ZN282_HUMAN Loading...

Zinc finger protein 282

Binds to the U5 repressive element (U5RE) of the human T cell leukemia virus type I long terminal repeat. It recognizes the 5'-TCCACCCC-3' sequence as a core motif and exerts a strong repressive effect on HTLV-I LTR-mediated expression.

AlphaFold DB , UniProt , Accession Q9UDV7, Species HUMAN (Homo sapiens, Human), Gene ZNF282, Length 671 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	39.2	Very low	30.7	Very low	229 Å²	229	163.1 Å²	163.1	100%	1.128	84%	0.838	S	S	*	*				0	110.7	0	-74.4	155.1	169.9	0	0	108.5
2	Q	33.2	Very low	30.3	Very low	184 Å²	184	166 Å²	166	86%	0.86	85%	0.846	S	S	*	*			trans	-90	110.8	176.3	-71.7	173.7	-16.2	0	0	108.8	V4	Q2-V4 PolarHBondContact O-N 3.45Å
3	F	31.1	Very low	30.3	Very low	202 Å²	202	165 Å²	165	89%	0.886	84%	0.842	S	S	*	*			trans	-76.4	91.9	169.1	-88.5	-86.2	0	0	0	109.3	S5	F3-S5 VanDerWaalsContact C-N 3.35Å; F3-S5 PolarHBondContact O-N 3.41Å
4	V	33.5	Very low	29.8	Very low	116 Å²	116	158.4 Å²	158.4	70%	0.703	84%	0.835	S	S	*	*			trans	-69.8	93.9	169.2	-179.9	0	0	0	0	107.9	Q2 T6	Q2-V4 PolarHBondContact O-N 3.45Å; V4-T6 PolarHBondContact O-N 2.77Å
5	S	31.4	Very low	29.9	Very low	109 Å²	109	158.7 Å²	158.7	76%	0.762	84%	0.835	S	S	*	*			trans	-71.7	90	176.1	-175.7	0	0	0	0	109.9	F3 R7	F3-S5 VanDerWaalsContact C-N 3.35Å; F3-S5 PolarHBondContact O-N 3.41Å; S5-R7 PolarHBondContact O-N 3.14Å
6	T	31.7	Very low	29.7	Very low	124 Å²	124	160.3 Å²	160.3	76%	0.761	84%	0.837	S	S	*	*			trans	-58.3	107.8	172.6	37.1	0	0	0	0	110.6	V4	V4-T6 PolarHBondContact O-N 2.77Å
7	R	26.8	Very low	29.4	Very low	230 Å²	230	155 Å²	155	87%	0.868	83%	0.831	S	S	*	*	P	Polyproline II helix	trans	-75.1	126.8	164.3	-75.5	-175.8	174.4	-177.8	0	108.3	S5 Q9	S5-R7 PolarHBondContact O-N 3.14Å; R7-Q9 PolarHBondContact O-N 3.25Å
8	P	27.4	Very low	29.4	Very low	123 Å²	123	156.3 Å²	156.3	80%	0.799	84%	0.836	S	S	*	*	P	Polyproline II helix	trans	-65.9	128.5	169.8	27.3	-32.1	0	0	0	109.4
9	Q	25.1	Very low	29	Very low	178 Å²	178	151.5 Å²	151.5	83%	0.832	83%	0.827	S	S	*	*	P	Polyproline II helix	trans	-69.4	141.3	164.6	-79.5	-175.1	-19.7	0	0	109.1	R7 Q11	R7-Q9 PolarHBondContact O-N 3.25Å; Q9-Q11 PolarHBondContact O-N 3Å
10	P	30.6	Very low	29.1	Very low	125 Å²	125	152.7 Å²	152.7	81%	0.812	83%	0.832	S	S	*	*	P	Polyproline II helix	trans	-68.4	118.8	171.8	28.7	-32.4	0	0	0	109.4	Q12	P10-Q12 PolarHBondContact O-N 3.17Å
11	Q	27.3	Very low	28.8	Very low	174 Å²	174	152.4 Å²	152.4	81%	0.813	83%	0.83	S	S	*	*	P	Polyproline II helix	trans	-63.7	126.4	170.9	-71.8	173.9	-45.8	0	0	109.2	Q9 L13	Q9-Q11 PolarHBondContact O-N 3Å; Q11-L13 PolarHBondContact O-N 2.82Å
12	Q	26.3	Very low	28.2	Very low	198 Å²	198	147.6 Å²	147.6	93%	0.925	82%	0.819	S	S	*	*			trans	-68.3	97.9	164.6	-79	-167.2	-41.8	0	0	108.8	P10 G14	P10-Q12 PolarHBondContact O-N 3.17Å; Q12-G14 PolarHBondContact O-N 3.28Å
13	L	30.1	Very low	27.9	Very low	153 Å²	153	142 Å²	142	80%	0.801	81%	0.81	S	S	*	*			trans	-89.9	89	156.7	-72.7	174.4	0	0	0	107.8	Q11 I15	Q11-L13 PolarHBondContact O-N 2.82Å; L13-I15 PolarHBondContact O-N 3.15Å
14	G	23.5	Very low	27.5	Very low	72 Å²	72	138.2 Å²	138.2	74%	0.742	81%	0.808	S	S	*	*			trans	-69.9	112.2	165.7	0	0	0	0	0	109.1	Q12	Q12-G14 PolarHBondContact O-N 3.28Å
15	I	30.9	Very low	27.1	Very low	163 Å²	163	143 Å²	143	84%	0.836	81%	0.814	S	S	*	*			trans	-94.8	115.7	162	-65.8	179.7	0	0	0	106.4	L13	L13-I15 PolarHBondContact O-N 3.15Å
16	Q	27.3	Very low	26.6	Very low	184 Å²	184	143 Å²	143	86%	0.86	81%	0.814	S	S	*	*			trans	-68.7	155.5	178.5	-66.6	171.9	-6.4	0	0	110.1
17	G	23.9	Very low	26.3	Very low	71 Å²	71	147.1 Å²	147.1	73%	0.732	82%	0.816	S	S	*	*			trans	-69.9	150.1	-163.3	0	0	0	0	0	114.9
