å; F507-L550 HydrophobicContact CE1-CD1 4.1Å; F507-L550 HydrophobicContact CE1-CD2 4.04Å; F507-L550 HydrophobicContact CG-CD1 4.19Å; F507-M556 HydrophobicContact CZ-SD 4.42Å; F507-Y596 WeakPolarHBondContact CD2-OH 3.34Å; F507-Y596 HydrophobicContact CE2-CE2 4.34Å; F507-Y596 WeakPolarHBondContact CE2-OH 3.44Å
508	I	94.1	Very high	94.8	Very high	0 Å²	0	5.4 Å²	5.4	0%	0	4%	0.039	C	C	.	.	H	α-helix	trans	-65.1	-43	-177.3	-49.9	-50.1	0	0	0	112.3	E239 I350 P463 E464 V467 S510 L511 L512	E239-I508 HydrophobicContact CG-CD1 3.66Å; E239-I508 HydrophobicContact CG-CG1 3.82Å; I350-I508 HydrophobicContact CB-CD1 4.47Å; I350-I508 HydrophobicContact CD1-CD1 3.6Å; I350-I508 HydrophobicContact CG2-CD1 4.29Å; P463-I508 HydrophobicContact CB-CG2 3.64Å; E464-I508 HydrophobicContact CG-CG1 4.45Å; E464-I508 HydrophobicContact CG-CG2 4.29Å; V467-I508 HydrophobicContact CG2-CG2 4.44Å; I508-S510 VanDerWaalsContact C-N 3.34Å; I508-S510 PolarHBondContact O-N 3.48Å; I508-L511 HydrophobicContact CD1-CD1 4.01Å; I508-L511 PolarHBondContact O-N 3.45Å; I508-L512 WeakPolarHBondContact O-CB 3.3Å; I508-L512 PolarHBondContact O-N 3.35Å
509	P	95.4	Very high	94.9	Very high	2 Å²	2	4.7 Å²	4.7	1%	0.013	4%	0.036	C	C	.	.	H	α-helix	trans	-54.3	-44.6	170.6	-29	34.9	0	0	0	114.1	A235 Y490 A494 V506 L512 I513	A235-P509 WeakPolarHBondContact O-CG 3.37Å; Y490-P509 HydrophobicContact CE1-CB 4.1Å; A494-P509 HydrophobicContact CB-CB 3.95Å; V506-P509 WeakPolarHBondContact O-CD 3.48Å; P509-L512 PolarHBondContact O-N 3.46Å; P509-I513 WeakPolarHBondContact O-CD1 3.47Å; P509-I513 VanDerWaalsContact O-CG1 3.25Å; P509-I513 WeakPolarHBondContact O-CG1 3.35Å; P509-I513 PolarHBondContact O-N 2.79Å
510	S	95.8	Very high	95	Very high	0 Å²	0	5.2 Å²	5.2	0%	0	3%	0.03	C	C	.	.	H	α-helix	trans	-64.4	-42.6	177.1	-59.4	0	0	0	0	112.6	V506 F507 I508 G514 Q549 I553	V506-S510 PolarHBondContact O-N 3.32Å; V506-S510 PolarHBondContact O-OG 2.88Å; F507-S510 PolarHBondContact O-N 3.44Å; I508-S510 VanDerWaalsContact C-N 3.34Å; I508-S510 PolarHBondContact O-N 3.48Å; S510-G514 PolarHBondContact O-N 3.3Å; S510-Q549 WeakPolarHBondContact O-CG 3.49Å; S510-I553 WeakPolarHBondContact OG-CD1 3.48Å
511	L	95.9	Very high	94.9	Very high	1 Å²	1	7.1 Å²	7.1	1%	0.005	4%	0.043	C	C	.	.	H	α-helix	trans	-62.4	-41.2	175	-71.6	168.3	0	0	0	111.7	F352 V467 F507 I508 G514 A515 A546 L550 M564	F352-L511 HydrophobicContact CE1-CD1 4.15Å; F352-L511 HydrophobicContact CZ-CD1 3.97Å; V467-L511 HydrophobicContact CG2-CB 4.25Å; F507-L511 WeakPolarHBondContact O-CG 3.42Å; F507-L511 PolarHBondContact O-N 3.23Å; I508-L511 HydrophobicContact CD1-CD1 4.01Å; I508-L511 PolarHBondContact O-N 3.45Å; L511-G514 PolarHBondContact O-N 3.02Å; L511-A515 VanDerWaalsContact O-CB 3.24Å; L511-A515 WeakPolarHBondContact O-CB 3.43Å; L511-A515 PolarHBondContact O-N 3.01Å; L511-A546 HydrophobicContact CD2-CB 3.88Å; L511-L550 HydrophobicContact CD1-CD2 4.4Å; L511-L550 HydrophobicContact CD2-CB 4.27Å; L511-L550 HydrophobicContact CD2-CD2 3.72Å; L511-L550 HydrophobicContact CG-CD2 3.94Å; L511-M564 HydrophobicContact CD2-CE 4.14Å; L511-M564 HydrophobicContact CD2-SD 4.09Å
512	L	95.8	Very high	94.7	Very high	2 Å²	2	6.5 Å²	6.5	1%	0.01	4%	0.038	C	C	.	.	H	α-helix	trans	-68.7	-42	-179.5	-176.9	51.2	0	0	0	112.4	P463 V467 L470 F486 Y490 I508 P509 G514 A516	P463-L512 HydrophobicContact CB-CD2 3.99Å; V467-L512 HydrophobicContact CG2-CB 3.76Å; V467-L512 HydrophobicContact CG2-CD1 4.03Å; V467-L512 HydrophobicContact CG2-CG 4.43Å; L470-L512 HydrophobicContact CD1-CD1 3.58Å; F486-L512 HydrophobicContact CE1-CD1 4.17Å; F486-L512 HydrophobicContact CE1-CG 4.24Å; F486-L512 HydrophobicContact CZ-CD1 4.32Å; F486-L512 HydrophobicContact CZ-CD2 4.19Å; F486-L512 HydrophobicContact CZ-CG 4.2Å; Y490-L512 HydrophobicContact CE1-CB 4.38Å; Y490-L512 HydrophobicContact CE1-CD2 4.01Å; Y490-L512 HydrophobicContact CE1-CG 4.32Å; Y490-L512 HydrophobicContact CE2-CD2 4.17Å; I508-L512 WeakPolarHBondContact O-CB 3.3Å; I508-L512 PolarHBondContact O-N 3.35Å; P509-L512 PolarHBondContact O-N 3.46Å; L512-G514 VanDerWaalsContact C-N 3.35Å; L512-A516 WeakPolarHBondContact O-CB 3.45Å; L512-A516 PolarHBondContact O-N 2.88Å
513	I	96.9	Very high	94.4	Very high	2 Å²	2	8 Å²	8	1%	0.01	5%	0.045	C	C	.	.	H	α-helix	trans	-58.6	-49	171.7	-67.9	161.9	0	0	0	110.2	Y490 F491 A494 P509 A516 W517 Q549	Y490-I513 HydrophobicContact CD1-CD1 4.35Å; Y490-I513 HydrophobicContact CD1-CG1 3.8Å; Y490-I513 HydrophobicContact CE1-CG1 4.4Å; F491-I513 HydrophobicContact CB-CD1 4.39Å; F491-I513 HydrophobicContact CD2-CD1 4.29Å; F491-I513 HydrophobicContact CD2-CG2 4.09Å; A494-I513 HydrophobicContact CB-CD1 4Å; P509-I513 WeakPolarHBondContact O-CD1 3.47Å; P509-I513 VanDerWaalsContact O-CG1 3.25Å; P509-I513 WeakPolarHBondContact O-CG1 3.35Å; P509-I513 PolarHBondContact O-N 2.79Å; I513-A516 PolarHBondContact O-N 3.03Å; I513-W517 PolarHBondContact O-N 2.59Å; I513-W517 VanDerWaalsContact O-N 3.08Å; I513-Q549 HydrophobicContact CB-CG 4.15Å; I513-Q549 HydrophobicContact CG2-CG 3.84Å
514	G	97	Very high	94.1	Very high	0 Å²	0	13 Å²	13	0%	0	7%	0.071	C	C	.	.	H	α-helix	trans	-67.5	-38.5	-178.4	0	0	0	0	0	113.7	S510 L511 L512 A516 G518 G545 A546	S510-G514 PolarHBondContact O-N 3.3Å; L511-G514 PolarHBondContact O-N 3.02Å; L512-G514 VanDerWaalsContact C-N 3.35Å; G514-A516 VanDerWaalsContact C-N 3.34Å; G514-G518 WeakPolarHBondContact O-CA 3.38Å; G514-G518 PolarHBondContact O-N 3.38Å; G514-G545 VanDerWaalsContact CA-C 3.47Å; G514-G545 VanDerWaalsContact CA-O 3.25Å; G514-G545 WeakPolarHBondContact CA-O 3.21Å; G514-G545 CarbonylContact O-C 3.55Å; G514-G545 WeakPolarHBondContact O-CA 3.21Å; G514-A546 VanDerWaalsContact C-N 3.28Å; G514-A546 PolarHBondContact O-N 3.43Å
515	A	96	Very high	93.8	Very high	0 Å²	0	14.4 Å²	14.4	0%	0	8%	0.078	C	C	.	.	H	α-helix	trans	-63	-41.9	173.6	0	0	0	0	0	111.3	L470 F471 L511 R519 A542 A546	L470-A515 HydrophobicContact CB-CB 4.12Å; L470-A515 HydrophobicContact CD1-CB 3.99Å; F471-A515 HydrophobicContact CD1-CB 4.31Å; F471-A515 HydrophobicContact CE1-CB 3.71Å; F471-A515 HydrophobicContact CZ-CB 4.49Å; L511-A515 VanDerWaalsContact O-CB 3.24Å; L511-A515 WeakPolarHBondContact O-CB 3.43Å; L511-A515 PolarHBondContact O-N 3.01Å; A515-R519 WeakPolarHBondContact O-CB 3.17Å; A515-R519 PolarHBondContact O-N 3.26Å; A515-A542 WeakPolarHBondContact CA-O 3.5Å; A515-A542 HydrophobicContact CB-CB 4.48Å; A515-A546 HydrophobicContact CB-CB 4.31Å
516	A	95.1	Very high	93.4	Very high	0 Å²	0	16 Å²	16	0%	0	9%	0.091	C	C	.	.	H	α-helix	trans	-66.8	-48.7	-179.5	0	0	0	0	0	112.5	L470 L483 F486 T487 L512 I513 G514 L520	L470-A516 HydrophobicContact CD1-CB 4.18Å; L483-A516 HydrophobicContact CD1-CB 3.9Å; L483-A516 WeakPolarHBondContact CD2-O 3.38Å; F486-A516 HydrophobicContact CD1-CB 4.06Å; F486-A516 HydrophobicContact CE1-CB 4.2Å; T487-A516 VanDerWaalsContact OG1-CB 3.26Å; T487-A516 WeakPolarHBondContact OG1-CB 3.45Å; L512-A516 WeakPolarHBondContact O-CB 3.45Å; L512-A516 PolarHBondContact O-N 2.88Å; I513-A516 PolarHBondContact O-N 3.03Å; G514-A516 VanDerWaalsContact C-N 3.34Å; A516-L520 WeakPolarHBondContact O-CB 3.01Å; A516-L520 PolarHBondContact O-N 3.43Å
517	W	96.5	Very high	92.8	Very high	16 Å²	16	20 Å²	20	6%	0.061	12%	0.119	C	C	.	.	H	α-helix	trans	-73.8	-32.7	176.3	74.2	-112.8	0	0	0	113.1	M373 I376 T487 I513 L520 C521 A548	M373-W517 HydrophobicContact CB-CH2 4.06Å; M373-W517 HydrophobicContact CB-CZ3 4.08Å; M373-W517 HydrophobicContact CE-CE3 4.28Å; M373-W517 HydrophobicContact CE-CH2 4.25Å; M373-W517 HydrophobicContact CE-CZ3 3.57Å; M373-W517 HydrophobicContact CG-CZ3 4.14Å; M373-W517 WeakPolarHBondContact O-CH2 3.28Å; I376-W517 HydrophobicContact CB-CH2 4.44Å; I376-W517 HydrophobicContact CG2-CH2 4.22Å; I376-W517 HydrophobicContact CG2-CZ2 4.47Å; I376-W517 HydrophobicContact CG2-CZ3 4.23Å; T487-W517 HydrophobicContact CG2-CB 3.91Å; I513-W517 PolarHBondContact O-N 2.59Å; I513-W517 VanDerWaalsContact O-N 3.08Å; W517-L520 WeakPolarHBondContact O-CB 3.23Å; W517-L520 PolarHBondContact O-N 2.94Å; W517-C521 PolarHBondContact O-N 3.44Å; W517-C521 PolarHBondContact O-SG 2.87Å; W517-C521 VanDerWaalsContact O-SG 3.41Å; W517-A548 HydrophobicContact CH2-CB 3.86Å; W517-A548 HydrophobicContact CZ2-CB 3.87Å
518	G	95.6	Very high	92.2	Very high	0 Å²	0	24.2 Å²	24.2	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-61.8	-44.7	174.3	0	0	0	0	0	112	G514 C521 G522 Y541	G514-G518 WeakPolarHBondContact O-CA 3.38Å; G514-G518 PolarHBondContact O-N 3.38Å; G518-C521 WeakPolarHBondContact O-CB 3.44Å; G518-C521 PolarHBondContact O-N 3.4Å; G518-G522 PolarHBondContact O-N 3.36Å; G518-Y541 CarbonylContact C-O 3.35Å; G518-Y541 WeakPolarHBondContact CA-O 3.31Å; G518-Y541 VanDerWaalsContact O-CB 3.27Å; G518-Y541 WeakPolarHBondContact O-CB 3.31Å
519	R	93.5	Very high	91.1	Very high	2 Å²	2	26.6 Å²	26.6	1%	0.008	16%	0.16	C	C	.	.	H	α-helix	trans	-64.5	-39.2	173.9	-164.3	178.3	177.1	96.2	3.9	111.8	L470 N473 P474 L483 A515 C521 G522 I523 P538 A542	L470-R519 WeakPolarHBondContact O-CD 3.48Å; L470-R519 PolarHBondContact O-NH1 3.14Å; N473-R519 PolarHBondContact O-NH1 2.95Å; N473-R519 PolarHBondContact O-NH2 3.01Å; P474-R519 PolarHBondContact O-NH2 3.47Å; L483-R519 HydrophobicContact CD2-CB 4.1Å; L483-R519 HydrophobicContact CD2-CG 4.31Å; A515-R519 WeakPolarHBondContact O-CB 3.17Å; A515-R519 PolarHBondContact O-N 3.26Å; R519-C521 PolarHBondContact O-N 3.1Å; R519-G522 PolarHBondContact O-N 3.4Å; R519-I523 HydrophobicContact CG-CD1 4.25Å; R519-I523 WeakPolarHBondContact O-CG1 3.5Å; R519-I523 PolarHBondContact O-N 2.77Å; R519-P538 HydrophobicContact CG-CB 3.66Å; R519-A542 HydrophobicContact CB-CB 3.86Å; R519-A542 HydrophobicContact CG-CB 4.5Å
520	L	93.4	Very high	89.3	Confident	47 Å²	47	32.4 Å²	32.4	25%	0.246	20%	0.201	C	C	.	.	H	α-helix	trans	-60.9	-41.6	174	-178.2	63.7	0	0	0	112.1	S480 L483 A516 W517 I523 L524	S480-L520 WeakPolarHBondContact O-CD1 3.1Å; L483-L520 HydrophobicContact CD2-CB 4.17Å; A516-L520 WeakPolarHBondContact O-CB 3.01Å; A516-L520 PolarHBondContact O-N 3.43Å; W517-L520 WeakPolarHBondContact O-CB 3.23Å; W517-L520 PolarHBondContact O-N 2.94Å; L520-I523 PolarHBondContact O-N 3.36Å; L520-L524 WeakPolarHBondContact O-CB 3.25Å; L520-L524 PolarHBondContact O-N 2.91Å
521	C	92.6	Very high	87.3	Confident	45 Å²	45	38 Å²	38	30%	0.304	24%	0.235	S	C	.	.	H	α-helix	trans	-62.1	-41.4	172.6	-72.2	0	0	0	0	112.2	M373 W517 G518 R519 L524 L525	M373-C521 HydrophobicContact CE-CB 4.22Å; W517-C521 PolarHBondContact O-N 3.44Å; W517-C521 PolarHBondContact O-SG 2.87Å; W517-C521 VanDerWaalsContact O-SG 3.41Å; G518-C521 WeakPolarHBondContact O-CB 3.44Å; G518-C521 PolarHBondContact O-N 3.4Å; R519-C521 PolarHBondContact O-N 3.1Å; C521-L524 PolarHBondContact O-N 2.89Å; C521-L525 WeakPolarHBondContact O-CB 3.09Å; C521-L525 PolarHBondContact O-N 3.38Å
522	G	90.4	Very high	85.3	Confident	0 Å²	0	37.9 Å²	37.9	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-62.3	-45.2	174.8	0	0	0	0	0	113.3	G518 R519 L524 L525 A526	G518-G522 PolarHBondContact O-N 3.36Å; R519-G522 PolarHBondContact O-N 3.4Å; G522-L524 PolarHBondContact O-N 3.38Å; G522-L525 PolarHBondContact O-N 3.13Å; G522-A526 WeakPolarHBondContact O-CB 3.33Å; G522-A526 PolarHBondContact O-N 3.31Å
523	I	89.9	Confident	83.4	Confident	32 Å²	32	43.2 Å²	43.2	16%	0.164	27%	0.272	C	S	.	.	H	α-helix	trans	-61.5	-43.8	175.4	-65.5	162.4	0	0	0	110.8	S480 L483 R519 L520 A526 S527 P538	S480-I523 WeakPolarHBondContact OG-CG2 3.19Å; L483-I523 HydrophobicContact CD2-CD1 4.12Å; R519-I523 HydrophobicContact CG-CD1 4.25Å; R519-I523 WeakPolarHBondContact O-CG1 3.5Å; R519-I523 PolarHBondContact O-N 2.77Å; L520-I523 PolarHBondContact O-N 3.36Å; I523-A526 PolarHBondContact O-N 3.45Å; I523-S527 PolarHBondContact O-N 2.82Å; I523-P538 HydrophobicContact CG1-CB 4.13Å; I523-P538 HydrophobicContact CG1-CG 4Å
524	L	88.4	Confident	81.6	Confident	104 Å²	104	51.6 Å²	51.6	55%	0.545	31%	0.313	S	S	.	.	H	α-helix	trans	-62	-47.4	176.9	-178.3	63.3	0	0	0	111.3	L520 C521 G522 A526 S527 T528	L520-L524 WeakPolarHBondContact O-CB 3.25Å; L520-L524 PolarHBondContact O-N 2.91Å; C521-L524 PolarHBondContact O-N 2.89Å; G522-L524 PolarHBondContact O-N 3.38Å; L524-A526 PolarHBondContact O-N 3.03Å; L524-S527 PolarHBondContact O-N 2.91Å; L524-S527 VanDerWaalsContact O-N 3.11Å; L524-S527 PolarHBondContact O-OG 3.44Å; L524-T528 HydrophobicContact CD1-CG2 4.33Å; L524-T528 WeakPolarHBondContact O-CG2 3.48Å; L524-T528 PolarHBondContact O-N 3.46Å; L524-T528 PolarHBondContact O-OG1 2.85Å
525	L	86.9	Confident	80.4	Confident	36 Å²	36	54.5 Å²	54.5	19%	0.188	32%	0.324	C	S	.	.	H	α-helix	trans	-57.1	-50.5	177.8	-177.3	62.3	0	0	0	111.3	L369 C521 G522 S527 T528 T529 W535 A536 Y541	L369-L525 HydrophobicContact CD1-CD1 4.47Å; L369-L525 HydrophobicContact CD1-CD2 3.91Å; C521-L525 WeakPolarHBondContact O-CB 3.09Å; C521-L525 PolarHBondContact O-N 3.38Å; G522-L525 PolarHBondContact O-N 3.13Å; L525-S527 VanDerWaalsContact C-N 3.26Å; L525-S527 PolarHBondContact O-N 3.36Å; L525-T528 PolarHBondContact O-N 3.49Å; L525-T528 VanDerWaalsContact O-N 3.1Å; L525-T528 PolarHBondContact O-OG1 2.94Å; L525-T529 PolarHBondContact O-N 3.07Å; L525-W535 HydrophobicContact CD1-CH2 4.45Å; L525-W535 HydrophobicContact CD2-CH2 4.07Å; L525-W535 HydrophobicContact CD2-CZ3 3.84Å; L525-W535 HydrophobicContact CG-CH2 4.38Å; L525-A536 HydrophobicContact CD2-CB 4.26Å; L525-A536 HydrophobicContact CG-CB 4.33Å; L525-Y541 HydrophobicContact CD2-CE1 4.29Å; L525-Y541 HydrophobicContact CD2-CE2 3.86Å
526	A	84.1	Confident	79.5	Confident	37 Å²	37	54.8 Å²	54.8	31%	0.306	33%	0.326	S	S	.	.	H	α-helix	trans	-59.1	-33.7	176.3	0	0	0	0	0	112.9	G522 I523 L524 A536	G522-A526 WeakPolarHBondContact O-CB 3.33Å; G522-A526 PolarHBondContact O-N 3.31Å; I523-A526 PolarHBondContact O-N 3.45Å; L524-A526 PolarHBondContact O-N 3.03Å; A526-A536 HydrophobicContact CB-CB 4.29Å
527	S	81.7	Confident	79	Confident	89 Å²	89	56.1 Å²	56.1	62%	0.622	33%	0.333	S	S	*	.	H	α-helix	trans	-73.7	-31.3	175.4	77.3	0	0	0	0	113.8	I523 L524 L525	I523-S527 PolarHBondContact O-N 2.82Å; L524-S527 PolarHBondContact O-N 2.91Å; L524-S527 VanDerWaalsContact O-N 3.11Å; L524-S527 PolarHBondContact O-OG 3.44Å; L525-S527 VanDerWaalsContact C-N 3.26Å; L525-S527 PolarHBondContact O-N 3.36Å
528	T	80.3	Confident	78.6	Confident	94 Å²	94	55.5 Å²	55.5	58%	0.577	33%	0.331	S	S	*	.	H	α-helix	trans	-83	-19.3	-175.1	54.2	0	0	0	0	115	L524 L525	L524-T528 HydrophobicContact CD1-CG2 4.33Å; L524-T528 WeakPolarHBondContact O-CG2 3.48Å; L524-T528 PolarHBondContact O-N 3.46Å; L524-T528 PolarHBondContact O-OG1 2.85Å; L525-T528 PolarHBondContact O-N 3.49Å; L525-T528 VanDerWaalsContact O-N 3.1Å; L525-T528 PolarHBondContact O-OG1 2.94Å
529	T	71.1	Confident	78.3	Confident	50 Å²	50	55.5 Å²	55.5	31%	0.307	33%	0.331	S	S	.	.			trans	-125.7	105.5	-176.2	-62.3	0	0	0	0	110.7	L525 T531 A532	L525-T529 PolarHBondContact O-N 3.07Å; T529-T531 PolarHBondContact O-N 3.44Å; T529-A532 HydrophobicContact CG2-CB 3.68Å; T529-A532 WeakPolarHBondContact O-CB 3.33Å; T529-A532 PolarHBondContact O-N 2.8Å
530	S	57.5	Low	78.2	Confident	123 Å²	123	55.4 Å²	55.4	86%	0.86	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.6	-10.6	-176	49.5	0	0	0	0	115.3
531	T	54.9	Low	78.2	Confident	117 Å²	117	53.3 Å²	53.3	72%	0.718	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.5	4.6	173.8	45.3	0	0	0	0	114	T529	T529-T531 PolarHBondContact O-N 3.44Å
532	A	54	Low	78.2	Confident	0 Å²	0	51.2 Å²	51.2	0%	0	31%	0.306	C	S	.	.			trans	-93.7	-2.3	-173.4	0	0	0	0	0	115.8	T529 M534 W535 A536	T529-A532 HydrophobicContact CG2-CB 3.68Å; T529-A532 WeakPolarHBondContact O-CB 3.33Å; T529-A532 PolarHBondContact O-N 2.8Å; A532-M534 PolarHBondContact O-N 3.23Å; A532-W535 HydrophobicContact CB-CD2 4.39Å; A532-W535 HydrophobicContact CB-CH2 4.4Å; A532-W535 HydrophobicContact CB-CZ2 3.62Å; A532-W535 PolarHBondContact O-N 3.37Å; A532-W535 VanDerWaalsContact O-N 3.13Å; A532-A536 HydrophobicContact CB-CB 4.1Å; A532-A536 WeakPolarHBondContact O-CB 3.47Å; A532-A536 PolarHBondContact O-N 2.97Å
533	S	55.5	Low	78.5	Confident	113 Å²	113	51.2 Å²	51.2	79%	0.79	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.8	-11.9	-173.4	52.9	0	0	0	0	116
534	M	59.8	Low	78.7	Confident	179 Å²	179	49.7 Å²	49.7	88%	0.882	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100	-18.6	179.3	-168.2	175.4	-74	0	0	114.1	A532	A532-M534 PolarHBondContact O-N 3.23Å
535	W	71.3	Confident	79.1	Confident	61 Å²	61	44.7 Å²	44.7	23%	0.231	27%	0.272	C	S	.	.	T	Hydrogen-bonded Turn	trans	-121.8	-22.4	-176	62.7	-99.9	0	0	0	114.6	Y365 E366 L525 A532 D537 K540 Y541	Y365-W535 AromaticContact CE2-CD2 3.83Å; Y365-W535 HydrophobicContact CE2-CD2 3.83Å; Y365-W535 AromaticContact CE2-CE2 3.94Å; Y365-W535 AromaticContact CE2-CE3 3.76Å; Y365-W535 HydrophobicContact CE2-CE3 3.76Å; Y365-W535 AromaticContact CE2-CH2 3.99Å; Y365-W535 HydrophobicContact CE2-CH2 3.99Å; Y365-W535 HydrophobicContact CE2-CZ2 4.04Å; Y365-W535 AromaticContact CE2-CZ3 3.84Å; Y365-W535 HydrophobicContact CE2-CZ3 3.84Å; E366-W535 HydrophobicContact CG-CE3 4.23Å; E366-W535 HydrophobicContact CG-CZ3 4.19Å; L525-W535 HydrophobicContact CD1-CH2 4.45Å; L525-W535 HydrophobicContact CD2-CH2 4.07Å; L525-W535 HydrophobicContact CD2-CZ3 3.84Å; L525-W535 HydrophobicContact CG-CH2 4.38Å; A532-W535 HydrophobicContact CB-CD2 4.39Å; A532-W535 HydrophobicContact CB-CH2 4.4Å; A532-W535 HydrophobicContact CB-CZ2 3.62Å; A532-W535 PolarHBondContact O-N 3.37Å; A532-W535 VanDerWaalsContact O-N 3.13Å; W535-D537 VanDerWaalsContact C-N 3.28Å; W535-D537 PolarHBondContact O-N 3.3Å; W535-D537 VanDerWaalsContact O-N 3.09Å; W535-K540 WeakPolarHBondContact O-CE 3.35Å; W535-K540 PolarHBondContact O-NZ 2.7Å; W535-Y541 WeakPolarHBondContact CZ3-OH 3.46Å
536	A	76.1	Confident	79.6	Confident	5 Å²	5	43 Å²	43	4%	0.041	26%	0.263	C	S	.	.			trans	-86.7	54.3	-176.2	0	0	0	0	0	112.9	L525 A526 A532 P538 Y541	L525-A536 HydrophobicContact CD2-CB 4.26Å; L525-A536 HydrophobicContact CG-CB 4.33Å; A526-A536 HydrophobicContact CB-CB 4.29Å; A532-A536 HydrophobicContact CB-CB 4.1Å; A532-A536 WeakPolarHBondContact O-CB 3.47Å; A532-A536 PolarHBondContact O-N 2.97Å; A536-P538 WeakPolarHBondContact O-CD 3.04Å; A536-Y541 HydrophobicContact CB-CE2 4.33Å
537	D	85.9	Confident	80.2	Confident	28 Å²	28	41.2 Å²	41.2	15%	0.15	25%	0.248	C	C	.	.			trans	-64.5	125.9	177.3	177.5	66.6	0	0	0	112.2	M360 W535 G539 K540 Y541	M360-D537 VanDerWaalsContact CE-OD2 3.25Å; M360-D537 WeakPolarHBondContact CE-OD2 3.38Å; W535-D537 VanDerWaalsContact C-N 3.28Å; W535-D537 PolarHBondContact O-N 3.3Å; W535-D537 VanDerWaalsContact O-N 3.09Å; D537-G539 VanDerWaalsContact C-N 3.31Å; D537-G539 PolarHBondContact O-N 2.67Å; D537-G539 WeakPolarHBondContact OD2-CA 2.97Å; D537-G539 PolarHBondContact OD2-N 2.95Å; D537-K540 PolarHBondContact O-N 3.05Å; D537-K540 PolarHBondContact OD2-N 2.72Å; D537-Y541 WeakPolarHBondContact O-CD2 3.2Å
538	P	88.1	Confident	81	Confident	3 Å²	3	37 Å²	37	2%	0.019	22%	0.219	C	C	.	.	H	α-helix	trans	-66.7	-23.1	-179.7	-24.3	36	0	0	0	115.7	T475 R519 I523 A536 Y541 A542	T475-P538 HydrophobicContact CG2-CG 4.05Å; R519-P538 HydrophobicContact CG-CB 3.66Å; I523-P538 HydrophobicContact CG1-CB 4.13Å; I523-P538 HydrophobicContact CG1-CG 4Å; A536-P538 WeakPolarHBondContact O-CD 3.04Å; P538-Y541 PolarHBondContact O-N 2.7Å; P538-A542 WeakPolarHBondContact O-CB 3.26Å; P538-A542 PolarHBondContact O-N 3.19Å
539	G	88.8	Confident	81.8	Confident	0 Å²	0	32.5 Å²	32.5	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-70.2	-41.3	177.8	0	0	0	0	0	112.5	F471 D537 Y541 A542 L543	F471-G539 VanDerWaalsContact O-CA 3.28Å; F471-G539 WeakPolarHBondContact O-CA 3.34Å; D537-G539 VanDerWaalsContact C-N 3.31Å; D537-G539 PolarHBondContact O-N 2.67Å; D537-G539 WeakPolarHBondContact OD2-CA 2.97Å; D537-G539 PolarHBondContact OD2-N 2.95Å; G539-Y541 PolarHBondContact O-N 3.33Å; G539-A542 WeakPolarHBondContact O-CB 3.38Å; G539-A542 PolarHBondContact O-N 3.42Å; G539-A542 VanDerWaalsContact O-N 3.16Å; G539-L543 PolarHBondContact O-N 3.41Å
540	K	90.6	Very high	83	Confident	1 Å²	1	30.2 Å²	30.2	0%	0.004	18%	0.177	C	C	.	.	H	α-helix	trans	-53.9	-47.9	168.4	169.2	169.1	55.2	172.4	0	112	M360 E361 E366 F370 W535 D537 L543 I544 Y573	M360-K540 HydrophobicContact SD-CB 4.26Å; E361-K540 PolarHBondContact O-NZ 3.37Å; E366-K540 VanDerWaalsContact CD-NZ 3.27Å; E366-K540 IonicContact OE1-NZ 3.01Å; E366-K540 PolarHBondContact OE1-NZ 3.49Å; E366-K540 WeakPolarHBondContact OE2-CE 3.48Å; E366-K540 IonicContact OE2-NZ 3.07Å; E366-K540 PolarHBondContact OE2-NZ 3.12Å; F370-K540 HydrophobicContact CZ-CD 4.32Å; F370-K540 HydrophobicContact CZ-CG 4.41Å; W535-K540 WeakPolarHBondContact O-CE 3.35Å; W535-K540 PolarHBondContact O-NZ 2.7Å; D537-K540 PolarHBondContact O-N 3.05Å; D537-K540 PolarHBondContact OD2-N 2.72Å; K540-L543 PolarHBondContact O-N 2.95Å; K540-I544 WeakPolarHBondContact O-CG1 3.32Å; K540-I544 PolarHBondContact O-N 3.09Å; K540-Y573 HydrophobicContact CG-CE1 4.27Å; K540-Y573 WeakPolarHBondContact CG-OH 3.5Å
541	Y	93.2	Very high	84.8	Confident	3 Å²	3	24.4 Å²	24.4	1%	0.012	14%	0.136	C	C	.	.	H	α-helix	trans	-71.4	-30.1	177	-62.2	-68.3	0	0	0	113.2	E366 F370 M373 G518 L525 W535 A536 D537 P538 G539 I544 G545	E366-Y541 PolarHBondContact OE2-OH 3.38Å; F370-Y541 HydrophobicContact CD1-CD1 4.31Å; F370-Y541 HydrophobicContact CD1-CE1 4.12Å; F370-Y541 AromaticContact CE1-CD1 3.86Å; F370-Y541 HydrophobicContact CE1-CD1 3.86Å; F370-Y541 AromaticContact CE1-CE1 3.49Å; F370-Y541 HydrophobicContact CE1-CE1 3.49Å; F370-Y541 VanDerWaalsContact CE1-CE1 3.49Å; F370-Y541 HydrophobicContact CZ-CE1 4.43Å; M373-Y541 WeakPolarHBondContact CE-O 3.39Å; M373-Y541 HydrophobicContact SD-CD1 3.8Å; G518-Y541 CarbonylContact C-O 3.35Å; G518-Y541 WeakPolarHBondContact CA-O 3.31Å; G518-Y541 VanDerWaalsContact O-CB 3.27Å; G518-Y541 WeakPolarHBondContact O-CB 3.31Å; L525-Y541 HydrophobicContact CD2-CE1 4.29Å; L525-Y541 HydrophobicContact CD2-CE2 3.86Å; W535-Y541 WeakPolarHBondContact CZ3-OH 3.46Å; A536-Y541 HydrophobicContact CB-CE2 4.33Å; D537-Y541 WeakPolarHBondContact O-CD2 3.2Å; P538-Y541 PolarHBondContact O-N 2.7Å; G539-Y541 PolarHBondContact O-N 3.33Å; Y541-I544 PolarHBondContact O-N 2.99Å; Y541-G545 PolarHBondContact O-N 3.26Å
542	A	94.7	Very high	86.8	Confident	0 Å²	0	18.8 Å²	18.8	0%	0	10%	0.102	C	C	.	.	H	α-helix	trans	-60.8	-45.6	172	0	0	0	0	0	111.8	F471 A515 R519 P538 G539 I544 G545 A546	F471-A542 HydrophobicContact CD1-CB 3.79Å; F471-A542 HydrophobicContact CE1-CB 4.18Å; A515-A542 WeakPolarHBondContact CA-O 3.5Å; A515-A542 HydrophobicContact CB-CB 4.48Å; R519-A542 HydrophobicContact CB-CB 3.86Å; R519-A542 HydrophobicContact CG-CB 4.5Å; P538-A542 WeakPolarHBondContact O-CB 3.26Å; P538-A542 PolarHBondContact O-N 3.19Å; G539-A542 WeakPolarHBondContact O-CB 3.38Å; G539-A542 PolarHBondContact O-N 3.42Å; G539-A542 VanDerWaalsContact O-N 3.16Å; A542-I544 PolarHBondContact O-N 2.85Å; A542-G545 PolarHBondContact O-N 3.22Å; A542-A546 WeakPolarHBondContact O-CB 3.45Å; A542-A546 PolarHBondContact O-N 2.83Å
543	L	94.6	Very high	88.8	Confident	0 Å²	0	18.8 Å²	18.8	0%	0	10%	0.102	C	C	.	.	H	α-helix	trans	-59.9	-44.5	175.9	176.8	62.9	0	0	0	111.9	F355 F471 G539 K540 A546 A547 M564 T568 Y573	F355-L543 HydrophobicContact CD1-CD2 4.13Å; F355-L543 HydrophobicContact CE1-CB 4.45Å; F355-L543 HydrophobicContact CE1-CD2 4.05Å; F471-L543 HydrophobicContact CE1-CB 4.38Å; F471-L543 HydrophobicContact CE2-CD1 4.37Å; F471-L543 HydrophobicContact CZ-CD1 4.18Å; G539-L543 PolarHBondContact O-N 3.41Å; K540-L543 PolarHBondContact O-N 2.95Å; L543-A546 PolarHBondContact O-N 3.34Å; L543-A547 PolarHBondContact O-N 3.47Å; L543-M564 HydrophobicContact CD1-CE 3.68Å; L543-T568 HydrophobicContact CD1-CG2 3.66Å; L543-T568 HydrophobicContact CD2-CG2 3.86Å; L543-T568 HydrophobicContact CG-CG2 4.43Å; L543-Y573 HydrophobicContact CD2-CD1 3.92Å; L543-Y573 HydrophobicContact CD2-CE1 4Å; L543-Y573 HydrophobicContact CD2-CG 4.29Å
544	I	95.9	Very high	90.6	Very high	0 Å²	0	13.7 Å²	13.7	0%	0	7%	0.066	C	C	.	.	H	α-helix	trans	-66	-42.3	178.1	-65.7	-67.8	0	0	0	111.8	F370 M373 K540 Y541 A542 A547 A548 P576 I577 V580	F370-I544 HydrophobicContact CB-CG2 4.23Å; F370-I544 HydrophobicContact CD1-CB 4.29Å; F370-I544 HydrophobicContact CD1-CD1 4.29Å; F370-I544 HydrophobicContact CD1-CG1 3.83Å; F370-I544 HydrophobicContact CD1-CG2 3.89Å; F370-I544 HydrophobicContact CE1-CG1 3.88Å; F370-I544 HydrophobicContact CG-CD1 4.35Å; F370-I544 HydrophobicContact CG-CG1 4.39Å; F370-I544 HydrophobicContact CG-CG2 4.34Å; M373-I544 HydrophobicContact CB-CG2 4.2Å; M373-I544 HydrophobicContact CE-CG2 4.23Å; M373-I544 HydrophobicContact SD-CG2 4.04Å; K540-I544 WeakPolarHBondContact O-CG1 3.32Å; K540-I544 PolarHBondContact O-N 3.09Å; Y541-I544 PolarHBondContact O-N 2.99Å; A542-I544 PolarHBondContact O-N 2.85Å; I544-A547 PolarHBondContact O-N 3.46Å; I544-A548 WeakPolarHBondContact O-CB 3.41Å; I544-A548 PolarHBondContact O-N 3.04Å; I544-P576 HydrophobicContact CD1-CB 3.83Å; I544-I577 HydrophobicContact CD1-CG1 4.39Å; I544-V580 HydrophobicContact CD1-CG2 4.29Å; I544-V580 HydrophobicContact CG2-CG1 4.31Å; I544-V580 HydrophobicContact CG2-CG2 3.69Å