18	L	29.5	Very low	26.1	Very low	179 Å²	179	140.5 Å²	140.5	94%	0.937	81%	0.81	S	S	*	*			trans	-111.5	93.7	144.4	-70.5	176.8	0	0	0	106.9
19	G	22.1	Very low	26.1	Very low	64 Å²	64	142.1 Å²	142.1	66%	0.66	81%	0.807	S	S	*	*			trans	-75.3	119.5	168.2	0	0	0	0	0	109.3
20	L	30.3	Very low	26	Very low	175 Å²	175	138.3 Å²	138.3	92%	0.916	81%	0.806	S	S	*	*			trans	-129	88.6	159.3	-78.4	176.7	0	0	0	107.2
21	D	24.4	Very low	25.9	Very low	148 Å²	148	140.1 Å²	140.1	79%	0.791	81%	0.808	S	S	*	*			trans	-74.3	155.2	173.4	-66.9	-57.7	0	0	0	111.5
22	S	26.2	Very low	26.1	Very low	128 Å²	128	136.9 Å²	136.9	90%	0.895	80%	0.802	S	S	*	*			trans	67.3	121.1	162.2	70.5	0	0	0	0	118.4
23	G	25.8	Very low	26.4	Very low	65 Å²	65	133 Å²	133	67%	0.67	79%	0.793	S	S	*	*			trans	172.7	51.7	176.8	0	0	0	0	0	115.2	W25	G23-W25 PolarHBondContact O-N 3.23Å
24	S	23.8	Very low	26.1	Very low	123 Å²	123	134.4 Å²	134.4	86%	0.86	80%	0.796	S	S	*	*			trans	-68.2	110.9	175.1	-174.1	0	0	0	0	111
25	W	24	Very low	26.1	Very low	218 Å²	218	138.8 Å²	138.8	83%	0.826	80%	0.797	S	S	*	*			trans	-126.8	98.4	175.1	-80	59.5	0	0	0	110.6	G23	G23-W25 PolarHBondContact O-N 3.23Å
26	S	21.2	Very low	25.8	Very low	107 Å²	107	137.3 Å²	137.3	75%	0.748	80%	0.796	S	S	*	*			trans	-78.6	116	171.8	51.9	0	0	0	0	110.9
27	W	25.3	Very low	25.7	Very low	212 Å²	212	133.6 Å²	133.6	80%	0.803	79%	0.789	S	S	*	*			trans	-96.3	90	163.2	-90.1	67.5	0	0	0	110.2
28	A	23.2	Very low	25.9	Very low	91 Å²	91	138.4 Å²	138.4	75%	0.752	79%	0.792	S	S	*	*			trans	-118.9	81.7	163.8	0	0	0	0	0	108.2
29	Q	28	Very low	25.6	Very low	156 Å²	156	139.2 Å²	139.2	73%	0.729	79%	0.791	S	S	*	*			trans	-133.3	107.6	164.9	-66.1	-179.3	12.9	0	0	104.6
30	A	23	Very low	25.7	Very low	98 Å²	98	145 Å²	145	81%	0.81	80%	0.801	S	S	*	*			cis	70.1	74.3	49.7	0	0	0	0	0	112.4
31	L	27.7	Very low	25.7	Very low	164 Å²	164	141.8 Å²	141.8	86%	0.859	79%	0.79	S	S	*	*			trans	-157.7	154.8	165.7	-98.6	179.4	0	0	0	107.6
32	P	30.8	Very low	25.6	Very low	106 Å²	106	139.5 Å²	139.5	69%	0.688	79%	0.792	S	S	*	*				-106	174.4	-93.1	38.8	-36	0	0	0	114
33	P	33.9	Very low	25.7	Very low	115 Å²	115	141.7 Å²	141.7	75%	0.747	79%	0.793	S	S	*	*			trans	-77.2	-172.7	170.8	35.9	-38.2	0	0	0	112.3
34	E	23.3	Very low	25.5	Very low	184 Å²	184	148.6 Å²	148.6	86%	0.86	80%	0.799	S	S	*	*			trans	87.9	130.1	-174.9	-54.2	-173.5	159	0	0	113
35	E	24.4	Very low	25.7	Very low	164 Å²	164	146.4 Å²	146.4	77%	0.766	80%	0.795	S	S	*	*			cis	-129.9	153.8	9.7	-73.4	-166.2	132.9	0	0	114.4	C37	E35-C37 PolarHBondContact O-N 2.96Å
36	V	24	Very low	25.7	Very low	132 Å²	132	142.7 Å²	142.7	80%	0.8	79%	0.787	S	S	*	*			trans	-82.5	103.7	157.4	174.3	0	0	0	0	107.5
37	C	25.8	Very low	25.9	Very low	106 Å²	106	146.8 Å²	146.8	72%	0.716	80%	0.797	S	S	*	*			trans	-104.5	143.5	166.5	-98.1	0	0	0	0	110.9	E35	E35-C37 PolarHBondContact O-N 2.96Å
38	H	27.3	Very low	26.2	Very low	172 Å²	172	141.4 Å²	141.4	80%	0.796	80%	0.797	S	S	*	*			trans	-80.3	158.3	-160.2	-77.2	-97.9	0	0	0	114.6	E40	H38-E40 PolarHBondContact O-N 3.35Å
39	Q	22.4	Very low	26.3	Very low	195 Å²	195	146.4 Å²	146.4	91%	0.911	81%	0.805	S	S	*	*			trans	-48.8	125	161.4	-80.2	165	-27.2	0	0	111.8
40	E	25.3	Very low	26.4	Very low	187 Å²	187	142.4 Å²	142.4	87%	0.874	81%	0.805	S	S	*	*			trans	-121.4	148.7	151.2	-100.9	-162.1	89.7	0	0	110.4	H38	H38-E40 PolarHBondContact O-N 3.35Å
41	P	29.7	Very low	26.7	Very low	106 Å²	106	146.5 Å²	146.5	69%	0.688	81%	0.81	S	S	*	*			trans	-101.7	146	-156.1	37.5	-34.6	0	0	0	115.5	L43	P41-L43 PolarHBondContact O-N 2.94Å
42	A	23.7	Very low	26.8	Very low	100 Å²	100	144.1 Å²	144.1	83%	0.826	80%	0.804	S	S	*	*			trans	26.2	84.5	141.5	0	0	0	0	0	118.4	R44	A42-R44 PolarHBondContact O-N 3.49Å