545	G	97.1	Very high	92.2	Very high	0 Å²	0	5.9 Å²	5.9	0%	0	3%	0.027	C	C	.	.	H	α-helix	trans	-63.8	-39.3	174.6	0	0	0	0	0	112.8	G514 Y541 A542 A548 Q549	G514-G545 VanDerWaalsContact CA-C 3.47Å; G514-G545 VanDerWaalsContact CA-O 3.25Å; G514-G545 WeakPolarHBondContact CA-O 3.21Å; G514-G545 CarbonylContact O-C 3.55Å; G514-G545 WeakPolarHBondContact O-CA 3.21Å; Y541-G545 PolarHBondContact O-N 3.26Å; A542-G545 PolarHBondContact O-N 3.22Å; G545-A548 PolarHBondContact O-N 2.83Å; G545-Q549 WeakPolarHBondContact O-CB 3.29Å; G545-Q549 PolarHBondContact O-N 3.03Å
546	A	96.8	Very high	93.1	Very high	0 Å²	0	3.3 Å²	3.3	0%	0	2%	0.017	C	C	.	.	H	α-helix	trans	-60.3	-45.8	174.8	0	0	0	0	0	111.9	F471 L511 G514 A515 A542 L543 L550	F471-A546 HydrophobicContact CE1-CB 3.97Å; F471-A546 HydrophobicContact CZ-CB 3.85Å; L511-A546 HydrophobicContact CD2-CB 3.88Å; G514-A546 VanDerWaalsContact C-N 3.28Å; G514-A546 PolarHBondContact O-N 3.43Å; A515-A546 HydrophobicContact CB-CB 4.31Å; A542-A546 WeakPolarHBondContact O-CB 3.45Å; A542-A546 PolarHBondContact O-N 2.83Å; L543-A546 PolarHBondContact O-N 3.34Å; A546-L550 WeakPolarHBondContact O-CB 3.36Å; A546-L550 PolarHBondContact O-N 2.83Å; A546-L550 VanDerWaalsContact O-N 3.14Å
547	A	96.9	Very high	93.7	Very high	0 Å²	0	4.9 Å²	4.9	0%	0	3%	0.027	C	C	.	.	H	α-helix	trans	-62	-48.7	173	0	0	0	0	0	111.9	L543 I544 Q549 L550 G551 M564 I577 V580 L581	L543-A547 PolarHBondContact O-N 3.47Å; I544-A547 PolarHBondContact O-N 3.46Å; A547-Q549 PolarHBondContact O-N 3.19Å; A547-L550 PolarHBondContact O-N 3.17Å; A547-G551 PolarHBondContact O-N 3.41Å; A547-M564 HydrophobicContact CB-CE 4.4Å; A547-I577 HydrophobicContact CB-CG2 4.35Å; A547-V580 HydrophobicContact CB-CG1 4.32Å; A547-L581 HydrophobicContact CB-CD2 4.44Å; A547-L581 VanDerWaalsContact O-CD2 3.22Å; A547-L581 WeakPolarHBondContact O-CD2 3.35Å
548	A	97.7	Very high	94	Very high	0 Å²	0	8.8 Å²	8.8	0%	0	5%	0.047	C	C	.	.	H	α-helix	trans	-57.9	-46.2	-179	0	0	0	0	0	112.7	W517 I544 G545 G552 V580	W517-A548 HydrophobicContact CH2-CB 3.86Å; W517-A548 HydrophobicContact CZ2-CB 3.87Å; I544-A548 WeakPolarHBondContact O-CB 3.41Å; I544-A548 PolarHBondContact O-N 3.04Å; G545-A548 PolarHBondContact O-N 2.83Å; A548-G552 PolarHBondContact O-N 3.34Å; A548-V580 HydrophobicContact CB-CG1 3.56Å
549	Q	97.7	Very high	94.3	Very high	0 Å²	0	8.7 Å²	8.7	0%	0	5%	0.046	C	C	.	.	H	α-helix	trans	-69	-42.8	-179.5	-170.4	66.5	36.5	0	0	112.1	S510 I513 G545 A547 G552 I553	S510-Q549 WeakPolarHBondContact O-CG 3.49Å; I513-Q549 HydrophobicContact CB-CG 4.15Å; I513-Q549 HydrophobicContact CG2-CG 3.84Å; G545-Q549 WeakPolarHBondContact O-CB 3.29Å; G545-Q549 PolarHBondContact O-N 3.03Å; A547-Q549 PolarHBondContact O-N 3.19Å; Q549-G552 PolarHBondContact O-N 2.75Å; Q549-I553 HydrophobicContact CG-CD1 4.26Å; Q549-I553 WeakPolarHBondContact O-CG1 3.44Å; Q549-I553 PolarHBondContact O-N 3.17Å; Q549-I553 VanDerWaalsContact O-N 3.13Å
550	L	96.3	Very high	94.5	Very high	1 Å²	1	8.8 Å²	8.8	1%	0.005	5%	0.047	C	C	.	.	H	α-helix	trans	-66.9	-44.4	178.8	178.9	59.6	0	0	0	111.3	F507 L511 A546 A547 I553 V554 L560	F507-L550 HydrophobicContact CD1-CD1 3.7Å; F507-L550 HydrophobicContact CD1-CD2 3.69Å; F507-L550 HydrophobicContact CD1-CG 4.29Å; F507-L550 HydrophobicContact CE1-CD1 4.1Å; F507-L550 HydrophobicContact CE1-CD2 4.04Å; F507-L550 HydrophobicContact CG-CD1 4.19Å; L511-L550 HydrophobicContact CD1-CD2 4.4Å; L511-L550 HydrophobicContact CD2-CB 4.27Å; L511-L550 HydrophobicContact CD2-CD2 3.72Å; L511-L550 HydrophobicContact CG-CD2 3.94Å; A546-L550 WeakPolarHBondContact O-CB 3.36Å; A546-L550 PolarHBondContact O-N 2.83Å; A546-L550 VanDerWaalsContact O-N 3.14Å; A547-L550 PolarHBondContact O-N 3.17Å; L550-I553 PolarHBondContact O-N 3.38Å; L550-V554 HydrophobicContact CD1-CB 4.5Å; L550-V554 HydrophobicContact CD1-CG2 3.79Å; L550-V554 WeakPolarHBondContact O-CB 3.45Å; L550-V554 PolarHBondContact O-N 2.86Å; L550-L560 HydrophobicContact CD2-CD1 3.6Å; L550-L560 HydrophobicContact CD2-CD2 4.07Å; L550-L560 HydrophobicContact CD2-CG 4.49Å; L550-L560 HydrophobicContact CG-CD1 4.32Å; L550-L560 HydrophobicContact CG-CD2 3.88Å
551	G	95.5	Very high	94.8	Very high	1 Å²	1	9.5 Å²	9.5	1%	0.01	5%	0.051	C	C	.	.	H	α-helix	trans	-60	-45.6	172.7	0	0	0	0	0	112.5	A547 I553 V554 R555	A547-G551 PolarHBondContact O-N 3.41Å; G551-I553 VanDerWaalsContact C-N 3.29Å; G551-I553 PolarHBondContact O-N 2.98Å; G551-V554 PolarHBondContact O-N 3.23Å; G551-R555 WeakPolarHBondContact O-CA 3.25Å; G551-R555 WeakPolarHBondContact O-CD 3.26Å; G551-R555 PolarHBondContact O-N 3.13Å
552	G	96.4	Very high	94.9	Very high	0 Å²	0	11.2 Å²	11.2	0%	0	6%	0.062	C	C	.	.	H	α-helix	trans	-62.4	-29.1	178.7	0	0	0	0	0	114.7	G381 A548 Q549 R555	G381-G552 CarbonylContact C-O 3.25Å; G381-G552 WeakPolarHBondContact CA-O 3.4Å; A548-G552 PolarHBondContact O-N 3.34Å; Q549-G552 PolarHBondContact O-N 2.75Å; G552-R555 PolarHBondContact O-NE 3.29Å; G552-R555 PolarHBondContact O-NH2 3.49Å; G552-R555 VanDerWaalsContact O-NH2 3.07Å
553	I	96.6	Very high	94.9	Very high	0 Å²	0	11.6 Å²	11.6	0%	0	6%	0.064	C	C	.	.	H	α-helix	trans	-85.4	-47.4	175.8	-70	171.8	0	0	0	111.5	F384 N385 S510 Q549 L550 G551 L595	F384-I553 HydrophobicContact CB-CD1 4.2Å; F384-I553 HydrophobicContact CB-CG1 4.13Å; F384-I553 HydrophobicContact CD1-CD1 3.69Å; F384-I553 HydrophobicContact CD1-CG1 3.86Å; F384-I553 HydrophobicContact CD1-CG2 4.01Å; F384-I553 HydrophobicContact CD2-CD1 4.21Å; F384-I553 HydrophobicContact CE1-CD1 4.05Å; F384-I553 HydrophobicContact CE1-CG2 4.16Å; F384-I553 HydrophobicContact CG-CD1 3.78Å; F384-I553 HydrophobicContact CG-CG1 4.11Å; F384-I553 HydrophobicContact CZ-CD1 4.45Å; N385-I553 PolarHBondContact ND2-O 3.26Å; S510-I553 WeakPolarHBondContact OG-CD1 3.48Å; Q549-I553 HydrophobicContact CG-CD1 4.26Å; Q549-I553 WeakPolarHBondContact O-CG1 3.44Å; Q549-I553 PolarHBondContact O-N 3.17Å; Q549-I553 VanDerWaalsContact O-N 3.13Å; L550-I553 PolarHBondContact O-N 3.38Å; G551-I553 VanDerWaalsContact C-N 3.29Å; G551-I553 PolarHBondContact O-N 2.98Å; I553-L595 HydrophobicContact CG2-CB 3.98Å; I553-L595 HydrophobicContact CG2-CD2 3.82Å; I553-L595 HydrophobicContact CG2-CG 4.49Å; I553-L595 PolarHBondContact O-N 3.37Å
554	V	93.6	Very high	94.9	Very high	6 Å²	6	11.7 Å²	11.7	4%	0.036	6%	0.064	C	C	.	.	H	α-helix	trans	-97	-27.8	-165.6	176.8	0	0	0	0	114.1	L550 G551 M556 Y596	L550-V554 HydrophobicContact CD1-CB 4.5Å; L550-V554 HydrophobicContact CD1-CG2 3.79Å; L550-V554 WeakPolarHBondContact O-CB 3.45Å; L550-V554 PolarHBondContact O-N 2.86Å; G551-V554 PolarHBondContact O-N 3.23Å; V554-M556 VanDerWaalsContact C-N 3.29Å; V554-M556 HydrophobicContact CG1-CB 4.33Å; V554-M556 HydrophobicContact CG1-CE 4.1Å; V554-M556 HydrophobicContact CG1-CG 3.92Å; V554-M556 HydrophobicContact CG1-SD 3.48Å; V554-M556 WeakPolarHBondContact CG1-SD 3.4Å; V554-M556 PolarHBondContact O-N 3.43Å; V554-Y596 HydrophobicContact CB-CE2 4.5Å; V554-Y596 HydrophobicContact CG1-CD2 3.93Å; V554-Y596 HydrophobicContact CG1-CE2 3.49Å; V554-Y596 VanDerWaalsContact CG1-CE2 3.49Å; V554-Y596 HydrophobicContact CG2-CE2 4.26Å
555	R	93.4	Very high	94.8	Very high	14 Å²	14	12.7 Å²	12.7	5%	0.053	7%	0.071	C	C	.	.			trans	66.1	11.4	178.6	-49	-62.5	168.6	70.3	8.8	117.7	G551 G552 G588 D589 Q592	G551-R555 WeakPolarHBondContact O-CA 3.25Å; G551-R555 WeakPolarHBondContact O-CD 3.26Å; G551-R555 PolarHBondContact O-N 3.13Å; G552-R555 PolarHBondContact O-NE 3.29Å; G552-R555 PolarHBondContact O-NH2 3.49Å; G552-R555 VanDerWaalsContact O-NH2 3.07Å; R555-G588 PolarHBondContact NH1-O 2.03Å; R555-G588 PolarHBondContact NH2-O 2.89Å; R555-D589 WeakPolarHBondContact CD-OD1 3.34Å; R555-D589 IonicContact CZ-OD1 2.66Å; R555-D589 IonicContact NE-OD1 3.89Å; R555-D589 VanDerWaalsContact NH1-N 3.12Å; R555-D589 IonicContact NH1-OD1 3.76Å; R555-D589 PolarHBondContact NH1-OD1 2.95Å; R555-Q592 VanDerWaalsContact CZ-O 3.29Å; R555-Q592 PolarHBondContact NH1-O 3.16Å; R555-Q592 PolarHBondContact NH2-O 3.29Å
556	M	89.1	Confident	94.6	Very high	7 Å²	7	15.4 Å²	15.4	3%	0.034	8%	0.083	C	C	.	.			trans	-72.5	141.3	164.8	-71.5	159.6	-178.6	0	0	110.3	F302 E306 F507 V554 L560 Y596	F302-M556 HydrophobicContact CD2-CE 4.18Å; F302-M556 HydrophobicContact CD2-SD 4.18Å; F302-M556 HydrophobicContact CE2-CE 3.61Å; F302-M556 HydrophobicContact CE2-SD 4.05Å; E306-M556 HydrophobicContact CG-CE 4.13Å; E306-M556 WeakPolarHBondContact OE1-CE 3.44Å; F507-M556 HydrophobicContact CZ-SD 4.42Å; V554-M556 VanDerWaalsContact C-N 3.29Å; V554-M556 HydrophobicContact CG1-CB 4.33Å; V554-M556 HydrophobicContact CG1-CE 4.1Å; V554-M556 HydrophobicContact CG1-CG 3.92Å; V554-M556 HydrophobicContact CG1-SD 3.48Å; V554-M556 WeakPolarHBondContact CG1-SD 3.4Å; V554-M556 PolarHBondContact O-N 3.43Å; M556-L560 HydrophobicContact CB-CB 4.08Å; M556-Y596 HydrophobicContact CE-CD2 4.05Å; M556-Y596 HydrophobicContact CE-CE2 4.11Å
557	T	89.8	Confident	94.4	Very high	38 Å²	38	16.1 Å²	16.1	23%	0.233	9%	0.089	C	C	.	.			trans	-124.4	-61.1	-177.8	53.2	0	0	0	0	113	E305 T561 K585	E305-T557 PolarHBondContact OE1-N 3.38Å; T557-T561 WeakPolarHBondContact O-CB 3.22Å; T557-T561 PolarHBondContact O-N 3.27Å; T557-T561 PolarHBondContact O-OG1 3.44Å; T557-K585 HydrophobicContact CG2-CB 4.19Å; T557-K585 HydrophobicContact CG2-CD 3.61Å
558	L	91.9	Very high	94.1	Very high	110 Å²	110	16.2 Å²	16.2	58%	0.576	9%	0.09	S	C	*	.	H	α-helix	trans	-71.4	-54.3	-171	-66.2	178.6	0	0	0	111.6	L560 T561 V562	L558-L560 VanDerWaalsContact C-N 3.33Å; L558-L560 PolarHBondContact O-N 3.02Å; L558-T561 PolarHBondContact O-N 2.86Å; L558-V562 PolarHBondContact O-N 3.16Å
559	S	92.9	Very high	93.6	Very high	1 Å²	1	19 Å²	19	1%	0.007	12%	0.118	C	C	.	.	H	α-helix	trans	-56.7	-46.2	173.5	53.4	0	0	0	0	111.9	E305 T561 V562 I563	E305-S559 WeakPolarHBondContact OE2-CB 3.37Å; E305-S559 PolarHBondContact OE2-N 3.01Å; E305-S559 PolarHBondContact OE2-OG 3.39Å; S559-T561 PolarHBondContact O-N 3.08Å; S559-V562 PolarHBondContact O-N 3.04Å; S559-I563 VanDerWaalsContact O-CG1 3.26Å; S559-I563 WeakPolarHBondContact O-CG1 3.19Å; S559-I563 PolarHBondContact O-N 2.91Å
560	L	94.1	Very high	93.2	Very high	3 Å²	3	20.6 Å²	20.6	2%	0.016	13%	0.127	C	C	.	.	H	α-helix	trans	-66	-37.3	-178.2	-177.9	55.9	0	0	0	113	L550 M556 L558 V562 I563 M564 L581	L550-L560 HydrophobicContact CD2-CD1 3.6Å; L550-L560 HydrophobicContact CD2-CD2 4.07Å; L550-L560 HydrophobicContact CD2-CG 4.49Å; L550-L560 HydrophobicContact CG-CD1 4.32Å; L550-L560 HydrophobicContact CG-CD2 3.88Å; M556-L560 HydrophobicContact CB-CB 4.08Å; L558-L560 VanDerWaalsContact C-N 3.33Å; L558-L560 PolarHBondContact O-N 3.02Å; L560-V562 VanDerWaalsContact C-N 3.32Å; L560-V562 PolarHBondContact O-N 3.45Å; L560-I563 PolarHBondContact O-N 2.9Å; L560-M564 HydrophobicContact CD1-CG 4.06Å; L560-M564 HydrophobicContact CD1-SD 4.48Å; L560-M564 VanDerWaalsContact O-CG 3.31Å; L560-M564 WeakPolarHBondContact O-CG 3.27Å; L560-M564 PolarHBondContact O-N 3.38Å; L560-L581 HydrophobicContact CB-CD1 4.19Å; L560-L581 HydrophobicContact CD2-CD1 4.25Å; L560-L581 HydrophobicContact CD2-CD2 3.65Å; L560-L581 HydrophobicContact CG-CD1 3.91Å; L560-L581 HydrophobicContact CG-CD2 4.2Å
561	T	95.8	Very high	92.9	Very high	15 Å²	15	26 Å²	26	9%	0.092	16%	0.16	C	C	.	.	H	α-helix	trans	-57.8	-48	173.4	-58.2	0	0	0	0	110.3	T557 L558 S559 M564 V565 I577 M578 L581	T557-T561 WeakPolarHBondContact O-CB 3.22Å; T557-T561 PolarHBondContact O-N 3.27Å; T557-T561 PolarHBondContact O-OG1 3.44Å; L558-T561 PolarHBondContact O-N 2.86Å; S559-T561 PolarHBondContact O-N 3.08Å; T561-M564 PolarHBondContact O-N 3.38Å; T561-V565 WeakPolarHBondContact O-CG2 3.32Å; T561-V565 PolarHBondContact O-N 3.06Å; T561-I577 HydrophobicContact CG2-CG2 4.21Å; T561-M578 HydrophobicContact CG2-CB 4Å; T561-L581 WeakPolarHBondContact OG1-CD1 3.45Å
562	V	96.1	Very high	92.7	Very high	40 Å²	40	30.4 Å²	30.4	24%	0.242	19%	0.187	C	C	.	.	H	α-helix	trans	-70.5	-37.8	-178.2	178.5	0	0	0	0	111.8	V297 L301 L558 S559 L560 M564 V565 E566	V297-V562 HydrophobicContact CB-CG1 4.03Å; V297-V562 HydrophobicContact CG1-CG1 4.06Å; L301-V562 HydrophobicContact CD1-CB 3.92Å; L301-V562 HydrophobicContact CD1-CG1 4.14Å; L301-V562 HydrophobicContact CD1-CG2 3.59Å; L558-V562 PolarHBondContact O-N 3.16Å; S559-V562 PolarHBondContact O-N 3.04Å; L560-V562 VanDerWaalsContact C-N 3.32Å; L560-V562 PolarHBondContact O-N 3.45Å; V562-M564 VanDerWaalsContact C-N 3.35Å; V562-M564 PolarHBondContact O-N 2.82Å; V562-V565 PolarHBondContact O-N 3.35Å; V562-E566 HydrophobicContact CG1-CG 4.31Å; V562-E566 PolarHBondContact O-N 3.38Å
563	I	95.1	Very high	92.4	Very high	7 Å²	7	30.5 Å²	30.5	4%	0.036	19%	0.187	C	C	.	.	H	α-helix	trans	-57.2	-47	172.6	-69.1	166.5	0	0	0	111.1	V289 F293 A295 S559 L560 A567	V289-I563 HydrophobicContact CG1-CD1 3.71Å; V289-I563 HydrophobicContact CG1-CG1 4.21Å; F293-I563 HydrophobicContact CB-CG2 3.71Å; F293-I563 HydrophobicContact CD1-CG2 4.16Å; F293-I563 HydrophobicContact CD2-CG2 4.12Å; F293-I563 HydrophobicContact CG-CG2 3.73Å; A295-I563 HydrophobicContact CB-CB 4.28Å; A295-I563 HydrophobicContact CB-CG1 4.14Å; A295-I563 HydrophobicContact CB-CG2 4.23Å; S559-I563 VanDerWaalsContact O-CG1 3.26Å; S559-I563 WeakPolarHBondContact O-CG1 3.19Å; S559-I563 PolarHBondContact O-N 2.91Å; L560-I563 PolarHBondContact O-N 2.9Å; I563-A567 WeakPolarHBondContact O-CB 3.23Å; I563-A567 PolarHBondContact O-N 3.01Å
564	M	94.2	Very high	92.2	Very high	2 Å²	2	31.3 Å²	31.3	1%	0.01	20%	0.195	C	C	.	.	H	α-helix	trans	-68.2	-34	179.5	-64.3	-64.8	-66	0	0	112.3	F352 L511 L543 A547 L560 T561 V562 T568 I577	F352-M564 HydrophobicContact CE2-CE 3.93Å; F352-M564 HydrophobicContact CE2-SD 3.79Å; F352-M564 HydrophobicContact CZ-CE 4.26Å; F352-M564 HydrophobicContact CZ-SD 4.04Å; L511-M564 HydrophobicContact CD2-CE 4.14Å; L511-M564 HydrophobicContact CD2-SD 4.09Å; L543-M564 HydrophobicContact CD1-CE 3.68Å; A547-M564 HydrophobicContact CB-CE 4.4Å; L560-M564 HydrophobicContact CD1-CG 4.06Å; L560-M564 HydrophobicContact CD1-SD 4.48Å; L560-M564 VanDerWaalsContact O-CG 3.31Å; L560-M564 WeakPolarHBondContact O-CG 3.27Å; L560-M564 PolarHBondContact O-N 3.38Å; T561-M564 PolarHBondContact O-N 3.38Å; V562-M564 VanDerWaalsContact C-N 3.35Å; V562-M564 PolarHBondContact O-N 2.82Å; M564-T568 WeakPolarHBondContact O-CB 3.31Å; M564-T568 VanDerWaalsContact O-CG2 3.23Å; M564-T568 WeakPolarHBondContact O-CG2 3.21Å; M564-T568 PolarHBondContact O-N 3.5Å; M564-T568 VanDerWaalsContact O-N 3.17Å; M564-T568 PolarHBondContact O-OG1 2.73Å; M564-I577 HydrophobicContact CB-CD1 3.99Å; M564-I577 HydrophobicContact CB-CG2 4.14Å
565	V	93.8	Very high	92.2	Very high	22 Å²	22	34.9 Å²	34.9	13%	0.133	21%	0.213	C	C	.	.	H	α-helix	trans	-69.8	-46.7	175.9	165.6	0	0	0	0	112	T561 V562 T568 G569 V571 G574	T561-V565 WeakPolarHBondContact O-CG2 3.32Å; T561-V565 PolarHBondContact O-N 3.06Å; V562-V565 PolarHBondContact O-N 3.35Å; V565-T568 PolarHBondContact O-N 3.12Å; V565-T568 PolarHBondContact O-OG1 2.98Å; V565-G569 PolarHBondContact O-N 3.08Å; V565-V571 HydrophobicContact CG1-CB 4.39Å; V565-V571 HydrophobicContact CG1-CG2 4.18Å; V565-G574 VanDerWaalsContact CG2-CA 3.48Å
566	E	93.5	Very high	92.2	Very high	57 Å²	57	34.2 Å²	34.2	27%	0.266	21%	0.211	S	C	.	.	H	α-helix	trans	-62.9	-44.2	176.3	-75.2	-177.9	-73.1	0	0	111.3	A295 P296 V297 G298 V562 T568 G569	A295-E566 VanDerWaalsContact C-OE1 3.28Å; A295-E566 WeakPolarHBondContact CA-OE1 3.33Å; A295-E566 HydrophobicContact CB-CB 3.74Å; A295-E566 HydrophobicContact CB-CG 4.43Å; A295-E566 WeakPolarHBondContact CB-OE1 3.38Å; P296-E566 WeakPolarHBondContact CD-OE2 3.33Å; P296-E566 WeakPolarHBondContact CG-OE2 3.5Å; V297-E566 WeakPolarHBondContact CG2-OE2 3.38Å; V297-E566 PolarHBondContact N-OE1 3.37Å; V297-E566 VanDerWaalsContact N-OE1 3.11Å; V297-E566 PolarHBondContact N-OE2 2.68Å; G298-E566 PolarHBondContact N-OE1 2.89Å; V562-E566 HydrophobicContact CG1-CG 4.31Å; V562-E566 PolarHBondContact O-N 3.38Å; E566-T568 VanDerWaalsContact C-N 3.32Å; E566-T568 PolarHBondContact O-N 3.5Å; E566-G569 PolarHBondContact O-N 3.14Å
567	A	91.3	Very high	92.5	Very high	14 Å²	14	33.9 Å²	33.9	12%	0.116	21%	0.209	C	C	.	.	H	α-helix	trans	-73.7	-17.5	-177	0	0	0	0	0	114.6	F352 I563	F352-A567 HydrophobicContact CD2-CB 3.46Å; F352-A567 VanDerWaalsContact CD2-CB 3.46Å; F352-A567 HydrophobicContact CE2-CB 3.55Å; F352-A567 HydrophobicContact CG-CB 4.4Å; I563-A567 WeakPolarHBondContact O-CB 3.23Å; I563-A567 PolarHBondContact O-N 3.01Å
568	T	90.8	Very high	92.8	Very high	3 Å²	3	36.2 Å²	36.2	2%	0.018	22%	0.218	C	C	.	.	H	α-helix	trans	-95.8	-15.8	171.8	53.4	0	0	0	0	113.1	F352 F355 L543 M564 V565 E566 N570	F352-T568 HydrophobicContact CD2-CG2 4.04Å; F355-T568 HydrophobicContact CD2-CG2 3.82Å; F355-T568 HydrophobicContact CE2-CG2 3.71Å; F355-T568 HydrophobicContact CG-CG2 4.46Å; F355-T568 HydrophobicContact CZ-CG2 4.25Å; L543-T568 HydrophobicContact CD1-CG2 3.66Å; L543-T568 HydrophobicContact CD2-CG2 3.86Å; L543-T568 HydrophobicContact CG-CG2 4.43Å; M564-T568 WeakPolarHBondContact O-CB 3.31Å; M564-T568 VanDerWaalsContact O-CG2 3.23Å; M564-T568 WeakPolarHBondContact O-CG2 3.21Å; M564-T568 PolarHBondContact O-N 3.5Å; M564-T568 VanDerWaalsContact O-N 3.17Å; M564-T568 PolarHBondContact O-OG1 2.73Å; V565-T568 PolarHBondContact O-N 3.12Å; V565-T568 PolarHBondContact O-OG1 2.98Å; E566-T568 VanDerWaalsContact C-N 3.32Å; E566-T568 PolarHBondContact O-N 3.5Å; T568-N570 PolarHBondContact O-N 3.34Å
569	G	88.1	Confident	93.1	Very high	58 Å²	58	33.2 Å²	33.2	60%	0.598	20%	0.203	S	C	*	.			trans	72.1	-1.2	-176.5	0	0	0	0	0	115.3	V565 E566	V565-G569 PolarHBondContact O-N 3.08Å; E566-G569 PolarHBondContact O-N 3.14Å
570	N	89.1	Confident	93.3	Very high	33 Å²	33	33.1 Å²	33.1	18%	0.176	20%	0.202	C	C	.	.			trans	-116.6	103.8	-171.9	-171.9	-27.4	0	0	0	111.5	F355 T568 T572 Y573	F355-N570 HydrophobicContact CB-CB 4.37Å; F355-N570 PolarHBondContact O-ND2 3.31Å; T568-N570 PolarHBondContact O-N 3.34Å; N570-T572 VanDerWaalsContact C-N 3.27Å; N570-T572 PolarHBondContact O-N 3.06Å; N570-T572 VanDerWaalsContact OD1-CB 3.26Å; N570-T572 WeakPolarHBondContact OD1-CB 3.39Å; N570-T572 PolarHBondContact OD1-N 2.82Å; N570-T572 VanDerWaalsContact OD1-N 3.08Å; N570-T572 PolarHBondContact OD1-OG1 2.91Å; N570-Y573 HydrophobicContact CB-CD2 4.11Å; N570-Y573 PolarHBondContact O-N 2.92Å
571	V	89.9	Confident	93.4	Very high	116 Å²	116	33 Å²	33	70%	0.703	20%	0.202	S	C	*	.	G	3₁₀ helix	trans	-65.5	-27.8	-177.1	-175.8	0	0	0	0	112.9	V565 Y573 G574	V565-V571 HydrophobicContact CG1-CB 4.39Å; V565-V571 HydrophobicContact CG1-CG2 4.18Å; V571-Y573 PolarHBondContact O-N 2.91Å; V571-G574 PolarHBondContact O-N 2.91Å
572	T	90.6	Very high	93.4	Very high	93 Å²	93	37.5 Å²	37.5	57%	0.571	22%	0.223	S	C	*	.	G	3₁₀ helix	trans	-61	-34.3	-179.1	-41.9	0	0	0	0	111.4	Y362 N570 G574	Y362-T572 HydrophobicContact CE1-CG2 3.9Å; Y362-T572 WeakPolarHBondContact CE1-O 3.44Å; Y362-T572 PolarHBondContact OH-O 3.41Å; N570-T572 VanDerWaalsContact C-N 3.27Å; N570-T572 PolarHBondContact O-N 3.06Å; N570-T572 VanDerWaalsContact OD1-CB 3.26Å; N570-T572 WeakPolarHBondContact OD1-CB 3.39Å; N570-T572 PolarHBondContact OD1-N 2.82Å; N570-T572 VanDerWaalsContact OD1-N 3.08Å; N570-T572 PolarHBondContact OD1-OG1 2.91Å; T572-G574 PolarHBondContact O-N 2.89Å; T572-G574 VanDerWaalsContact O-N 3.16Å
573	Y	90.6	Very high	93.5	Very high	2 Å²	2	37 Å²	37	1%	0.008	22%	0.22	C	C	.	.	G	3₁₀ helix	trans	-65.3	-12.7	175.4	-90.2	-84.2	0	0	0	114.8	M360 K540 L543 N570 V571 L575 P576 I577	M360-Y573 WeakPolarHBondContact O-CE2 3.4Å; M360-Y573 VanDerWaalsContact O-CZ 3.27Å; M360-Y573 PolarHBondContact O-OH 3.08Å; K540-Y573 HydrophobicContact CG-CE1 4.27Å; K540-Y573 WeakPolarHBondContact CG-OH 3.5Å; L543-Y573 HydrophobicContact CD2-CD1 3.92Å; L543-Y573 HydrophobicContact CD2-CE1 4Å; L543-Y573 HydrophobicContact CD2-CG 4.29Å; N570-Y573 HydrophobicContact CB-CD2 4.11Å; N570-Y573 PolarHBondContact O-N 2.92Å; V571-Y573 PolarHBondContact O-N 2.91Å; Y573-L575 VanDerWaalsContact C-N 3.32Å; Y573-L575 PolarHBondContact O-N 2.92Å; Y573-P576 WeakPolarHBondContact O-CD 3.27Å; Y573-I577 WeakPolarHBondContact O-CB 3.05Å; Y573-I577 VanDerWaalsContact O-CG1 3.26Å; Y573-I577 WeakPolarHBondContact O-CG1 3.39Å; Y573-I577 PolarHBondContact O-N 3.43Å
574	G	92.6	Very high	93.6	Very high	16 Å²	16	36.7 Å²	36.7	17%	0.165	22%	0.219	C	C	.	.	H	α-helix	trans	-58.4	-37.7	-178.3	0	0	0	0	0	114.1	V565 V571 T572 M578	V565-G574 VanDerWaalsContact CG2-CA 3.48Å; V571-G574 PolarHBondContact O-N 2.91Å; T572-G574 PolarHBondContact O-N 2.89Å; T572-G574 VanDerWaalsContact O-N 3.16Å; G574-M578 WeakPolarHBondContact O-CB 3.43Å; G574-M578 PolarHBondContact O-N 3.46Å
575	L	93.3	Very high	93.7	Very high	82 Å²	82	39.5 Å²	39.5	43%	0.429	23%	0.231	S	C	.	.	H	α-helix	trans	-69.4	-52.6	178.5	174	64.9	0	0	0	112.4	Y573 I577 M578 L579	Y573-L575 VanDerWaalsContact C-N 3.32Å; Y573-L575 PolarHBondContact O-N 2.92Å; L575-I577 VanDerWaalsContact C-N 3.35Å; L575-I577 PolarHBondContact O-N 3.42Å; L575-M578 HydrophobicContact CD1-CE 4.05Å; L575-M578 PolarHBondContact O-N 3.37Å; L575-L579 HydrophobicContact CD1-CD1 3.99Å; L575-L579 HydrophobicContact CD1-CG 4.17Å; L575-L579 HydrophobicContact CG-CD1 4.23Å; L575-L579 WeakPolarHBondContact O-CG 3.21Å; L575-L579 PolarHBondContact O-N 3.25Å; L575-L579 VanDerWaalsContact O-N 3.09Å
576	P	94.2	Very high	93.8	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-50.9	-49.8	169.9	-30.2	34.5	0	0	0	113.6	Y362 F370 I544 Y573 M578 L579 V580	Y362-P576 HydrophobicContact CD1-CG 3.83Å; Y362-P576 HydrophobicContact CD2-CG 4.04Å; Y362-P576 HydrophobicContact CE1-CG 3.47Å; Y362-P576 VanDerWaalsContact CE1-CG 3.47Å; Y362-P576 HydrophobicContact CE2-CG 3.74Å; Y362-P576 HydrophobicContact CG-CG 4.11Å; Y362-P576 VanDerWaalsContact CZ-CG 3.46Å; F370-P576 HydrophobicContact CD2-CB 3.82Å; F370-P576 HydrophobicContact CD2-CG 4.25Å; F370-P576 HydrophobicContact CE2-CB 4.08Å; F370-P576 HydrophobicContact CE2-CG 4.17Å; I544-P576 HydrophobicContact CD1-CB 3.83Å; Y573-P576 WeakPolarHBondContact O-CD 3.27Å; P576-M578 PolarHBondContact O-N 2.96Å; P576-L579 PolarHBondContact O-N 3.43Å; P576-V580 WeakPolarHBondContact O-CB 3.43Å; P576-V580 WeakPolarHBondContact O-CG2 3.45Å; P576-V580 PolarHBondContact O-N 2.88Å
577	I	95.8	Very high	94	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-62.9	-43.1	-177.4	-68.7	169.8	0	0	0	111	I544 A547 T561 M564 Y573 L575 V580 L581	I544-I577 HydrophobicContact CD1-CG1 4.39Å; A547-I577 HydrophobicContact CB-CG2 4.35Å; T561-I577 HydrophobicContact CG2-CG2 4.21Å; M564-I577 HydrophobicContact CB-CD1 3.99Å; M564-I577 HydrophobicContact CB-CG2 4.14Å; Y573-I577 WeakPolarHBondContact O-CB 3.05Å; Y573-I577 VanDerWaalsContact O-CG1 3.26Å; Y573-I577 WeakPolarHBondContact O-CG1 3.39Å; Y573-I577 PolarHBondContact O-N 3.43Å; L575-I577 VanDerWaalsContact C-N 3.35Å; L575-I577 PolarHBondContact O-N 3.42Å; I577-V580 PolarHBondContact O-N 3.35Å; I577-L581 HydrophobicContact CG2-CD1 3.71Å; I577-L581 HydrophobicContact CG2-CG 4.26Å; I577-L581 WeakPolarHBondContact O-CB 3.47Å; I577-L581 VanDerWaalsContact O-CG 3.29Å; I577-L581 WeakPolarHBondContact O-CG 3.28Å; I577-L581 PolarHBondContact O-N 2.87Å
578	M	96.1	Very high	94.2	Very high	86 Å²	86	42 Å²	42	42%	0.424	24%	0.244	S	C	.	.	H	α-helix	trans	-61.7	-45	177.4	-174.5	179.2	65.9	0	0	112.1	T561 G574 L575 P576 L581 M582	T561-M578 HydrophobicContact CG2-CB 4Å; G574-M578 WeakPolarHBondContact O-CB 3.43Å; G574-M578 PolarHBondContact O-N 3.46Å; L575-M578 HydrophobicContact CD1-CE 4.05Å; L575-M578 PolarHBondContact O-N 3.37Å; P576-M578 PolarHBondContact O-N 2.96Å; M578-L581 PolarHBondContact O-N 3.02Å; M578-M582 VanDerWaalsContact O-CB 3.27Å; M578-M582 WeakPolarHBondContact O-CB 3.34Å; M578-M582 PolarHBondContact O-N 3.28Å
579	L	96.5	Very high	94.4	Very high	47 Å²	47	45.3 Å²	45.3	25%	0.246	26%	0.261	C	S	.	.	H	α-helix	trans	-64.3	-40.5	178	-68.9	171.8	0	0	0	111.8	I367 I371 L575 P576 T583	I367-L579 HydrophobicContact CG2-CD1 3.73Å; I371-L579 HydrophobicContact CG1-CB 4.48Å; L575-L579 HydrophobicContact CD1-CD1 3.99Å; L575-L579 HydrophobicContact CD1-CG 4.17Å; L575-L579 HydrophobicContact CG-CD1 4.23Å; L575-L579 WeakPolarHBondContact O-CG 3.21Å; L575-L579 PolarHBondContact O-N 3.25Å; L575-L579 VanDerWaalsContact O-N 3.09Å; P576-L579 PolarHBondContact O-N 3.43Å; L579-T583 WeakPolarHBondContact O-CB 3.23Å; L579-T583 VanDerWaalsContact O-CG2 3.3Å; L579-T583 WeakPolarHBondContact O-CG2 3.41Å; L579-T583 PolarHBondContact O-N 3.45Å; L579-T583 PolarHBondContact O-OG1 3.42Å