43	L	26.9	Very low	26.9	Very low	175 Å²	175	145.1 Å²	145.1	92%	0.916	81%	0.811	S	S	*	*			trans	-77.1	108.8	155.3	-81.7	171	0	0	0	110.2	P41 G45	P41-L43 PolarHBondContact O-N 2.94Å; L43-G45 PolarHBondContact O-N 3.16Å
44	R	22.7	Very low	26.6	Very low	210 Å²	210	148.6 Å²	148.6	79%	0.792	82%	0.819	S	S	*	*			trans	-59.1	117.2	161.1	-90.5	-179.8	164.5	-124.7	4.1	109.3	A42 E46	A42-R44 PolarHBondContact O-N 3.49Å; R44-E46 IonicContact CZ-OE2 3.64Å; R44-E46 IonicContact NH1-OE2 3.7Å; R44-E46 PolarHBondContact NH1-OE2 3.16Å
45	G	27.8	Very low	26.8	Very low	77 Å²	77	148.4 Å²	148.4	79%	0.794	82%	0.819	S	S	*	*			trans	-116.9	85	164.8	0	0	0	0	0	109.9	L43	L43-G45 PolarHBondContact O-N 3.16Å
46	E	22.7	Very low	27.1	Very low	140 Å²	140	145.4 Å²	145.4	65%	0.654	82%	0.822	S	S	*	*			trans	-71.2	127.7	166.5	-69.2	165.1	63.6	0	0	108.9	R44	R44-E46 IonicContact CZ-OE2 3.64Å; R44-E46 IonicContact NH1-OE2 3.7Å; R44-E46 PolarHBondContact NH1-OE2 3.16Å
47	M	26.7	Very low	27.2	Very low	193 Å²	193	147.4 Å²	147.4	95%	0.951	82%	0.822	S	S	*	*			trans	179.7	160.2	145.4	-102	166.5	-142.3	0	0	113.1
48	A	32	Very low	27.2	Very low	98 Å²	98	151.1 Å²	151.1	81%	0.81	83%	0.829	S	S	*	*			trans	75.7	70.3	172	0	0	0	0	0	117.4
49	E	25.1	Very low	27.4	Very low	197 Å²	197	152.6 Å²	152.6	92%	0.921	83%	0.828	S	S	*	*			trans	-59.8	155.3	141.8	-59.1	-169	140.7	0	0	110.7
50	G	29.5	Very low	27.7	Very low	71 Å²	71	149.3 Å²	149.3	73%	0.732	82%	0.817	S	S	*	*			trans	109.2	61.1	156.8	0	0	0	0	0	118.3
51	M	29.5	Very low	28.1	Very low	184 Å²	184	148 Å²	148	91%	0.906	81%	0.813	S	S	*	*			trans	-124.5	127.5	149.9	-119.2	79.2	-175.7	0	0	109.1
52	P	30.3	Very low	28.3	Very low	114 Å²	114	149.9 Å²	149.9	74%	0.74	82%	0.817	S	S	*	*			trans	-76.4	161.2	-174.7	31.5	-35.7	0	0	0	112.7	M54	P52-M54 PolarHBondContact O-N 3.47Å; P52-M54 VanDerWaalsContact O-N 3.14Å
53	P	31.9	Very low	28.6	Very low	127 Å²	127	149.4 Å²	149.4	83%	0.825	81%	0.813	S	S	*	*			trans	-70.5	110.7	-176.1	28.6	-34.5	0	0	0	111.3	Q55	P53-Q55 PolarHBondContact O-N 3.43Å
54	M	27.9	Very low	29.1	Very low	188 Å²	188	152.4 Å²	152.4	93%	0.926	81%	0.812	S	S	*	*			trans	-69.5	126.9	168.4	-164.5	171.5	-178.6	0	0	108.9	P52	P52-M54 PolarHBondContact O-N 3.47Å; P52-M54 VanDerWaalsContact O-N 3.14Å
55	Q	28.4	Very low	29.6	Very low	181 Å²	181	153.6 Å²	153.6	85%	0.846	82%	0.816	S	S	*	*			trans	-54.4	137.7	-171	-74.7	167.9	-33	0	0	112.4	P53 Q57	P53-Q55 PolarHBondContact O-N 3.43Å; Q55-Q57 PolarHBondContact O-N 2.98Å
56	A	29.1	Very low	29.8	Very low	100 Å²	100	155.9 Å²	155.9	83%	0.826	82%	0.817	S	S	*	*			trans	-66.7	97.1	173.4	0	0	0	0	0	109.4	E58	A56-E58 PolarHBondContact O-N 3.16Å
57	Q	27.6	Very low	30.1	Very low	175 Å²	175	157.3 Å²	157.3	82%	0.818	83%	0.826	S	S	*	*			trans	-69	116.9	176.4	-173.4	164.6	-6.3	0	0	109.5	Q55 W59	Q55-Q57 PolarHBondContact O-N 2.98Å; Q57-W59 PolarHBondContact O-N 3Å
58	E	24.4	Very low	30.3	Very low	184 Å²	184	153 Å²	153	86%	0.86	81%	0.812	S	S	*	*			trans	-55.4	119.7	175.7	-73.8	168.2	87.6	0	0	110.4	A56 D60	A56-E58 PolarHBondContact O-N 3.16Å; E58-D60 PolarHBondContact O-N 3.22Å
59	W	31.1	Very low	30.1	Very low	202 Å²	202	157.9 Å²	157.9	77%	0.765	82%	0.816	S	S	*	*			trans	-86.8	87.5	176.5	25.4	-82.5	0	0	0	108.6	Q57 M61	Q57-W59 PolarHBondContact O-N 3Å; W59-M61 HydrophobicContact CE3-SD 4.19Å; W59-M61 HydrophobicContact CZ3-CE 4.06Å; W59-M61 HydrophobicContact CZ3-SD 4.13Å; W59-M61 PolarHBondContact O-N 3.46Å
60	D	28.5	Very low	30.2	Very low	127 Å²	127	157 Å²	157	68%	0.679	81%	0.812	S	S	*	*			trans	-50.1	122.7	170.3	-180	-97.4	0	0	0	110.5	E58 D62	E58-D60 PolarHBondContact O-N 3.22Å; D60-D62 PolarHBondContact OD1-N 2.89Å