580	V	97.2	Very high	94.7	Very high	0 Å²	0	51.7 Å²	51.7	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-64.1	-46.1	176.3	168.7	0	0	0	0	111.5	F370 I544 A547 A548 P576 I577 T583 A584	F370-V580 HydrophobicContact CB-CG2 3.79Å; F370-V580 WeakPolarHBondContact O-CG2 3.12Å; I544-V580 HydrophobicContact CD1-CG2 4.29Å; I544-V580 HydrophobicContact CG2-CG1 4.31Å; I544-V580 HydrophobicContact CG2-CG2 3.69Å; A547-V580 HydrophobicContact CB-CG1 4.32Å; A548-V580 HydrophobicContact CB-CG1 3.56Å; P576-V580 WeakPolarHBondContact O-CB 3.43Å; P576-V580 WeakPolarHBondContact O-CG2 3.45Å; P576-V580 PolarHBondContact O-N 2.88Å; I577-V580 PolarHBondContact O-N 3.35Å; V580-T583 PolarHBondContact O-OG1 3.01Å; V580-T583 VanDerWaalsContact O-OG1 3.08Å; V580-A584 WeakPolarHBondContact O-CB 3.38Å; V580-A584 PolarHBondContact O-N 2.96Å
581	L	97	Very high	95	Very high	1 Å²	1	56.7 Å²	56.7	1%	0.005	29%	0.289	C	S	.	.	H	α-helix	trans	-68.6	-39.8	179	-71.2	173.8	0	0	0	112.1	A547 L560 T561 I577 M578 K585	A547-L581 HydrophobicContact CB-CD2 4.44Å; A547-L581 VanDerWaalsContact O-CD2 3.22Å; A547-L581 WeakPolarHBondContact O-CD2 3.35Å; L560-L581 HydrophobicContact CB-CD1 4.19Å; L560-L581 HydrophobicContact CD2-CD1 4.25Å; L560-L581 HydrophobicContact CD2-CD2 3.65Å; L560-L581 HydrophobicContact CG-CD1 3.91Å; L560-L581 HydrophobicContact CG-CD2 4.2Å; T561-L581 WeakPolarHBondContact OG1-CD1 3.45Å; I577-L581 HydrophobicContact CG2-CD1 3.71Å; I577-L581 HydrophobicContact CG2-CG 4.26Å; I577-L581 WeakPolarHBondContact O-CB 3.47Å; I577-L581 VanDerWaalsContact O-CG 3.29Å; I577-L581 WeakPolarHBondContact O-CG 3.28Å; I577-L581 PolarHBondContact O-N 2.87Å; M578-L581 PolarHBondContact O-N 3.02Å; L581-K585 WeakPolarHBondContact O-CB 3.19Å; L581-K585 PolarHBondContact O-N 3.43Å
582	M	96.6	Very high	95.1	Very high	108 Å²	108	53 Å²	53	53%	0.532	26%	0.264	S	S	.	.	H	α-helix	trans	-64.7	-44.8	176.4	-174.7	175.6	-176.5	0	0	111.7	M578 K585 I586	M578-M582 VanDerWaalsContact O-CB 3.27Å; M578-M582 WeakPolarHBondContact O-CB 3.34Å; M578-M582 PolarHBondContact O-N 3.28Å; M582-K585 PolarHBondContact O-N 3.22Å; M582-I586 HydrophobicContact CE-CD1 4.13Å; M582-I586 HydrophobicContact CG-CD1 3.89Å; M582-I586 VanDerWaalsContact O-CG1 3.27Å; M582-I586 WeakPolarHBondContact O-CG1 3Å; M582-I586 PolarHBondContact O-N 3.3Å
583	T	97.3	Very high	95.1	Very high	31 Å²	31	52.1 Å²	52.1	19%	0.19	25%	0.254	C	S	.	.	H	α-helix	trans	-69.3	-40.9	177.8	50.3	0	0	0	0	112.2	I371 L579 V580 K585 I586 V587	I371-T583 HydrophobicContact CG2-CG2 4.17Å; L579-T583 WeakPolarHBondContact O-CB 3.23Å; L579-T583 VanDerWaalsContact O-CG2 3.3Å; L579-T583 WeakPolarHBondContact O-CG2 3.41Å; L579-T583 PolarHBondContact O-N 3.45Å; L579-T583 PolarHBondContact O-OG1 3.42Å; V580-T583 PolarHBondContact O-OG1 3.01Å; V580-T583 VanDerWaalsContact O-OG1 3.08Å; T583-K585 VanDerWaalsContact C-N 3.33Å; T583-K585 PolarHBondContact O-N 3.16Å; T583-I586 PolarHBondContact O-N 3.44Å; T583-V587 WeakPolarHBondContact O-CB 3.35Å; T583-V587 WeakPolarHBondContact O-CG2 3.26Å; T583-V587 PolarHBondContact O-N 3.14Å
584	A	97.6	Very high	95.2	Very high	0 Å²	0	52.1 Å²	52.1	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-61.3	-39.3	173.3	0	0	0	0	0	112.6	G374 G378 V580 G588	G374-A584 WeakPolarHBondContact O-CA 3.35Å; G374-A584 VanDerWaalsContact O-CB 3.31Å; G374-A584 WeakPolarHBondContact O-CB 3.25Å; G378-A584 VanDerWaalsContact CA-O 3.23Å; G378-A584 WeakPolarHBondContact CA-O 3.3Å; V580-A584 WeakPolarHBondContact O-CB 3.38Å; V580-A584 PolarHBondContact O-N 2.96Å; A584-G588 PolarHBondContact O-N 3.15Å
585	K	96.1	Very high	95.3	Very high	60 Å²	60	51.4 Å²	51.4	26%	0.261	25%	0.246	S	C	.	.	H	α-helix	trans	-63.9	-53.9	173	175.8	170.6	171.1	54	0	111.5	T557 L581 M582 T583 V587 G588 D589	T557-K585 HydrophobicContact CG2-CB 4.19Å; T557-K585 HydrophobicContact CG2-CD 3.61Å; L581-K585 WeakPolarHBondContact O-CB 3.19Å; L581-K585 PolarHBondContact O-N 3.43Å; M582-K585 PolarHBondContact O-N 3.22Å; T583-K585 VanDerWaalsContact C-N 3.33Å; T583-K585 PolarHBondContact O-N 3.16Å; K585-V587 PolarHBondContact O-N 3.26Å; K585-G588 PolarHBondContact O-N 2.95Å; K585-D589 WeakPolarHBondContact CE-OD2 3.5Å; K585-D589 WeakPolarHBondContact CG-OD2 3.13Å; K585-D589 IonicContact NZ-OD1 2.93Å; K585-D589 IonicContact NZ-OD2 2.84Å; K585-D589 PolarHBondContact NZ-OD2 3.06Å; K585-D589 VanDerWaalsContact O-CB 3.3Å; K585-D589 WeakPolarHBondContact O-CB 3.4Å; K585-D589 PolarHBondContact O-N 2.89Å
586	I	96.4	Very high	95.2	Very high	101 Å²	101	47.6 Å²	47.6	52%	0.518	23%	0.227	S	C	.	.	H	α-helix	trans	-58.8	-49	-177.2	-69.5	164.2	0	0	0	111.5	M582 T583 G588 Y590	M582-I586 HydrophobicContact CE-CD1 4.13Å; M582-I586 HydrophobicContact CG-CD1 3.89Å; M582-I586 VanDerWaalsContact O-CG1 3.27Å; M582-I586 WeakPolarHBondContact O-CG1 3Å; M582-I586 PolarHBondContact O-N 3.3Å; T583-I586 PolarHBondContact O-N 3.44Å; I586-G588 VanDerWaalsContact C-N 3.34Å; I586-G588 PolarHBondContact O-N 3.32Å; I586-Y590 PolarHBondContact O-N 2.74Å
587	V	97.3	Very high	95.1	Very high	46 Å²	46	48.9 Å²	48.9	28%	0.279	23%	0.233	S	C	.	.	H	α-helix	trans	-65.5	-39.7	179.3	173.4	0	0	0	0	111	A375 T583 K585 F591	A375-V587 HydrophobicContact CB-CG2 4.03Å; T583-V587 WeakPolarHBondContact O-CB 3.35Å; T583-V587 WeakPolarHBondContact O-CG2 3.26Å; T583-V587 PolarHBondContact O-N 3.14Å; K585-V587 PolarHBondContact O-N 3.26Å; V587-F591 HydrophobicContact CG1-CE2 4.21Å; V587-F591 WeakPolarHBondContact O-CD2 3.44Å
588	G	96	Very high	94.9	Very high	0 Å²	0	49.3 Å²	49.3	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-68.9	-41.6	178.4	0	0	0	0	0	113.8	R555 A584 K585 I586 Y590 F591 Q592	R555-G588 PolarHBondContact NH1-O 2.03Å; R555-G588 PolarHBondContact NH2-O 2.89Å; A584-G588 PolarHBondContact O-N 3.15Å; K585-G588 PolarHBondContact O-N 2.95Å; I586-G588 VanDerWaalsContact C-N 3.34Å; I586-G588 PolarHBondContact O-N 3.32Å; G588-Y590 PolarHBondContact O-N 3.17Å; G588-F591 PolarHBondContact O-N 3Å; G588-Q592 PolarHBondContact O-N 3.24Å
589	D	94	Very high	94.7	Very high	71 Å²	71	47 Å²	47	38%	0.38	22%	0.224	S	C	.	.	H	α-helix	trans	-65	-28.7	-176.5	-73.6	-8.9	0	0	0	111.8	R555 K585 F591	R555-D589 WeakPolarHBondContact CD-OD1 3.34Å; R555-D589 IonicContact CZ-OD1 2.66Å; R555-D589 IonicContact NE-OD1 3.89Å; R555-D589 VanDerWaalsContact NH1-N 3.12Å; R555-D589 IonicContact NH1-OD1 3.76Å; R555-D589 PolarHBondContact NH1-OD1 2.95Å; K585-D589 WeakPolarHBondContact CE-OD2 3.5Å; K585-D589 WeakPolarHBondContact CG-OD2 3.13Å; K585-D589 IonicContact NZ-OD1 2.93Å; K585-D589 IonicContact NZ-OD2 2.84Å; K585-D589 PolarHBondContact NZ-OD2 3.06Å; K585-D589 VanDerWaalsContact O-CB 3.3Å; K585-D589 WeakPolarHBondContact O-CB 3.4Å; K585-D589 PolarHBondContact O-N 2.89Å; D589-F591 VanDerWaalsContact C-N 3.27Å; D589-F591 PolarHBondContact O-N 3.49Å
590	Y	94.8	Very high	94.5	Very high	193 Å²	193	45 Å²	45	76%	0.757	21%	0.213	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.1	-27.9	172.7	-179.6	-98.9	0	0	0	113.6	I586 G588	I586-Y590 PolarHBondContact O-N 2.74Å; G588-Y590 PolarHBondContact O-N 3.17Å
591	F	94.3	Very high	94.1	Very high	137 Å²	137	49.3 Å²	49.3	60%	0.601	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	-103.4	-45.4	-175.5	-69.6	-65.1	0	0	0	114.2	A382 V587 G588 D589	A382-F591 HydrophobicContact CB-CB 3.73Å; A382-F591 HydrophobicContact CB-CD2 4.41Å; A382-F591 HydrophobicContact CB-CG 4.49Å; V587-F591 HydrophobicContact CG1-CE2 4.21Å; V587-F591 WeakPolarHBondContact O-CD2 3.44Å; G588-F591 PolarHBondContact O-N 3Å; D589-F591 VanDerWaalsContact C-N 3.27Å; D589-F591 PolarHBondContact O-N 3.49Å
592	Q	92.2	Very high	93.8	Very high	38 Å²	38	51.6 Å²	51.6	18%	0.178	24%	0.244	C	C	.	.			trans	-162.3	147.2	-174.4	179.4	59.3	-60	0	0	111.1	A382 N385 R555 G588	A382-Q592 HydrophobicContact CB-CB 4.4Å; N385-Q592 HydrophobicContact CB-CG 3.85Å; R555-Q592 VanDerWaalsContact CZ-O 3.29Å; R555-Q592 PolarHBondContact NH1-O 3.16Å; R555-Q592 PolarHBondContact NH2-O 3.29Å; G588-Q592 PolarHBondContact O-N 3.24Å
593	E	90.5	Very high	93.3	Very high	76 Å²	76	48.2 Å²	48.2	36%	0.355	24%	0.237	S	C	.	.			trans	-63.9	166.4	178.9	-59.4	-172.2	-175.8	0	0	114.1	N385 K601	N385-E593 PolarHBondContact ND2-O 2.86Å; E593-K601 IonicContact OE1-NZ 2.67Å; E593-K601 PolarHBondContact OE1-NZ 3Å; E593-K601 WeakPolarHBondContact OE2-CD 3.41Å; E593-K601 WeakPolarHBondContact OE2-CE 3.36Å; E593-K601 IonicContact OE2-NZ 2.74Å; E593-K601 PolarHBondContact OE2-NZ 3.3Å
594	G	93.4	Very high	93	Very high	2 Å²	2	48.6 Å²	48.6	2%	0.021	24%	0.24	C	C	.	.			trans	-66.4	147.3	176.1	0	0	0	0	0	113.2	Y596 D597 L598	G594-Y596 VanDerWaalsContact C-N 3.27Å; G594-Y596 PolarHBondContact O-N 3.01Å; G594-Y596 VanDerWaalsContact O-N 3.17Å; G594-D597 PolarHBondContact O-N 3.38Å; G594-L598 WeakPolarHBondContact O-CB 3.21Å; G594-L598 PolarHBondContact O-N 2.98Å
595	L	93.9	Very high	92.6	Very high	0 Å²	0	49.4 Å²	49.4	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-58.6	-35.4	-169.7	-172.2	67.9	0	0	0	113.7	F384 N385 N388 Y498 V506 I553 H599	F384-L595 HydrophobicContact CE1-CD2 4.11Å; N385-L595 PolarHBondContact ND2-N 3.32Å; N388-L595 HydrophobicContact CB-CD1 3.85Å; Y498-L595 HydrophobicContact CD1-CD1 4.22Å; Y498-L595 HydrophobicContact CD1-CD2 4.09Å; Y498-L595 HydrophobicContact CD1-CG 4.44Å; Y498-L595 HydrophobicContact CD2-CD2 4.27Å; Y498-L595 HydrophobicContact CE1-CD1 3.88Å; Y498-L595 HydrophobicContact CE1-CD2 3.77Å; Y498-L595 HydrophobicContact CE1-CG 3.82Å; Y498-L595 HydrophobicContact CE2-CD2 3.97Å; Y498-L595 HydrophobicContact CG-CD2 4.31Å; V506-L595 HydrophobicContact CB-CD2 4.46Å; V506-L595 HydrophobicContact CG1-CD2 4.12Å; V506-L595 HydrophobicContact CG2-CD2 4.04Å; I553-L595 HydrophobicContact CG2-CB 3.98Å; I553-L595 HydrophobicContact CG2-CD2 3.82Å; I553-L595 HydrophobicContact CG2-CG 4.49Å; I553-L595 PolarHBondContact O-N 3.37Å; L595-H599 PolarHBondContact O-N 3.44Å; L595-H599 PolarHBondContact O-ND1 3.16Å
596	Y	92.8	Very high	92.3	Very high	3 Å²	3	49 Å²	49	1%	0.012	25%	0.249	C	C	.	.	H	α-helix	trans	-74.5	-45.7	179.1	-60.5	-31.8	0	0	0	112.1	I198 P199 V506 F507 V554 M556 G594 L598 H599 I600	I198-Y596 HydrophobicContact CB-CE2 4.37Å; I198-Y596 HydrophobicContact CD1-CE2 4.19Å; I198-Y596 HydrophobicContact CG2-CD2 3.94Å; I198-Y596 HydrophobicContact CG2-CE2 3.86Å; P199-Y596 HydrophobicContact CG-CD1 3.89Å; P199-Y596 HydrophobicContact CG-CG 4.22Å; V506-Y596 HydrophobicContact CG1-CE1 4.12Å; V506-Y596 WeakPolarHBondContact CG1-OH 3.39Å; F507-Y596 WeakPolarHBondContact CD2-OH 3.34Å; F507-Y596 HydrophobicContact CE2-CE2 4.34Å; F507-Y596 WeakPolarHBondContact CE2-OH 3.44Å; V554-Y596 HydrophobicContact CB-CE2 4.5Å; V554-Y596 HydrophobicContact CG1-CD2 3.93Å; V554-Y596 HydrophobicContact CG1-CE2 3.49Å; V554-Y596 VanDerWaalsContact CG1-CE2 3.49Å; V554-Y596 HydrophobicContact CG2-CE2 4.26Å; M556-Y596 HydrophobicContact CE-CD2 4.05Å; M556-Y596 HydrophobicContact CE-CE2 4.11Å; G594-Y596 VanDerWaalsContact C-N 3.27Å; G594-Y596 PolarHBondContact O-N 3.01Å; G594-Y596 VanDerWaalsContact O-N 3.17Å; Y596-L598 VanDerWaalsContact C-N 3.31Å; Y596-L598 PolarHBondContact O-N 3.21Å; Y596-H599 CarbonylContact O-C 3.18Å; Y596-H599 WeakPolarHBondContact O-CA 3.39Å; Y596-H599 PolarHBondContact O-N 2.79Å; Y596-I600 WeakPolarHBondContact O-CG1 3.33Å; Y596-I600 PolarHBondContact O-N 2.74Å
597	D	91.7	Very high	91.9	Very high	26 Å²	26	46 Å²	46	14%	0.139	23%	0.232	C	C	.	.	H	α-helix	trans	-66	-37.9	-178.8	-55.6	-27	0	0	0	111	K202 G594 H599 I600 K601	K202-D597 WeakPolarHBondContact CE-OD1 3.1Å; K202-D597 IonicContact NZ-OD1 2.7Å; K202-D597 PolarHBondContact NZ-OD1 2.79Å; K202-D597 IonicContact NZ-OD2 2.71Å; G594-D597 PolarHBondContact O-N 3.38Å; D597-H599 VanDerWaalsContact C-N 3.28Å; D597-H599 PolarHBondContact O-N 3.01Å; D597-I600 WeakPolarHBondContact O-CB 3.41Å; D597-I600 PolarHBondContact O-N 3.16Å; D597-K601 WeakPolarHBondContact O-CG 3.39Å; D597-K601 PolarHBondContact O-N 2.99Å
598	L	92	Very high	91.5	Very high	9 Å²	9	50.1 Å²	50.1	5%	0.047	25%	0.252	C	S	.	.	H	α-helix	trans	-54.7	-41.3	169	-173.9	72	0	0	0	112.4	Y389 G594 Y596 L602	Y389-L598 HydrophobicContact CD2-CD1 3.71Å; Y389-L598 HydrophobicContact CD2-CG 4.35Å; Y389-L598 HydrophobicContact CE2-CD1 4.33Å; Y389-L598 HydrophobicContact CG-CD1 4.46Å; G594-L598 WeakPolarHBondContact O-CB 3.21Å; G594-L598 PolarHBondContact O-N 2.98Å; Y596-L598 VanDerWaalsContact C-N 3.31Å; Y596-L598 PolarHBondContact O-N 3.21Å; L598-L602 HydrophobicContact CG-CD1 4.36Å; L598-L602 WeakPolarHBondContact O-CB 3.43Å; L598-L602 WeakPolarHBondContact O-CG 3.39Å; L598-L602 PolarHBondContact O-N 2.8Å
599	H	91.1	Very high	91	Very high	38 Å²	38	54.6 Å²	54.6	18%	0.176	27%	0.272	C	S	.	.	H	α-helix	trans	-78.3	-27	178.8	-79.3	68.9	0	0	0	113.3	T392 Y498 L595 Y596 D597 G603	T392-H599 PolarHBondContact OG1-NE2 3.28Å; Y498-H599 AromaticContact CE1-CE1 3.56Å; Y498-H599 AromaticContact CE1-ND1 3.95Å; Y498-H599 AromaticContact CE1-NE2 3.65Å; L595-H599 PolarHBondContact O-N 3.44Å; L595-H599 PolarHBondContact O-ND1 3.16Å; Y596-H599 CarbonylContact O-C 3.18Å; Y596-H599 WeakPolarHBondContact O-CA 3.39Å; Y596-H599 PolarHBondContact O-N 2.79Å; D597-H599 VanDerWaalsContact C-N 3.28Å; D597-H599 PolarHBondContact O-N 3.01Å; H599-G603 PolarHBondContact O-N 2.69Å
600	I	91.6	Very high	90.5	Very high	4 Å²	4	59.6 Å²	59.6	2%	0.021	29%	0.286	C	S	.	.	H	α-helix	trans	-64.7	-46.1	169.1	-68.2	174.4	0	0	0	109.8	P199 K202 Y596 D597 G603 S604 V605 F607	P199-I600 HydrophobicContact CB-CD1 4.43Å; P199-I600 HydrophobicContact CB-CG1 3.91Å; K202-I600 HydrophobicContact CB-CD1 4.28Å; K202-I600 HydrophobicContact CD-CD1 3.76Å; K202-I600 HydrophobicContact CG-CD1 3.88Å; Y596-I600 WeakPolarHBondContact O-CG1 3.33Å; Y596-I600 PolarHBondContact O-N 2.74Å; D597-I600 WeakPolarHBondContact O-CB 3.41Å; D597-I600 PolarHBondContact O-N 3.16Å; I600-G603 WeakPolarHBondContact O-CA 3.47Å; I600-G603 PolarHBondContact O-N 3.41Å; I600-G603 VanDerWaalsContact O-N 3.16Å; I600-S604 PolarHBondContact O-N 3.2Å; I600-V605 HydrophobicContact CG2-CB 4.04Å; I600-V605 PolarHBondContact O-N 3.47Å; I600-F607 HydrophobicContact CD1-CD2 4.18Å; I600-F607 HydrophobicContact CD1-CE2 4.34Å; I600-F607 HydrophobicContact CG2-CB 3.58Å; I600-F607 HydrophobicContact CG2-CD2 4.29Å; I600-F607 HydrophobicContact CG2-CG 3.99Å
601	K	90.4	Very high	89.9	Confident	92 Å²	92	58.6 Å²	58.6	40%	0.4	29%	0.288	S	S	.	.	H	α-helix	trans	-67.1	-44.6	177.9	-70.5	178.4	-178.8	174.7	0	112.9	E593 D597 G603 S604	E593-K601 IonicContact OE1-NZ 2.67Å; E593-K601 PolarHBondContact OE1-NZ 3Å; E593-K601 WeakPolarHBondContact OE2-CD 3.41Å; E593-K601 WeakPolarHBondContact OE2-CE 3.36Å; E593-K601 IonicContact OE2-NZ 2.74Å; E593-K601 PolarHBondContact OE2-NZ 3.3Å; D597-K601 WeakPolarHBondContact O-CG 3.39Å; D597-K601 PolarHBondContact O-N 2.99Å; K601-G603 PolarHBondContact O-N 3.28Å; K601-S604 PolarHBondContact O-N 3.5Å
602	L	89.6	Confident	89.4	Confident	49 Å²	49	55.3 Å²	55.3	26%	0.257	29%	0.286	S	S	.	.	H	α-helix	trans	-63.4	-21	171.7	-73.2	172.3	0	0	0	113.1	Y389 T392 I393 L598 S604	Y389-L602 HydrophobicContact CD2-CD1 4.16Å; Y389-L602 HydrophobicContact CD2-CD2 4.33Å; Y389-L602 HydrophobicContact CE2-CD2 4.03Å; T392-L602 HydrophobicContact CG2-CD1 3.82Å; I393-L602 HydrophobicContact CD1-CD2 4.48Å; I393-L602 HydrophobicContact CG1-CD2 4.1Å; L598-L602 HydrophobicContact CG-CD1 4.36Å; L598-L602 WeakPolarHBondContact O-CB 3.43Å; L598-L602 WeakPolarHBondContact O-CG 3.39Å; L598-L602 PolarHBondContact O-N 2.8Å; L602-S604 VanDerWaalsContact C-N 3.33Å
603	G	87.3	Confident	89.2	Confident	37 Å²	37	57.5 Å²	57.5	38%	0.381	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.4	-0.7	172.3	0	0	0	0	0	115.2	H599 I600 K601 V605	H599-G603 PolarHBondContact O-N 2.69Å; I600-G603 WeakPolarHBondContact O-CA 3.47Å; I600-G603 PolarHBondContact O-N 3.41Å; I600-G603 VanDerWaalsContact O-N 3.16Å; K601-G603 PolarHBondContact O-N 3.28Å; G603-V605 PolarHBondContact O-N 2.92Å
604	S	89.4	Confident	88.9	Confident	38 Å²	38	58 Å²	58	27%	0.266	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	54.1	32.1	-175.4	-72.8	0	0	0	0	114.1	L81 S83 I600 K601 L602	L81-S604 WeakPolarHBondContact O-CB 3.37Å; L81-S604 PolarHBondContact O-OG 2.87Å; S83-S604 PolarHBondContact N-O 3.36Å; I600-S604 PolarHBondContact O-N 3.2Å; K601-S604 PolarHBondContact O-N 3.5Å; L602-S604 VanDerWaalsContact C-N 3.33Å
605	V	90	Very high	88.6	Confident	17 Å²	17	63.4 Å²	63.4	10%	0.103	35%	0.354	C	S	.	.			trans	-86.8	130.4	-179.9	-165.9	0	0	0	0	109.7	F86 C203 V208 I600 G603 F607	F86-V605 HydrophobicContact CD2-CG1 4.35Å; F86-V605 HydrophobicContact CE1-CG2 4.39Å; F86-V605 HydrophobicContact CE2-CB 4.26Å; F86-V605 HydrophobicContact CE2-CG1 4.45Å; F86-V605 HydrophobicContact CE2-CG2 3.88Å; F86-V605 HydrophobicContact CG-CG1 4.41Å; F86-V605 HydrophobicContact CZ-CG2 3.78Å; C203-V605 HydrophobicContact CB-CG1 4.32Å; V208-V605 HydrophobicContact CB-CG1 4.41Å; V208-V605 HydrophobicContact CG1-CG1 3.87Å; V208-V605 HydrophobicContact CG2-CG1 4.36Å; I600-V605 HydrophobicContact CG2-CB 4.04Å; I600-V605 PolarHBondContact O-N 3.47Å; G603-V605 PolarHBondContact O-N 2.92Å; V605-F607 PolarHBondContact O-N 3.38Å; V605-F607 VanDerWaalsContact O-N 3.08Å
606	P	89.3	Confident	88.4	Confident	51 Å²	51	64.9 Å²	64.9	33%	0.331	36%	0.364	S	S	.	.			trans	-70.4	102.9	171.9	29.2	-33.4	0	0	0	109.6	L82 F86 V208	L82-P606 HydrophobicContact CD1-CB 4.41Å; L82-P606 HydrophobicContact CD2-CB 4.29Å; F86-P606 HydrophobicContact CB-CG 4.35Å; V208-P606 WeakPolarHBondContact CG2-O 3.17Å
607	F	88.6	Confident	88.2	Confident	39 Å²	39	72.4 Å²	72.4	17%	0.171	40%	0.399	C	S	.	.			trans	-115.1	129.6	-178.8	-178.3	-93	0	0	0	110.7	K202 N206 I600 V605 H609	K202-F607 HydrophobicContact CD-CE2 4.28Å; K202-F607 HydrophobicContact CD-CZ 4.19Å; K202-F607 HydrophobicContact CG-CE2 3.59Å; K202-F607 HydrophobicContact CG-CZ 3.9Å; N206-F607 HydrophobicContact CB-CD2 3.85Å; N206-F607 HydrophobicContact CB-CE2 3.5Å; N206-F607 HydrophobicContact CB-CZ 4.39Å; N206-F607 WeakPolarHBondContact OD1-CD2 3.37Å; I600-F607 HydrophobicContact CD1-CD2 4.18Å; I600-F607 HydrophobicContact CD1-CE2 4.34Å; I600-F607 HydrophobicContact CG2-CB 3.58Å; I600-F607 HydrophobicContact CG2-CD2 4.29Å; I600-F607 HydrophobicContact CG2-CG 3.99Å; V605-F607 PolarHBondContact O-N 3.38Å; V605-F607 VanDerWaalsContact O-N 3.08Å; F607-H609 AromaticContact CE1-ND1 3.98Å
608	L	88.6	Confident	88.2	Confident	132 Å²	132	79.7 Å²	79.7	69%	0.691	43%	0.425	S	S	*	.			trans	-89.9	119.5	177.9	-64.5	173	0	0	0	110	N206	N206-L608 PolarHBondContact ND2-O 2.99Å; N206-L608 PolarHBondContact OD1-N 3.13Å
609	H	86.1	Confident	88.2	Confident	94 Å²	94	82.8 Å²	82.8	44%	0.435	44%	0.441	S	S	.	.			trans	-71.8	161.2	170	-65.3	-68.2	0	0	0	111	F607 E611	F607-H609 AromaticContact CE1-ND1 3.98Å; H609-E611 PolarHBondContact O-N 3.26Å
610	W	83.3	Confident	88.3	Confident	177 Å²	177	84.3 Å²	84.3	67%	0.67	45%	0.453	S	S	*	.	S	Bend	trans	-60.9	-30.5	-176.7	-60.1	-76	0	0	0	113.9	E305	E305-W610 HydrophobicContact CG-CZ2 4.47Å; E305-W610 PolarHBondContact O-NE1 3.47Å
611	E	82.1	Confident	88.3	Confident	171 Å²	171	88.1 Å²	88.1	80%	0.799	49%	0.485	S	S	*	.	S	Bend	trans	-131.3	157.2	178.6	-65.7	-177.3	171.5	0	0	110.4	H609	H609-E611 PolarHBondContact O-N 3.26Å
612	A	84.3	Confident	88.4	Confident	68 Å²	68	93.3 Å²	93.3	56%	0.562	50%	0.502	S	S	*	.			trans	-71.9	154.8	171.7	0	0	0	0	0	111	A614	A612-A614 PolarHBondContact O-N 3.43Å
613	P	86.7	Confident	88.4	Confident	85 Å²	85	96.1 Å²	96.1	55%	0.552	51%	0.514	S	S	*	.			trans	-56.7	135.2	175.8	-24	34.2	0	0	0	111.9	T615 S616	P613-T615 PolarHBondContact O-N 3.45Å; P613-S616 PolarHBondContact O-N 3.36Å; P613-S616 PolarHBondContact O-OG 2.93Å
614	A	84.1	Confident	88.5	Confident	86 Å²	86	99.6 Å²	99.6	71%	0.711	53%	0.527	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.5	-15.7	-179.6	0	0	0	0	0	114.4	A612 H617	A612-A614 PolarHBondContact O-N 3.43Å; A614-H617 PolarHBondContact O-CD2 2.89Å; A614-H617 VanDerWaalsContact O-CD2 3.23Å
615	T	88.5	Confident	88.6	Confident	116 Å²	116	103.1 Å²	103.1	71%	0.712	54%	0.541	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.9	-5.2	174.6	51.2	0	0	0	0	114.5	P613 W618	P613-T615 PolarHBondContact O-N 3.45Å; T615-W618 PolarHBondContact O-NE1 2.88Å
616	S	88.9	Confident	88.6	Confident	30 Å²	30	107.2 Å²	107.2	21%	0.21	57%	0.57	C	S	.	*			trans	-96.7	5.1	-176.4	73.3	0	0	0	0	114.8	P613 W618 L619	P613-S616 PolarHBondContact O-N 3.36Å; P613-S616 PolarHBondContact O-OG 2.93Å; S616-W618 PolarHBondContact O-N 3.35Å; S616-W618 VanDerWaalsContact O-N 3.12Å; S616-L619 WeakPolarHBondContact O-CB 3.41Å; S616-L619 PolarHBondContact O-N 3.42Å
617	H	89.8	Confident	88.5	Confident	162 Å²	162	109.1 Å²	109.1	75%	0.75	59%	0.585	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.3	-16.8	-178	-69.5	-60	0	0	0	115.1	A614	A614-H617 PolarHBondContact O-CD2 2.89Å; A614-H617 VanDerWaalsContact O-CD2 3.23Å
618	W	91.3	Very high	88.6	Confident	178 Å²	178	113.4 Å²	113.4	67%	0.674	62%	0.617	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.1	-15.9	174.6	65.5	-88.2	0	0	0	113.5	T615 S616 T620	T615-W618 PolarHBondContact O-NE1 2.88Å; S616-W618 PolarHBondContact O-N 3.35Å; S616-W618 VanDerWaalsContact O-N 3.12Å; W618-T620 PolarHBondContact O-N 2.97Å
619	L	91.9	Very high	88.6	Confident	74 Å²	74	111.6 Å²	111.6	39%	0.387	61%	0.611	S	S	.	*			trans	-73.9	127.3	-179.7	-76.9	169.9	0	0	0	110.3	S616 E623	S616-L619 WeakPolarHBondContact O-CB 3.41Å; S616-L619 PolarHBondContact O-N 3.42Å; L619-E623 HydrophobicContact CD2-CB 4.28Å
620	T	92.3	Very high	88.7	Confident	71 Å²	71	109.6 Å²	109.6	44%	0.436	61%	0.605	S	S	.	*			trans	-91.6	156.4	179.1	68.2	0	0	0	0	111.3	W618 R622 E623 V624	W618-T620 PolarHBondContact O-N 2.97Å; T620-R622 PolarHBondContact O-N 3.24Å; T620-R622 VanDerWaalsContact O-N 3.07Å; T620-E623 WeakPolarHBondContact CB-OE2 3.3Å; T620-E623 PolarHBondContact N-OE2 3.32Å; T620-E623 PolarHBondContact O-N 3.26Å; T620-E623 PolarHBondContact OG1-OE2 3.09Å; T620-V624 PolarHBondContact O-N 2.88Å
621	A	92.1	Very high	89	Confident	83 Å²	83	103.1 Å²	103.1	69%	0.686	59%	0.587	S	S	*	*	H	α-helix	trans	-56.5	-26.6	174.5	0	0	0	0	0	113	E623 V624 M625	A621-E623 VanDerWaalsContact C-N 3.31Å; A621-E623 PolarHBondContact O-N 3.28Å; A621-V624 PolarHBondContact O-N 3.25Å; A621-M625 WeakPolarHBondContact O-CB 3.4Å; A621-M625 WeakPolarHBondContact O-CG 3.38Å; A621-M625 PolarHBondContact O-N 3.04Å
622	R	91.5	Very high	89.3	Confident	202 Å²	202	95.7 Å²	95.7	76%	0.762	55%	0.552	S	S	*	*	H	α-helix	trans	-65.6	-29.4	176	-178.8	178.3	177.1	174.7	1.2	113.4	T620 M625	T620-R622 PolarHBondContact O-N 3.24Å; T620-R622 VanDerWaalsContact O-N 3.07Å; R622-M625 HydrophobicContact CG-CE 4.07Å
623	E	90.6	Very high	89.4	Confident	107 Å²	107	94.9 Å²	94.9	50%	0.5	54%	0.539	S	S	.	.	H	α-helix	trans	-88.6	-22.4	179.2	-67	156.2	118.7	0	0	112.2	L619 T620 A621	L619-E623 HydrophobicContact CD2-CB 4.28Å; T620-E623 WeakPolarHBondContact CB-OE2 3.3Å; T620-E623 PolarHBondContact N-OE2 3.32Å; T620-E623 PolarHBondContact O-N 3.26Å; T620-E623 PolarHBondContact OG1-OE2 3.09Å; A621-E623 VanDerWaalsContact C-N 3.31Å; A621-E623 PolarHBondContact O-N 3.28Å
624	V	89.8	Confident	89.4	Confident	110 Å²	110	97.7 Å²	97.7	67%	0.667	54%	0.538	S	S	*	.	H	α-helix	trans	-91.8	-26.5	-180	-178.6	0	0	0	0	112.4	T620 A621	T620-V624 PolarHBondContact O-N 2.88Å; A621-V624 PolarHBondContact O-N 3.25Å
625	M	91.4	Very high	89.5	Confident	112 Å²	112	101.1 Å²	101.1	55%	0.552	54%	0.543	S	S	*	.	S	Bend	trans	-72.2	139.9	179.8	72.2	-173.9	-165.6	0	0	112.7	A621 R622	A621-M625 WeakPolarHBondContact O-CB 3.4Å; A621-M625 WeakPolarHBondContact O-CG 3.38Å; A621-M625 PolarHBondContact O-N 3.04Å; R622-M625 HydrophobicContact CG-CE 4.07Å
626	S	88.8	Confident	89.4	Confident	103 Å²	103	98 Å²	98	72%	0.72	52%	0.52	S	S	*	.			trans	-71.3	138.7	169.2	-51.7	0	0	0	0	110.9	V629	S626-V629 WeakPolarHBondContact O-CG2 3.33Å
627	S	87.4	Confident	89.4	Confident	92 Å²	92	104.3 Å²	104.3	64%	0.643	54%	0.544	S	S	*	.	S	Bend	trans	-142.9	147.9	171.5	58.1	0	0	0	0	110.8
628	P	90.4	Very high	89.4	Confident	129 Å²	129	100.7 Å²	100.7	84%	0.838	53%	0.533	S	S	*	.	S	Bend	cis	-68.4	161.5	-4.4	31.9	-36.9	0	0	0	112.9
629	V	89.4	Confident	89.4	Confident	94 Å²	94	94.1 Å²	94.1	57%	0.57	52%	0.521	S	S	*	.			trans	-102	140.8	177.9	-177	0	0	0	0	109.4	S626 C631 P656	S626-V629 WeakPolarHBondContact O-CG2 3.33Å; V629-C631 PolarHBondContact O-N 3.41Å; V629-P656 HydrophobicContact CG1-CG 3.67Å
630	T	88.6	Confident	89.2	Confident	51 Å²	51	93.1 Å²	93.1	31%	0.313	52%	0.518	S	S	.	.			trans	-89.5	96.6	178.1	-36.8	0	0	0	0	110.7	T644 F655	T630-T644 HydrophobicContact CG2-CG2 3.85Å; T630-F655 HydrophobicContact CG2-CD1 4.46Å