61	M	34.7	Very low	30	Very low	160 Å²	160	162 Å²	162	79%	0.788	81%	0.814	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.3	19.2	-164.8	-160.3	136.3	67.3	0	0	113.6	W59	W59-M61 HydrophobicContact CE3-SD 4.19Å; W59-M61 HydrophobicContact CZ3-CE 4.06Å; W59-M61 HydrophobicContact CZ3-SD 4.13Å; W59-M61 PolarHBondContact O-N 3.46Å
62	D	34	Very low	30.1	Very low	145 Å²	145	158.2 Å²	158.2	78%	0.775	80%	0.803	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.5	-3.1	179	-104.5	-62.2	0	0	0	114.6	D60 R64	D60-D62 PolarHBondContact OD1-N 2.89Å; D62-R64 PolarHBondContact O-N 3.28Å
63	A	30	Very low	30.2	Very low	90 Å²	90	158.8 Å²	158.8	74%	0.744	81%	0.806	S	S	*	*			trans	-79.8	45.9	177.8	0	0	0	0	0	115
64	R	37.8	Very low	30.1	Very low	237 Å²	237	161.7 Å²	161.7	89%	0.894	81%	0.806	S	S	*	*			trans	-133.4	48.3	170.5	-74.5	-160.4	-176.2	-110.8	1.3	115	D62	D62-R64 PolarHBondContact O-N 3.28Å
65	R	31.6	Very low	30.7	Very low	235 Å²	235	158.7 Å²	158.7	89%	0.887	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-77.3	125.1	151.2	-80.4	-174.4	173.7	-110.8	-1.1	109.6	M67	R65-M67 PolarHBondContact O-N 2.89Å
66	P	33.6	Very low	30.6	Very low	125 Å²	125	156.9 Å²	156.9	81%	0.812	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-63.7	124.5	177.8	-21	32.7	0	0	0	111
67	M	28.1	Very low	30.5	Very low	170 Å²	170	163.2 Å²	163.2	84%	0.837	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-60.4	128.5	168.1	-80.5	-73.3	-107.8	0	0	109.2	R65 F69	R65-M67 PolarHBondContact O-N 2.89Å; M67-F69 PolarHBondContact O-N 3.29Å
68	P	31	Very low	30.7	Very low	103 Å²	103	159.5 Å²	159.5	67%	0.669	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-69.7	120.8	178.5	27.6	-32.5	0	0	0	109.6	Q70	P68-Q70 PolarHBondContact O-N 3.43Å
69	F	28.7	Very low	31.4	Very low	201 Å²	201	155.8 Å²	155.8	88%	0.882	79%	0.791	S	S	*	*			trans	-61.3	103.2	172.2	-85.8	-97.5	0	0	0	109.8	M67 F71	M67-F69 PolarHBondContact O-N 3.29Å; F69-F71 PolarHBondContact O-N 3.28Å
70	Q	25.8	Very low	31.4	Very low	178 Å²	178	152.9 Å²	152.9	83%	0.832	80%	0.795	S	S	*	*			trans	-73.4	115	167	-65	-177.4	13.2	0	0	107.9	P68	P68-Q70 PolarHBondContact O-N 3.43Å
71	F	25.8	Very low	31.7	Very low	177 Å²	177	155.5 Å²	155.5	78%	0.776	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-64.7	127.4	169.2	-87.8	-96.9	0	0	0	109	F69	F69-F71 PolarHBondContact O-N 3.28Å
72	P	31.9	Very low	31.9	Very low	104 Å²	104	153.2 Å²	153.2	68%	0.675	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-64.2	142.5	168.8	27.6	-32.7	0	0	0	109.5
73	P	33.3	Very low	31.7	Very low	126 Å²	126	154.3 Å²	154.3	82%	0.818	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-70	133.9	-172.8	27.7	-34.3	0	0	0	111.6
74	F	29.7	Very low	32.3	Very low	188 Å²	188	161.3 Å²	161.3	83%	0.825	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-67.8	125.6	171.7	-77.4	-94.5	0	0	0	110.1
75	P	38.9	Very low	32.3	Very low	125 Å²	125	158.7 Å²	158.7	81%	0.812	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-72.7	129	172.1	29	-32.2	0	0	0	110.3
76	D	27.2	Very low	32.5	Very low	142 Å²	142	156.3 Å²	156.3	76%	0.759	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-71.6	148	177.2	-160.8	-9.3	0	0	0	111.3
77	R	27.7	Very low	32.8	Very low	233 Å²	233	161.5 Å²	161.5	88%	0.879	82%	0.815	S	S	*	*			trans	20	108.7	169.1	-80.9	168.4	157.4	-179.8	-5	119.1
78	A	30	Very low	33.2	Very low	98 Å²	98	160.7 Å²	160.7	81%	0.81	81%	0.81	S	S	*	*			trans	-125	152.8	150.2	0	0	0	0	0	110.2
79	P	39.5	Very low	34	Very low	105 Å²	105	161.4 Å²	161.4	68%	0.682	81%	0.814	S	S	*	*			trans	-94.3	160.3	-143.8	35.1	-37.6	0	0	0	116.4	F81	P79-F81 HydrophobicContact CG-CD2 4.5Å; P79-F81 HydrophobicContact CG-CE2 4.05Å; P79-F81 PolarHBondContact O-N 2.97Å
80	V	30.6	Very low	34.5	Very low	142 Å²	142	160.1 Å²	160.1	86%	0.861	81%	0.811	S	S	*	*			trans	-60.9	122.1	172.3	-179.6	0	0	0	0	110.8
81	F	36.3	Very low	35.4	Very low	181 Å²	181	159 Å²	159	79%	0.794	81%	0.81	S	S	*	*			trans	-117.1	142.4	163.1	-84.1	-83.6	0	0	0	109.7	P79	P79-F81 HydrophobicContact CG-CD2 4.5Å; P79-F81 HydrophobicContact CG-CE2 4.05Å; P79-F81 PolarHBondContact O-N 2.97Å
82	P	38.9	Very low	36.7	Very low	112 Å²	112	155.9 Å²	155.9	73%	0.727	81%	0.807	S	S	*	*			trans	-90.7	163.3	-163.6	35.1	-35.5	0	0	0	114.5	R84	P82-R84 PolarHBondContact O-N 3.28Å
83	D	30.3	Very low	37.7	Very low	168 Å²	168	157.5 Å²	157.5	90%	0.898	82%	0.815	S	S	*	*			trans	-39	124	179.7	-81.3	-79.7	0	0	0	116.1
84	R	41.6	Very low	39.2	Very low	238 Å²	238	155.4 Å²	155.4	90%	0.898	81%	0.808	S	S	*	*			trans	-143.5	91.2	157.4	-163.8	174.1	-174.9	179.2	1.8	111.7	P82	P82-R84 PolarHBondContact O-N 3.28Å
85	M	38.7	Very low	41.1	Very low	182 Å²	182	155.5 Å²	155.5	90%	0.897	81%	0.811	S	S	*	*			trans	23.3	122.9	157.3	-61	179	-177.5	0	0	119
86	M	35.4	Very low	43	Very low	184 Å²	184	155.6 Å²	155.6	91%	0.906	80%	0.804	S	S	*	*			trans	-35.2	133.6	168.6	-68.3	-87.5	-83.1	0	0	114.4
87	R	39.7	Very low	45.9	Very low	235 Å²	235	151.6 Å²	151.6	89%	0.887	79%	0.787	S	S	*	*			trans	-128.2	122.5	161.3	-168.8	173	-171.5	154	3.2	108.9
88	E	36.5	Very low	48.9	Very low	153 Å²	153	146.9 Å²	146.9	72%	0.715	78%	0.779	S	S	*	*			trans	-50.2	132.2	179.3	-151.5	88	152.9	0	0	111.4	Q90	E88-Q90 PolarHBondContact O-N 3.45Å
89	P	48.4	Very low	51.8	Low	117 Å²	117	152.1 Å²	152.1	76%	0.76	78%	0.778	S	S	*	*			trans	-70.6	114	177.9	-17	31.1	0	0	0	111.3	L91	P89-L91 PolarHBondContact O-N 3.23Å; P89-L91 VanDerWaalsContact O-N 3.15Å
90	Q	38.8	Very low	54.4	Low	175 Å²	175	151 Å²	151	82%	0.818	77%	0.769	S	S	*	*			trans	-69.6	110	170.8	-64.9	-73.1	46.7	0	0	109.3	E88 P92	E88-Q90 PolarHBondContact O-N 3.45Å; Q90-P92 VanDerWaalsContact O-CD 3.3Å; Q90-P92 WeakPolarHBondContact O-CD 3.3Å
91	L	44.8	Very low	57.4	Low	155 Å²	155	147.4 Å²	147.4	81%	0.812	75%	0.747	S	S	*	*			trans	-73	115.9	-177.1	-140.5	163.9	0	0	0	109.4	P89 T93	P89-L91 PolarHBondContact O-N 3.23Å; P89-L91 VanDerWaalsContact O-N 3.15Å; L91-T93 PolarHBondContact O-N 3.04Å
92	P	53.4	Low	60.2	Low	110 Å²	110	141.2 Å²	141.2	71%	0.714	72%	0.724	S	S	*	*			trans	-72.4	119.6	-178	-16.6	31.6	0	0	0	110.6	Q90 A94	Q90-P92 VanDerWaalsContact O-CD 3.3Å; Q90-P92 WeakPolarHBondContact O-CD 3.3Å; P92-A94 PolarHBondContact O-N 3Å
93	T	53.1	Low	62.8	Low	138 Å²	138	138.4 Å²	138.4	85%	0.847	71%	0.71	S	S	*	*			trans	-73	72.5	174.4	-31.3	0	0	0	0	110.2	L91 E95	L91-T93 PolarHBondContact O-N 3.04Å; T93-E95 PolarHBondContact O-N 3.27Å; T93-E95 VanDerWaalsContact O-N 3.17Å
94	A	63.1	Low	65.9	Low	82 Å²	82	133 Å²	133	68%	0.678	69%	0.689	S	S	*	*			trans	-71	106.2	172.3	0	0	0	0	0	108.9	P92 I96	P92-A94 PolarHBondContact O-N 3Å; A94-I96 PolarHBondContact O-N 3.23Å
95	E	69.4	Low	68.4	Low	190 Å²	190	126.7 Å²	126.7	89%	0.888	67%	0.672	S	S	*	*			trans	-61.1	107.2	174	-64.6	-171.8	165	0	0	109.5	T93 S97	T93-E95 PolarHBondContact O-N 3.27Å; T93-E95 VanDerWaalsContact O-N 3.17Å; E95-S97 PolarHBondContact O-N 2.88Å
96	I	80	Confident	71.2	Confident	128 Å²	128	121.9 Å²	121.9	66%	0.656	65%	0.647	S	S	*	*			trans	-66.2	121.1	177.4	-58.9	171.4	0	0	0	107.3	A94 L98 T100 V101	A94-I96 PolarHBondContact O-N 3.23Å; I96-L98 PolarHBondContact O-N 3.14Å; I96-T100 HydrophobicContact CG2-CG2 4.07Å; I96-V101 HydrophobicContact CG2-CG2 3.94Å