631	C	88.6	Confident	89	Confident	42 Å²	42	90.2 Å²	90.2	28%	0.284	50%	0.5	S	S	.	.			trans	-80.6	159.7	177	-58.4	0	0	0	0	112.7	V629 P656 V658 E666	V629-C631 PolarHBondContact O-N 3.41Å; C631-P656 WeakPolarHBondContact CA-O 3.26Å; C631-V658 HydrophobicContact CB-CG1 3.97Å; C631-V658 HydrophobicContact CB-CG2 3.9Å; C631-E666 PolarHBondContact SG-OE2 3.49Å; C631-E666 VanDerWaalsContact SG-OE2 3.39Å
632	L	89.2	Confident	88.8	Confident	14 Å²	14	89.3 Å²	89.3	7%	0.073	49%	0.485	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	140.1	165	-65.9	174.5	0	0	0	109.4	E636 I641 F655 P656 V657 V658	L632-E636 HydrophobicContact CD2-CG 4.42Å; L632-I641 HydrophobicContact CD2-CG1 4.26Å; L632-F655 HydrophobicContact CD1-CB 3.81Å; L632-F655 HydrophobicContact CD1-CD2 4.45Å; L632-F655 HydrophobicContact CD1-CG 4.1Å; L632-F655 HydrophobicContact CG-CB 4.04Å; L632-F655 HydrophobicContact CG-CG 4.46Å; L632-P656 PolarHBondContact N-O 3.47Å; L632-V657 CarbonylContact O-C 3.55Å; L632-V657 VanDerWaalsContact O-CA 3.26Å; L632-V657 WeakPolarHBondContact O-CA 3.22Å; L632-V658 PolarHBondContact O-N 2.85Å
633	N	87	Confident	88.7	Confident	51 Å²	51	85 Å²	85	27%	0.273	48%	0.477	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.5	151.1	174.8	-70.3	-77.6	0	0	0	111.8	I635 E636	N633-I635 PolarHBondContact O-N 3.26Å; N633-I635 VanDerWaalsContact O-N 3.15Å; N633-E636 HydrophobicContact CB-CB 4.27Å; N633-E636 WeakPolarHBondContact CB-OE2 3.25Å; N633-E636 PolarHBondContact N-OE2 2.73Å; N633-E636 PolarHBondContact ND2-OE2 2.98Å
634	R	85.5	Confident	88.5	Confident	145 Å²	145	81.3 Å²	81.3	55%	0.547	46%	0.462	S	S	.	.	S	Bend	trans	-55.6	-28.5	171	179.2	176.8	170.6	-168.2	-5.6	113	V657 V658 V659 F669	R634-V657 HydrophobicContact CB-CG1 4.03Å; R634-V658 PolarHBondContact N-O 3.39Å; R634-V659 HydrophobicContact CB-CG2 3.77Å; R634-V659 HydrophobicContact CG-CG2 4.47Å; R634-F669 HydrophobicContact CG-CD1 4.41Å; R634-F669 HydrophobicContact CG-CE1 4.34Å
635	I	86	Confident	88.3	Confident	158 Å²	158	78.7 Å²	78.7	81%	0.81	44%	0.444	S	S	*	.	S	Bend	trans	-127.1	101.1	170.3	-56.7	176.7	0	0	0	106.5	N633	N633-I635 PolarHBondContact O-N 3.26Å; N633-I635 VanDerWaalsContact O-N 3.15Å
636	E	86.1	Confident	88	Confident	50 Å²	50	76.8 Å²	76.8	23%	0.234	44%	0.442	C	S	.	.			trans	-122.1	151.9	-172.8	-173.1	52.8	-103.9	0	0	111.3	L632 N633 T640 I641	L632-E636 HydrophobicContact CD2-CG 4.42Å; N633-E636 HydrophobicContact CB-CB 4.27Å; N633-E636 WeakPolarHBondContact CB-OE2 3.25Å; N633-E636 PolarHBondContact N-OE2 2.73Å; N633-E636 PolarHBondContact ND2-OE2 2.98Å; E636-T640 HydrophobicContact CG-CG2 4.41Å; E636-T640 VanDerWaalsContact OE1-CB 3.24Å; E636-T640 WeakPolarHBondContact OE1-CB 3.42Å; E636-T640 PolarHBondContact OE1-OG1 2.86Å; E636-I641 HydrophobicContact CB-CD1 3.92Å; E636-I641 HydrophobicContact CB-CG1 4.36Å; E636-I641 HydrophobicContact CG-CD1 3.89Å; E636-I641 HydrophobicContact CG-CG1 3.86Å
637	K	89.8	Confident	87.8	Confident	162 Å²	162	75.2 Å²	75.2	70%	0.704	43%	0.425	S	S	*	.			trans	-77.7	134.2	178.4	-63.2	170.2	-175.9	165.6	0	110.1	G639 T640 I641	K637-G639 PolarHBondContact O-N 3.05Å; K637-G639 VanDerWaalsContact O-N 3.08Å; K637-T640 WeakPolarHBondContact O-CB 3.37Å; K637-T640 PolarHBondContact O-N 3.24Å; K637-T640 PolarHBondContact O-OG1 3.03Å; K637-I641 WeakPolarHBondContact O-CD1 3.22Å; K637-I641 PolarHBondContact O-N 3.49Å
638	V	90.6	Very high	87.3	Confident	86 Å²	86	77.7 Å²	77.7	52%	0.521	44%	0.437	S	S	.	.	H	α-helix	trans	-54.2	-32.3	177.5	-176.8	0	0	0	0	112.3	I641 V642	V638-I641 PolarHBondContact O-N 3.3Å; V638-V642 HydrophobicContact CG1-CG2 4.39Å; V638-V642 WeakPolarHBondContact O-CG2 3.14Å; V638-V642 PolarHBondContact O-N 3.1Å
639	G	90.5	Very high	86.6	Confident	41 Å²	41	76.1 Å²	76.1	42%	0.423	43%	0.429	S	S	.	.	H	α-helix	trans	-57.1	-58.5	170.6	0	0	0	0	0	112.4	K637 I641 V642 D643	K637-G639 PolarHBondContact O-N 3.05Å; K637-G639 VanDerWaalsContact O-N 3.08Å; G639-I641 PolarHBondContact O-N 3.28Å; G639-V642 PolarHBondContact O-N 3.5Å; G639-D643 VanDerWaalsContact O-CG 3.24Å; G639-D643 PolarHBondContact O-N 2.89Å
640	T	88.5	Confident	85.8	Confident	52 Å²	52	73.9 Å²	73.9	32%	0.319	42%	0.416	S	S	.	.	H	α-helix	trans	-50.1	-45.4	177.4	-36	0	0	0	0	111.7	E636 K637 D643 T644	E636-T640 HydrophobicContact CG-CG2 4.41Å; E636-T640 VanDerWaalsContact OE1-CB 3.24Å; E636-T640 WeakPolarHBondContact OE1-CB 3.42Å; E636-T640 PolarHBondContact OE1-OG1 2.86Å; K637-T640 WeakPolarHBondContact O-CB 3.37Å; K637-T640 PolarHBondContact O-N 3.24Å; K637-T640 PolarHBondContact O-OG1 3.03Å; T640-D643 PolarHBondContact O-N 3.07Å; T640-T644 WeakPolarHBondContact O-CB 3.27Å; T640-T644 PolarHBondContact O-N 2.62Å; T640-T644 PolarHBondContact O-OG1 3.27Å
641	I	87.5	Confident	85.4	Confident	11 Å²	11	77.8 Å²	77.8	6%	0.056	44%	0.435	C	S	.	.	H	α-helix	trans	-63.3	-45.4	179.3	-68.2	143.2	0	0	0	111.5	L632 E636 K637 V638 G639 T644 L645 I681	L632-I641 HydrophobicContact CD2-CG1 4.26Å; E636-I641 HydrophobicContact CB-CD1 3.92Å; E636-I641 HydrophobicContact CB-CG1 4.36Å; E636-I641 HydrophobicContact CG-CD1 3.89Å; E636-I641 HydrophobicContact CG-CG1 3.86Å; K637-I641 WeakPolarHBondContact O-CD1 3.22Å; K637-I641 PolarHBondContact O-N 3.49Å; V638-I641 PolarHBondContact O-N 3.3Å; G639-I641 PolarHBondContact O-N 3.28Å; I641-T644 PolarHBondContact O-N 3.19Å; I641-L645 HydrophobicContact CG2-CD1 3.86Å; I641-L645 HydrophobicContact CG2-CG 4.43Å; I641-L645 WeakPolarHBondContact O-CB 3.36Å; I641-L645 VanDerWaalsContact O-CG 3.27Å; I641-L645 WeakPolarHBondContact O-CG 3.42Å; I641-L645 PolarHBondContact O-N 3.08Å; I641-I681 HydrophobicContact CB-CD1 4.47Å; I641-I681 HydrophobicContact CD1-CD1 3.46Å; I641-I681 VanDerWaalsContact CD1-CD1 3.46Å; I641-I681 HydrophobicContact CD1-CG1 4.18Å; I641-I681 HydrophobicContact CD1-CG2 4.46Å; I641-I681 HydrophobicContact CG1-CD1 3.95Å; I641-I681 HydrophobicContact CG2-CD1 3.85Å
642	V	88.4	Confident	85.2	Confident	63 Å²	63	80.1 Å²	80.1	38%	0.382	44%	0.441	S	S	.	.	H	α-helix	trans	-66.7	-39.7	177.5	170.1	0	0	0	0	111.3	V638 G639 L645 S646	V638-V642 HydrophobicContact CG1-CG2 4.39Å; V638-V642 WeakPolarHBondContact O-CG2 3.14Å; V638-V642 PolarHBondContact O-N 3.1Å; G639-V642 PolarHBondContact O-N 3.5Å; V642-L645 PolarHBondContact O-N 3.22Å; V642-S646 WeakPolarHBondContact O-CB 3.41Å; V642-S646 PolarHBondContact O-N 2.78Å; V642-S646 PolarHBondContact O-OG 3.34Å
643	D	88.8	Confident	85	Confident	111 Å²	111	82 Å²	82	59%	0.594	45%	0.452	S	S	*	.	H	α-helix	trans	-65.1	-40.9	177	-63.4	-30.2	0	0	0	111.1	G639 T640 S646 N647	G639-D643 VanDerWaalsContact O-CG 3.24Å; G639-D643 PolarHBondContact O-N 2.89Å; T640-D643 PolarHBondContact O-N 3.07Å; D643-S646 PolarHBondContact O-OG 2.95Å; D643-N647 PolarHBondContact O-N 3.47Å
644	T	87.2	Confident	85	Confident	30 Å²	30	81.2 Å²	81.2	18%	0.184	46%	0.455	C	S	.	.	H	α-helix	trans	-67.1	-46	174.8	-61.3	0	0	0	0	112.5	T630 T640 I641 N647 F655	T630-T644 HydrophobicContact CG2-CG2 3.85Å; T640-T644 WeakPolarHBondContact O-CB 3.27Å; T640-T644 PolarHBondContact O-N 2.62Å; T640-T644 PolarHBondContact O-OG1 3.27Å; I641-T644 PolarHBondContact O-N 3.19Å; T644-N647 WeakPolarHBondContact O-CB 3.37Å; T644-N647 PolarHBondContact O-N 3.49Å; T644-F655 HydrophobicContact CG2-CD1 4.33Å; T644-F655 HydrophobicContact CG2-CE1 3.76Å; T644-F655 HydrophobicContact CG2-CZ 4.37Å
645	L	85.3	Confident	85.3	Confident	55 Å²	55	74.6 Å²	74.6	29%	0.288	43%	0.43	S	S	.	.	H	α-helix	trans	-73.7	-25.7	-178.9	-67.9	177.4	0	0	0	113.4	I641 V642 F655 D674	I641-L645 HydrophobicContact CG2-CD1 3.86Å; I641-L645 HydrophobicContact CG2-CG 4.43Å; I641-L645 WeakPolarHBondContact O-CB 3.36Å; I641-L645 VanDerWaalsContact O-CG 3.27Å; I641-L645 WeakPolarHBondContact O-CG 3.42Å; I641-L645 PolarHBondContact O-N 3.08Å; V642-L645 PolarHBondContact O-N 3.22Å; L645-F655 HydrophobicContact CD2-CE2 3.53Å; L645-F655 HydrophobicContact CD2-CZ 3.71Å; L645-D674 HydrophobicContact CD2-CB 4.29Å; L645-D674 WeakPolarHBondContact CD2-OD1 3.18Å
646	S	85.1	Confident	85.5	Confident	73 Å²	73	68.2 Å²	68.2	51%	0.51	40%	0.399	S	S	.	.	H	α-helix	trans	-86	-8	175.7	64.3	0	0	0	0	113.9	V642 D643 T648	V642-S646 WeakPolarHBondContact O-CB 3.41Å; V642-S646 PolarHBondContact O-N 2.78Å; V642-S646 PolarHBondContact O-OG 3.34Å; D643-S646 PolarHBondContact O-OG 2.95Å; S646-T648 PolarHBondContact O-N 3.4Å; S646-T648 PolarHBondContact O-OG1 3.46Å
647	N	84.1	Confident	85.6	Confident	69 Å²	69	66.7 Å²	66.7	37%	0.369	39%	0.393	S	S	.	.			trans	-65.4	97.9	179.1	-179.2	13.4	0	0	0	111.9	D643 T644 S649 T650	D643-N647 PolarHBondContact O-N 3.47Å; T644-N647 WeakPolarHBondContact O-CB 3.37Å; T644-N647 PolarHBondContact O-N 3.49Å; N647-S649 PolarHBondContact ND2-OG 2.9Å; N647-S649 PolarHBondContact O-N 3.39Å; N647-S649 PolarHBondContact OD1-N 3.35Å; N647-S649 VanDerWaalsContact OD1-N 3.15Å; N647-S649 PolarHBondContact OD1-OG 2.99Å; N647-T650 PolarHBondContact ND2-OG1 2.97Å; N647-T650 PolarHBondContact O-N 3.43Å; N647-T650 VanDerWaalsContact O-N 3.12Å
648	T	76.1	Confident	85.6	Confident	145 Å²	145	59.3 Å²	59.3	89%	0.89	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.9	-10.6	-177.1	-45.8	0	0	0	0	113.6	S646	S646-T648 PolarHBondContact O-N 3.4Å; S646-T648 PolarHBondContact O-OG1 3.46Å
649	S	76.3	Confident	85.5	Confident	95 Å²	95	57.5 Å²	57.5	66%	0.664	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.4	-21.4	175.3	66.3	0	0	0	0	114.4	N647	N647-S649 PolarHBondContact ND2-OG 2.9Å; N647-S649 PolarHBondContact O-N 3.39Å; N647-S649 PolarHBondContact OD1-N 3.35Å; N647-S649 VanDerWaalsContact OD1-N 3.15Å; N647-S649 PolarHBondContact OD1-OG 2.99Å
650	T	73.7	Confident	84.9	Confident	47 Å²	47	61.1 Å²	61.1	29%	0.288	36%	0.357	S	S	.	.			trans	-136.6	90.5	-171.4	53.9	0	0	0	0	112.3	N647 H652	N647-T650 PolarHBondContact ND2-OG1 2.97Å; N647-T650 PolarHBondContact O-N 3.43Å; N647-T650 VanDerWaalsContact O-N 3.12Å; T650-H652 PolarHBondContact O-N 3.28Å
651	N	78.2	Confident	84.2	Confident	134 Å²	134	63.4 Å²	63.4	72%	0.717	37%	0.37	S	S	*	.			trans	-80.4	60.1	179.7	-173.3	27	0	0	0	112.8
652	H	85.3	Confident	82.7	Confident	91 Å²	91	66.7 Å²	66.7	42%	0.421	39%	0.394	S	S	.	.			trans	-82	131.5	177.3	-63	-53.9	0	0	0	111.3	T650 F655	T650-H652 PolarHBondContact O-N 3.28Å; H652-F655 HydrophobicContact CB-CE1 3.89Å; H652-F655 HydrophobicContact CB-CZ 3.9Å; H652-F655 WeakPolarHBondContact O-CE2 3.42Å; H652-F655 VanDerWaalsContact O-CZ 3.27Å; H652-F655 WeakPolarHBondContact O-CZ 3.45Å
653	N	85.4	Confident	81.8	Confident	54 Å²	54	66.8 Å²	66.8	29%	0.289	41%	0.409	S	S	.	.	S	Bend	trans	-96.6	-2	179.2	-87.4	-115.8	0	0	0	113.1	T673 D674 K675	N653-T673 CarbonylContact O-C 3.28Å; N653-T673 VanDerWaalsContact O-CA 3.25Å; N653-T673 WeakPolarHBondContact O-CA 3.43Å; N653-T673 WeakPolarHBondContact O-CB 3.41Å; N653-D674 PolarHBondContact O-N 2.83Å; N653-K675 PolarHBondContact OD1-NZ 3.07Å
654	G	87.7	Confident	80.7	Confident	34 Å²	34	69.4 Å²	69.4	35%	0.351	42%	0.422	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153	138.9	-177.8	0	0	0	0	0	111.8	A672	G654-A672 CarbonylContact C-O 3.54Å; G654-A672 WeakPolarHBondContact CA-O 3.33Å
655	F	90.1	Very high	80	Confident	5 Å²	5	73.2 Å²	73.2	2%	0.022	44%	0.442	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	124.7	-171.4	-56.3	-88	0	0	0	109	T630 L632 T644 L645 H652 V657 A672 D674	T630-F655 HydrophobicContact CG2-CD1 4.46Å; L632-F655 HydrophobicContact CD1-CB 3.81Å; L632-F655 HydrophobicContact CD1-CD2 4.45Å; L632-F655 HydrophobicContact CD1-CG 4.1Å; L632-F655 HydrophobicContact CG-CB 4.04Å; L632-F655 HydrophobicContact CG-CG 4.46Å; T644-F655 HydrophobicContact CG2-CD1 4.33Å; T644-F655 HydrophobicContact CG2-CE1 3.76Å; T644-F655 HydrophobicContact CG2-CZ 4.37Å; L645-F655 HydrophobicContact CD2-CE2 3.53Å; L645-F655 HydrophobicContact CD2-CZ 3.71Å; H652-F655 HydrophobicContact CB-CE1 3.89Å; H652-F655 HydrophobicContact CB-CZ 3.9Å; H652-F655 WeakPolarHBondContact O-CE2 3.42Å; H652-F655 VanDerWaalsContact O-CZ 3.27Å; H652-F655 WeakPolarHBondContact O-CZ 3.45Å; F655-V657 PolarHBondContact O-N 2.96Å; F655-A672 PolarHBondContact N-O 2.67Å; F655-A672 PolarHBondContact O-N 3.04Å; F655-D674 HydrophobicContact CE2-CB 4.4Å
656	P	90.1	Very high	79.7	Confident	25 Å²	25	75.2 Å²	75.2	16%	0.162	45%	0.45	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.4	135.4	172.4	25.6	-32.2	0	0	0	110.4	V629 C631 L632 L668	V629-P656 HydrophobicContact CG1-CG 3.67Å; C631-P656 WeakPolarHBondContact CA-O 3.26Å; L632-P656 PolarHBondContact N-O 3.47Å; P656-L668 HydrophobicContact CB-CD1 3.52Å