97	S	87.7	Confident	74	Confident	58 Å²	58	115.8 Å²	115.8	41%	0.406	63%	0.626	S	S	.	*			trans	-60.3	141.1	-178.9	90.1	0	0	0	0	111	E95 W99 T100 V101	E95-S97 PolarHBondContact O-N 2.88Å; S97-W99 PolarHBondContact O-N 2.94Å; S97-W99 VanDerWaalsContact O-N 3.16Å; S97-T100 WeakPolarHBondContact O-CA 3.41Å; S97-T100 VanDerWaalsContact O-CB 3.27Å; S97-T100 WeakPolarHBondContact O-CB 3.35Å; S97-T100 PolarHBondContact O-N 3.25Å; S97-T100 PolarHBondContact OG-N 2.96Å; S97-T100 VanDerWaalsContact OG-N 3.14Å; S97-T100 PolarHBondContact OG-OG1 3.22Å; S97-V101 PolarHBondContact O-N 3.21Å
98	L	91.3	Very high	76.7	Confident	134 Å²	134	109 Å²	109	70%	0.702	61%	0.611	S	S	*	*	H	α-helix	trans	-53.4	-37.6	177	-179.3	63.2	0	0	0	111.7	I96 T100 V101 V102	I96-L98 PolarHBondContact O-N 3.14Å; L98-T100 VanDerWaalsContact C-N 3.33Å; L98-T100 PolarHBondContact O-N 3.45Å; L98-V101 PolarHBondContact O-N 3.4Å; L98-V101 VanDerWaalsContact O-N 3.16Å; L98-V102 WeakPolarHBondContact O-CG2 3.41Å; L98-V102 PolarHBondContact O-N 3.23Å
99	W	90.7	Very high	79.6	Confident	208 Å²	208	107.1 Å²	107.1	79%	0.788	60%	0.602	S	S	*	*	H	α-helix	trans	-62.8	-34.9	175.4	-70.8	110.8	0	0	0	113.4	S97 V101 V102 A103	S97-W99 PolarHBondContact O-N 2.94Å; S97-W99 VanDerWaalsContact O-N 3.16Å; W99-V101 VanDerWaalsContact C-N 3.34Å; W99-V102 PolarHBondContact O-N 2.95Å; W99-A103 VanDerWaalsContact O-CB 3.25Å; W99-A103 WeakPolarHBondContact O-CB 3.27Å; W99-A103 PolarHBondContact O-N 3.42Å
100	T	92.9	Very high	81.9	Confident	80 Å²	80	108.8 Å²	108.8	49%	0.491	59%	0.593	S	S	.	*	H	α-helix	trans	-64.3	-40.7	173.6	-49.1	0	0	0	0	110.9	I96 S97 L98 A104	I96-T100 HydrophobicContact CG2-CG2 4.07Å; S97-T100 WeakPolarHBondContact O-CA 3.41Å; S97-T100 VanDerWaalsContact O-CB 3.27Å; S97-T100 WeakPolarHBondContact O-CB 3.35Å; S97-T100 PolarHBondContact O-N 3.25Å; S97-T100 PolarHBondContact OG-N 2.96Å; S97-T100 VanDerWaalsContact OG-N 3.14Å; S97-T100 PolarHBondContact OG-OG1 3.22Å; L98-T100 VanDerWaalsContact C-N 3.33Å; L98-T100 PolarHBondContact O-N 3.45Å; T100-A104 WeakPolarHBondContact O-CB 3.25Å; T100-A104 PolarHBondContact O-N 2.93Å
101	V	93.8	Very high	84.6	Confident	67 Å²	67	107.2 Å²	107.2	41%	0.406	58%	0.583	S	S	.	*	H	α-helix	trans	-67	-46.5	177	-177	0	0	0	0	110.8	I96 S97 L98 W99 A103 A104 I105	I96-V101 HydrophobicContact CG2-CG2 3.94Å; S97-V101 PolarHBondContact O-N 3.21Å; L98-V101 PolarHBondContact O-N 3.4Å; L98-V101 VanDerWaalsContact O-N 3.16Å; W99-V101 VanDerWaalsContact C-N 3.34Å; V101-A103 PolarHBondContact O-N 3.11Å; V101-A104 WeakPolarHBondContact O-CB 3.46Å; V101-A104 PolarHBondContact O-N 3.04Å; V101-I105 HydrophobicContact CG1-CD1 4.05Å; V101-I105 WeakPolarHBondContact O-CG1 3.42Å; V101-I105 PolarHBondContact O-N 2.93Å
102	V	95.3	Very high	87.1	Confident	52 Å²	52	103.8 Å²	103.8	32%	0.315	57%	0.569	S	S	.	*	H	α-helix	trans	-60.7	-44	176.6	172.9	0	0	0	0	111.4	L98 W99 A104 I105 Q106	L98-V102 WeakPolarHBondContact O-CG2 3.41Å; L98-V102 PolarHBondContact O-N 3.23Å; W99-V102 PolarHBondContact O-N 2.95Å; V102-A104 VanDerWaalsContact C-N 3.33Å; V102-A104 PolarHBondContact O-N 2.94Å; V102-I105 PolarHBondContact O-N 2.99Å; V102-Q106 WeakPolarHBondContact O-CG 3.38Å; V102-Q106 PolarHBondContact O-N 3.06Å
103	A	94.9	Very high	89.2	Confident	53 Å²	53	102.9 Å²	102.9	44%	0.438	56%	0.558	S	S	.	*	H	α-helix	trans	-63.3	-37.9	176.6	0	0	0	0	0	112.4	W99 V101 A107	W99-A103 VanDerWaalsContact O-CB 3.25Å; W99-A103 WeakPolarHBondContact O-CB 3.27Å; W99-A103 PolarHBondContact O-N 3.42Å; V101-A103 PolarHBondContact O-N 3.11Å; A103-A107 WeakPolarHBondContact O-CB 3.46Å; A103-A107 PolarHBondContact O-N 2.96Å
104	A	94.2	Very high	91.2	Very high	55 Å²	55	98.6 Å²	98.6	46%	0.455	54%	0.536	S	S	.	.	H	α-helix	trans	-65.2	-42.9	174.3	0	0	0	0	0	112	T100 V101 V102 A107 V108	T100-A104 WeakPolarHBondContact O-CB 3.25Å; T100-A104 PolarHBondContact O-N 2.93Å; V101-A104 WeakPolarHBondContact O-CB 3.46Å; V101-A104 PolarHBondContact O-N 3.04Å; V102-A104 VanDerWaalsContact C-N 3.33Å; V102-A104 PolarHBondContact O-N 2.94Å; A104-A107 PolarHBondContact O-N 3.01Å; A104-V108 WeakPolarHBondContact O-CG2 3.32Å; A104-V108 PolarHBondContact O-N 3.38Å
105	I	94.5	Very high	92.8	Very high	105 Å²	105	99.6 Å²	99.6	54%	0.538	53%	0.527	S	S	.	.	H	α-helix	trans	-61.6	-49.2	176.1	-67.2	166.1	0	0	0	110.5	V101 V102 A107 V108 E109	V101-I105 HydrophobicContact CG1-CD1 4.05Å; V101-I105 WeakPolarHBondContact O-CG1 3.42Å; V101-I105 PolarHBondContact O-N 2.93Å; V102-I105 PolarHBondContact O-N 2.99Å; I105-A107 PolarHBondContact O-N 3.36Å; I105-V108 WeakPolarHBondContact O-CA 3.46Å; I105-V108 WeakPolarHBondContact O-CB 3.5Å; I105-V108 PolarHBondContact O-N 3.07Å; I105-E109 PolarHBondContact O-N 3.04Å
106	Q	96.5	Very high	94.1	Very high	80 Å²	80	92.7 Å²	92.7	37%	0.374	50%	0.503	S	S	.	.	H	α-helix	trans	-63	-28.2	176.4	-69.5	-176.5	0.7	0	0	113.4	V102 R110	V102-Q106 WeakPolarHBondContact O-CG 3.38Å; V102-Q106 PolarHBondContact O-N 3.06Å; Q106-R110 WeakPolarHBondContact O-CG 3.45Å; Q106-R110 PolarHBondContact O-N 3.02Å; Q106-R110 PolarHBondContact O-NH1 3.48Å; Q106-R110 VanDerWaalsContact O-NH1 3.16Å
107	A	95.4	Very high	94.8	Very high	56 Å²	56	90.4 Å²	90.4	46%	0.463	50%	0.498	S	S	.	.	H	α-helix	trans	-73.5	-32.9	173.8	0	0	0	0	0	112	A103 A104 I105 K111	A103-A107 WeakPolarHBondContact O-CB 3.46Å; A103-A107 PolarHBondContact O-N 2.96Å; A104-A107 PolarHBondContact O-N 3.01Å; I105-A107 PolarHBondContact O-N 3.36Å; A107-K111 WeakPolarHBondContact O-CB 3.5Å; A107-K111 PolarHBondContact O-N 3.26Å
108	V	96.4	Very high	95.1	Very high	93 Å²	93	93.7 Å²	93.7	56%	0.564	51%	0.507	S	S	*	.	H	α-helix	trans	-70.1	-45.7	172	172	0	0	0	0	110.8	A104 I105 K111 V112	A104-V108 WeakPolarHBondContact O-CG2 3.32Å; A104-V108 PolarHBondContact O-N 3.38Å; I105-V108 WeakPolarHBondContact O-CA 3.46Å; I105-V108 WeakPolarHBondContact O-CB 3.5Å; I105-V108 PolarHBondContact O-N 3.07Å; V108-K111 WeakPolarHBondContact O-CA 3.46Å; V108-K111 WeakPolarHBondContact O-CB 3.34Å; V108-K111 PolarHBondContact O-N 3.27Å; V108-V112 HydrophobicContact CG1-CG2 4.45Å; V108-V112 WeakPolarHBondContact O-CG2 3.43Å; V108-V112 PolarHBondContact O-N 2.86Å
109	E	96.8	Very high	95.2	Very high	113 Å²	113	92.2 Å²	92.2	53%	0.528	50%	0.499	S	S	.	.	H	α-helix	trans	-54.3	-56.9	177.8	-173.7	175.8	-156	0	0	111.7	I105 K111 V112 D113	I105-E109 PolarHBondContact O-N 3.04Å; E109-K111 PolarHBondContact O-N 2.94Å; E109-V112 WeakPolarHBondContact O-CA 3.46Å; E109-V112 WeakPolarHBondContact O-CB 3.48Å; E109-V112 PolarHBondContact O-N 3.36Å; E109-D113 PolarHBondContact O-N 3.43Å
110	R	96.2	Very high	95.3	Very high	152 Å²	152	88 Å²	88	57%	0.574	49%	0.491	S	S	*	.	H	α-helix	trans	-56	-28.9	175.5	-67.6	179.1	-164.6	102.2	1.2	113.5	Q106 A114	Q106-R110 WeakPolarHBondContact O-CG 3.45Å; Q106-R110 PolarHBondContact O-N 3.02Å; Q106-R110 PolarHBondContact O-NH1 3.48Å; Q106-R110 VanDerWaalsContact O-NH1 3.16Å; R110-A114 WeakPolarHBondContact O-CB 3.34Å; R110-A114 PolarHBondContact O-N 3.08Å; R110-A114 VanDerWaalsContact O-N 3.11Å
111	K	96.1	Very high	95.3	Very high	142 Å²	142	88.9 Å²	88.9	62%	0.617	49%	0.493	S	S	*	.	H	α-helix	trans	-76.7	-37.2	177	-171.3	176.1	-179.6	-179.9	0	111.6	A107 V108 E109 Q115	A107-K111 WeakPolarHBondContact O-CB 3.5Å; A107-K111 PolarHBondContact O-N 3.26Å; V108-K111 WeakPolarHBondContact O-CA 3.46Å; V108-K111 WeakPolarHBondContact O-CB 3.34Å; V108-K111 PolarHBondContact O-N 3.27Å; E109-K111 PolarHBondContact O-N 2.94Å; K111-Q115 VanDerWaalsContact O-CG 3.3Å; K111-Q115 WeakPolarHBondContact O-CG 3.3Å; K111-Q115 PolarHBondContact O-N 2.83Å