657	V	88.8	Confident	79.7	Confident	17 Å²	17	75.6 Å²	75.6	10%	0.103	45%	0.448	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	122.5	172.7	-176	0	0	0	0	107.8	L632 R634 F655 F669 D670 A672	L632-V657 CarbonylContact O-C 3.55Å; L632-V657 VanDerWaalsContact O-CA 3.26Å; L632-V657 WeakPolarHBondContact O-CA 3.22Å; R634-V657 HydrophobicContact CB-CG1 4.03Å; F655-V657 PolarHBondContact O-N 2.96Å; V657-F669 HydrophobicContact CG1-CD1 4.33Å; V657-F669 WeakPolarHBondContact O-CB 3.42Å; V657-F669 PolarHBondContact O-N 3.17Å; V657-D670 HydrophobicContact CB-CB 4.08Å; V657-D670 HydrophobicContact CG2-CB 4.31Å; V657-D670 PolarHBondContact N-O 3.09Å; V657-D670 PolarHBondContact O-N 2.81Å; V657-A672 HydrophobicContact CG2-CB 3.79Å
658	V	90.1	Very high	79.6	Confident	7 Å²	7	78 Å²	78	4%	0.042	46%	0.461	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	158	-178.2	-63.7	0	0	0	0	112.4	C631 L632 R634 E666 V667	C631-V658 HydrophobicContact CB-CG1 3.97Å; C631-V658 HydrophobicContact CB-CG2 3.9Å; L632-V658 PolarHBondContact O-N 2.85Å; R634-V658 PolarHBondContact N-O 3.39Å; V658-E666 HydrophobicContact CB-CB 4.24Å; V658-E666 HydrophobicContact CG1-CB 4.32Å; V658-E666 HydrophobicContact CG2-CG 4.39Å; V658-V667 CarbonylContact C-O 3.59Å; V658-V667 WeakPolarHBondContact CA-O 3.43Å
659	V	88.4	Confident	79.8	Confident	49 Å²	49	76.3 Å²	76.3	30%	0.297	44%	0.441	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	122.5	165.9	175.4	0	0	0	0	108.2	R634 V667 F669	R634-V659 HydrophobicContact CB-CG2 3.77Å; R634-V659 HydrophobicContact CG-CG2 4.47Å; V659-V667 PolarHBondContact N-O 2.84Å; V659-V667 PolarHBondContact O-N 3.17Å; V659-F669 HydrophobicContact CG2-CB 4.02Å; V659-F669 HydrophobicContact CG2-CD2 4.07Å; V659-F669 HydrophobicContact CG2-CG 4.11Å
660	Q	78.4	Confident	79.9	Confident	116 Å²	116	75.1 Å²	75.1	54%	0.542	43%	0.427	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.7	126.2	168.5	-66.7	179.9	-21.8	0	0	109.1	E666	Q660-E666 HydrophobicContact CG-CG 4.36Å
661	V	72.8	Confident	80.2	Confident	100 Å²	100	77.6 Å²	77.6	61%	0.606	44%	0.438	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-98.9	-46.4	-178.3	178	0	0	0	0	111.1	D665 V667	V661-D665 PolarHBondContact N-O 3.19Å; V661-V667 HydrophobicContact CG2-CB 4.11Å; V661-V667 HydrophobicContact CG2-CG2 3.6Å
662	S	55.9	Low	80	Confident	80 Å²	80	71.5 Å²	71.5	56%	0.559	41%	0.407	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-168	126	174.9	49.6	0	0	0	0	111.1
663	G	70.6	Confident	79.4	Confident	66 Å²	66	68.3 Å²	68.3	68%	0.68	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.5	-142.9	-176	0	0	0	0	0	112	D665	G663-D665 PolarHBondContact O-N 3.02Å
664	D	65.4	Low	78.2	Confident	165 Å²	165	68 Å²	68	88%	0.882	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81	2.5	179.1	-62.2	-32.1	0	0	0	113.3	E666	D664-E666 PolarHBondContact O-N 3.46Å; D664-E666 VanDerWaalsContact O-N 3.12Å
665	D	72.3	Confident	76.8	Confident	110 Å²	110	71 Å²	71	59%	0.588	40%	0.395	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75.1	99.6	-179.3	-72.3	-28.7	0	0	0	112.1	V661 G663	V661-D665 PolarHBondContact N-O 3.19Å; G663-D665 PolarHBondContact O-N 3.02Å
666	E	79.3	Confident	75	Confident	98 Å²	98	73.2 Å²	73.2	46%	0.458	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	128.3	170.2	-66.2	-168.4	168.9	0	0	112.2	C631 V658 Q660 D664	C631-E666 PolarHBondContact SG-OE2 3.49Å; C631-E666 VanDerWaalsContact SG-OE2 3.39Å; V658-E666 HydrophobicContact CB-CB 4.24Å; V658-E666 HydrophobicContact CG1-CB 4.32Å; V658-E666 HydrophobicContact CG2-CG 4.39Å; Q660-E666 HydrophobicContact CG-CG 4.36Å; D664-E666 PolarHBondContact O-N 3.46Å; D664-E666 VanDerWaalsContact O-N 3.12Å
667	V	84.4	Confident	72.7	Confident	80 Å²	80	72.1 Å²	72.1	49%	0.485	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	128.9	173.2	178.9	0	0	0	0	110.4	V658 V659 V661 F669	V658-V667 CarbonylContact C-O 3.59Å; V658-V667 WeakPolarHBondContact CA-O 3.43Å; V659-V667 PolarHBondContact N-O 2.84Å; V659-V667 PolarHBondContact O-N 3.17Å; V661-V667 HydrophobicContact CG2-CB 4.11Å; V661-V667 HydrophobicContact CG2-CG2 3.6Å; V667-F669 PolarHBondContact O-N 3.13Å
668	L	82.9	Confident	70.4	Confident	121 Å²	121	78.7 Å²	78.7	63%	0.634	42%	0.424	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-63.1	130	175.3	-178.7	67.3	0	0	0	111.1	P656	P656-L668 HydrophobicContact CB-CD1 3.52Å
669	F	78.9	Confident	68	Low	109 Å²	109	81.8 Å²	81.8	48%	0.478	45%	0.445	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	-42.4	-178.1	-178.7	-95.8	0	0	0	113	R634 V657 V659 V667	R634-F669 HydrophobicContact CG-CD1 4.41Å; R634-F669 HydrophobicContact CG-CE1 4.34Å; V657-F669 HydrophobicContact CG1-CD1 4.33Å; V657-F669 WeakPolarHBondContact O-CB 3.42Å; V657-F669 PolarHBondContact O-N 3.17Å; V659-F669 HydrophobicContact CG2-CB 4.02Å; V659-F669 HydrophobicContact CG2-CD2 4.07Å; V659-F669 HydrophobicContact CG2-CG 4.11Å; V667-F669 PolarHBondContact O-N 3.13Å
670	D	78.1	Confident	65.5	Low	69 Å²	69	81.4 Å²	81.4	37%	0.369	44%	0.439	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-163.4	178.3	-173.7	-172.3	5.1	0	0	0	109.8	V657 K680	V657-D670 HydrophobicContact CB-CB 4.08Å; V657-D670 HydrophobicContact CG2-CB 4.31Å; V657-D670 PolarHBondContact N-O 3.09Å; V657-D670 PolarHBondContact O-N 2.81Å; D670-K680 IonicContact OD1-NZ 2.66Å; D670-K680 PolarHBondContact OD1-NZ 2.87Å; D670-K680 IonicContact OD2-NZ 3.29Å; D670-K680 PolarHBondContact OD2-NZ 3.1Å
671	L	80.6	Confident	63.7	Low	99 Å²	99	78 Å²	78	52%	0.518	42%	0.424	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	130.4	171	-173.6	71.9	0	0	0	110.2	K680	L671-K680 PolarHBondContact O-NZ 3.33Å
672	A	74.2	Confident	61.9	Low	6 Å²	6	78.8 Å²	78.8	5%	0.05	42%	0.424	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	119.8	175.3	0	0	0	0	0	110.4	G654 F655 V657 K680	G654-A672 CarbonylContact C-O 3.54Å; G654-A672 WeakPolarHBondContact CA-O 3.33Å; F655-A672 PolarHBondContact N-O 2.67Å; F655-A672 PolarHBondContact O-N 3.04Å; V657-A672 HydrophobicContact CG2-CB 3.79Å; A672-K680 HydrophobicContact CB-CD 4.5Å
673	T	73.5	Confident	61	Low	24 Å²	24	79.8 Å²	79.8	15%	0.147	42%	0.42	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	143.4	169.6	53.6	0	0	0	0	110.7	I94 N653 K675 N676 A677	I94-T673 HydrophobicContact CD1-CG2 4.35Å; N653-T673 CarbonylContact O-C 3.28Å; N653-T673 VanDerWaalsContact O-CA 3.25Å; N653-T673 WeakPolarHBondContact O-CA 3.43Å; N653-T673 WeakPolarHBondContact O-CB 3.41Å; T673-K675 VanDerWaalsContact C-N 3.33Å; T673-K675 PolarHBondContact O-N 2.93Å; T673-N676 CarbonylContact O-C 3.05Å; T673-N676 WeakPolarHBondContact O-CA 3.43Å; T673-N676 PolarHBondContact O-N 2.98Å; T673-N676 PolarHBondContact OG1-ND2 3.29Å; T673-A677 PolarHBondContact O-N 3.01Å
674	D	58.5	Low	59.1	Low	49 Å²	49	80.9 Å²	80.9	26%	0.262	42%	0.417	S	S	.	.	H	α-helix	trans	-48.8	-51.4	-177	164	46.6	0	0	0	112.4	L645 N653 F655 N676 A677	L645-D674 HydrophobicContact CD2-CB 4.29Å; L645-D674 WeakPolarHBondContact CD2-OD1 3.18Å; N653-D674 PolarHBondContact O-N 2.83Å; F655-D674 HydrophobicContact CE2-CB 4.4Å; D674-N676 PolarHBondContact O-N 3.17Å; D674-A677 WeakPolarHBondContact O-CB 3.43Å; D674-A677 PolarHBondContact O-N 2.84Å
675	K	60.3	Low	57.4	Low	96 Å²	96	77.6 Å²	77.6	42%	0.417	41%	0.406	S	S	.	.	H	α-helix	trans	-55.1	-21	176	-67.3	153.3	-178.5	137.5	0	114	E87 N653 T673	E87-K675 IonicContact OE2-NZ 2.75Å; E87-K675 PolarHBondContact OE2-NZ 2.82Å; N653-K675 PolarHBondContact OD1-NZ 3.07Å; T673-K675 VanDerWaalsContact C-N 3.33Å; T673-K675 PolarHBondContact O-N 2.93Å
676	N	50.5	Low	55.3	Low	52 Å²	52	81.5 Å²	81.5	28%	0.278	43%	0.425	S	S	.	.	H	α-helix	trans	-113.2	-6.6	176.7	-72.5	-44	0	0	0	114.3	I94 T673 D674 W678 C679 K680	I94-N676 WeakPolarHBondContact CD1-ND2 3.4Å; T673-N676 CarbonylContact O-C 3.05Å; T673-N676 WeakPolarHBondContact O-CA 3.43Å; T673-N676 PolarHBondContact O-N 2.98Å; T673-N676 PolarHBondContact OG1-ND2 3.29Å; D674-N676 PolarHBondContact O-N 3.17Å; N676-W678 VanDerWaalsContact C-N 3.32Å; N676-W678 PolarHBondContact O-N 3.11Å; N676-C679 PolarHBondContact O-N 3.32Å; N676-K680 PolarHBondContact O-N 3Å
677	A	42.4	Very low	54.1	Low	2 Å²	2	80.7 Å²	80.7	2%	0.017	42%	0.423	C	S	.	.	H	α-helix	trans	-56.8	-50.5	-177.5	0	0	0	0	0	109.6	T673 D674 C679 K680 I681	T673-A677 PolarHBondContact O-N 3.01Å; D674-A677 WeakPolarHBondContact O-CB 3.43Å; D674-A677 PolarHBondContact O-N 2.84Å; A677-C679 VanDerWaalsContact C-N 3.27Å; A677-C679 PolarHBondContact O-N 3.47Å; A677-K680 PolarHBondContact O-N 3.49Å; A677-I681 HydrophobicContact CB-CD1 4.24Å; A677-I681 VanDerWaalsContact O-CB 3.31Å; A677-I681 WeakPolarHBondContact O-CB 3.44Å; A677-I681 VanDerWaalsContact O-CD1 3.3Å; A677-I681 WeakPolarHBondContact O-CD1 3.39Å; A677-I681 WeakPolarHBondContact O-CG1 3.49Å; A677-I681 PolarHBondContact O-N 2.94Å
678	W	40.7	Very low	52.5	Low	154 Å²	154	80.7 Å²	80.7	58%	0.583	42%	0.42	S	S	*	.	H	α-helix	trans	-49.1	-43.6	172.2	-66.5	89	0	0	0	113.4	N676 L682	N676-W678 VanDerWaalsContact C-N 3.32Å; N676-W678 PolarHBondContact O-N 3.11Å; W678-L682 WeakPolarHBondContact O-CB 3.44Å; W678-L682 PolarHBondContact O-N 2.69Å; W678-L682 VanDerWaalsContact O-N 3.12Å
679	C	39.9	Very low	50.9	Low	73 Å²	73	78.4 Å²	78.4	49%	0.493	41%	0.408	S	S	.	.	H	α-helix	trans	-75.6	-42.5	-179.8	-68.1	0	0	0	0	113.7	N676 A677 H683	N676-C679 PolarHBondContact O-N 3.32Å; A677-C679 VanDerWaalsContact C-N 3.27Å; A677-C679 PolarHBondContact O-N 3.47Å; C679-H683 PolarHBondContact O-N 2.92Å
680	K	36.6	Very low	49.2	Very low	41 Å²	41	76.6 Å²	76.6	18%	0.178	40%	0.404	C	S	.	.	H	α-helix	trans	-66.9	-37.1	177.2	-78.3	-167	175.2	-172.8	0	111.5	D670 L671 A672 N676 A677 S684	D670-K680 IonicContact OD1-NZ 2.66Å; D670-K680 PolarHBondContact OD1-NZ 2.87Å; D670-K680 IonicContact OD2-NZ 3.29Å; D670-K680 PolarHBondContact OD2-NZ 3.1Å; L671-K680 PolarHBondContact O-NZ 3.33Å; A672-K680 HydrophobicContact CB-CD 4.5Å; N676-K680 PolarHBondContact O-N 3Å; A677-K680 PolarHBondContact O-N 3.49Å; K680-S684 PolarHBondContact O-OG 3.34Å
681	I	39	Very low	47.4	Very low	44 Å²	44	77.1 Å²	77.1	23%	0.226	41%	0.406	C	S	.	.	H	α-helix	trans	-71.7	-47.9	179.9	-66.8	159.2	0	0	0	111	I641 A677 H683 S684 C685	I641-I681 HydrophobicContact CB-CD1 4.47Å; I641-I681 HydrophobicContact CD1-CD1 3.46Å; I641-I681 VanDerWaalsContact CD1-CD1 3.46Å; I641-I681 HydrophobicContact CD1-CG1 4.18Å; I641-I681 HydrophobicContact CD1-CG2 4.46Å; I641-I681 HydrophobicContact CG1-CD1 3.95Å; I641-I681 HydrophobicContact CG2-CD1 3.85Å; A677-I681 HydrophobicContact CB-CD1 4.24Å; A677-I681 VanDerWaalsContact O-CB 3.31Å; A677-I681 WeakPolarHBondContact O-CB 3.44Å; A677-I681 VanDerWaalsContact O-CD1 3.3Å; A677-I681 WeakPolarHBondContact O-CD1 3.39Å; A677-I681 WeakPolarHBondContact O-CG1 3.49Å; A677-I681 PolarHBondContact O-N 2.94Å; I681-H683 PolarHBondContact O-N 3.01Å; I681-S684 PolarHBondContact O-N 3.31Å; I681-C685 PolarHBondContact O-N 3.13Å
682	L	35.7	Very low	45.2	Very low	116 Å²	116	75.7 Å²	75.7	61%	0.607	40%	0.399	S	S	*	.	H	α-helix	trans	-56.3	-36	179.5	-96.6	158.9	0	0	0	113.2	W678 S684 C685	W678-L682 WeakPolarHBondContact O-CB 3.44Å; W678-L682 PolarHBondContact O-N 2.69Å; W678-L682 VanDerWaalsContact O-N 3.12Å; L682-S684 VanDerWaalsContact C-N 3.28Å; L682-S684 PolarHBondContact O-N 2.96Å; L682-C685 PolarHBondContact O-N 3.33Å
683	H	36.3	Very low	43.1	Very low	102 Å²	102	80.6 Å²	80.6	47%	0.472	42%	0.424	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.9	-0.7	179.1	-147.2	-54.1	0	0	0	114.1	C679 I681	C679-H683 PolarHBondContact O-N 2.92Å; I681-H683 PolarHBondContact O-N 3.01Å
684	S	31.5	Very low	40.8	Very low	89 Å²	89	85 Å²	85	62%	0.622	45%	0.445	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.1	2.8	168.3	-52.5	0	0	0	0	112.4	K680 I681 L682	K680-S684 PolarHBondContact O-OG 3.34Å; I681-S684 PolarHBondContact O-N 3.31Å; L682-S684 VanDerWaalsContact C-N 3.28Å; L682-S684 PolarHBondContact O-N 2.96Å
685	C	29.1	Very low	39.3	Very low	96 Å²	96	88 Å²	88	65%	0.649	46%	0.46	S	S	*	.			trans	-106.4	15	173.1	-63	0	0	0	0	112.9	I681 L682	I681-C685 PolarHBondContact O-N 3.13Å; L682-C685 PolarHBondContact O-N 3.33Å
686	I	29.5	Very low	37.4	Very low	191 Å²	191	87.3 Å²	87.3	98%	0.979	46%	0.464	S	S	*	.			trans	-130.9	0	176.3	-54.6	177.8	0	0	0	107.8

Retrieved 686 of 686 residues in 708.8 ms (Link to these results)

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