112	V	97.4	Very high	95.1	Very high	84 Å²	84	90.4 Å²	90.4	51%	0.509	50%	0.498	S	S	.	.	H	α-helix	trans	-63.7	-45.8	171.9	174.4	0	0	0	0	110.3	V108 E109 A114 Q115 A116	V108-V112 HydrophobicContact CG1-CG2 4.45Å; V108-V112 WeakPolarHBondContact O-CG2 3.43Å; V108-V112 PolarHBondContact O-N 2.86Å; E109-V112 WeakPolarHBondContact O-CA 3.46Å; E109-V112 WeakPolarHBondContact O-CB 3.48Å; E109-V112 PolarHBondContact O-N 3.36Å; V112-A114 PolarHBondContact O-N 3.25Å; V112-Q115 CarbonylContact O-C 3.58Å; V112-Q115 PolarHBondContact O-N 3.09Å; V112-Q115 VanDerWaalsContact O-N 3.09Å; V112-A116 PolarHBondContact O-N 3.04Å
113	D	97.1	Very high	94.9	Very high	90 Å²	90	93.6 Å²	93.6	48%	0.481	51%	0.51	S	S	.	.	H	α-helix	trans	-61.8	-41.4	177.6	-62.7	-35.7	0	0	0	112.7	E109 Q115 A116 S117	E109-D113 PolarHBondContact O-N 3.43Å; D113-Q115 VanDerWaalsContact C-N 3.32Å; D113-Q115 PolarHBondContact O-N 3.4Å; D113-A116 PolarHBondContact O-N 3.25Å; D113-S117 WeakPolarHBondContact O-CB 3.3Å; D113-S117 PolarHBondContact O-N 2.97Å; D113-S117 PolarHBondContact O-OG 3.35Å
114	A	95.7	Very high	94.6	Very high	48 Å²	48	93.3 Å²	93.3	40%	0.397	51%	0.512	S	S	.	.	H	α-helix	trans	-62.8	-38.9	174.2	0	0	0	0	0	111.8	R110 V112 Q118	R110-A114 WeakPolarHBondContact O-CB 3.34Å; R110-A114 PolarHBondContact O-N 3.08Å; R110-A114 VanDerWaalsContact O-N 3.11Å; V112-A114 PolarHBondContact O-N 3.25Å; A114-Q118 VanDerWaalsContact O-CG 3.3Å; A114-Q118 WeakPolarHBondContact O-CG 3.37Å; A114-Q118 PolarHBondContact O-N 2.88Å; A114-Q118 VanDerWaalsContact O-N 3.08Å
115	Q	96.8	Very high	94.3	Very high	103 Å²	103	98.7 Å²	98.7	48%	0.481	52%	0.521	S	S	.	.	H	α-helix	trans	-70.5	-39.6	175.5	-72.5	-176.4	-83.1	0	0	112.2	K111 V112 D113 Q118 L119	K111-Q115 VanDerWaalsContact O-CG 3.3Å; K111-Q115 WeakPolarHBondContact O-CG 3.3Å; K111-Q115 PolarHBondContact O-N 2.83Å; V112-Q115 CarbonylContact O-C 3.58Å; V112-Q115 PolarHBondContact O-N 3.09Å; V112-Q115 VanDerWaalsContact O-N 3.09Å; D113-Q115 VanDerWaalsContact C-N 3.32Å; D113-Q115 PolarHBondContact O-N 3.4Å; Q115-Q118 PolarHBondContact O-N 3.31Å; Q115-L119 WeakPolarHBondContact O-CG 3.42Å; Q115-L119 PolarHBondContact O-N 3.18Å
116	A	96	Very high	94.2	Very high	45 Å²	45	96.8 Å²	96.8	37%	0.372	51%	0.514	S	S	.	.	H	α-helix	trans	-61.3	-44.9	174.6	0	0	0	0	0	111.5	V112 D113 Q118 L119 L120	V112-A116 PolarHBondContact O-N 3.04Å; D113-A116 PolarHBondContact O-N 3.25Å; A116-Q118 VanDerWaalsContact C-N 3.31Å; A116-Q118 PolarHBondContact O-N 3.29Å; A116-L119 PolarHBondContact O-N 3.04Å; A116-L120 PolarHBondContact O-N 2.92Å
117	S	95.2	Very high	93.9	Very high	80 Å²	80	94.6 Å²	94.6	56%	0.559	51%	0.513	S	S	*	.	H	α-helix	trans	-61.3	-38.2	175.1	-57.2	0	0	0	0	112.5	D113 N121	D113-S117 WeakPolarHBondContact O-CB 3.3Å; D113-S117 PolarHBondContact O-N 2.97Å; D113-S117 PolarHBondContact O-OG 3.35Å; S117-N121 PolarHBondContact O-N 2.93Å
118	Q	94.6	Very high	93.6	Very high	128 Å²	128	96 Å²	96	60%	0.598	52%	0.515	S	S	*	.	H	α-helix	trans	-67.9	-39.1	174.1	-76.5	177.7	-11	0	0	112.6	A114 Q115 A116 N121 L122	A114-Q118 VanDerWaalsContact O-CG 3.3Å; A114-Q118 WeakPolarHBondContact O-CG 3.37Å; A114-Q118 PolarHBondContact O-N 2.88Å; A114-Q118 VanDerWaalsContact O-N 3.08Å; Q115-Q118 PolarHBondContact O-N 3.31Å; A116-Q118 VanDerWaalsContact C-N 3.31Å; A116-Q118 PolarHBondContact O-N 3.29Å; Q118-N121 PolarHBondContact O-N 3.46Å; Q118-L122 VanDerWaalsContact O-CG 3.31Å; Q118-L122 WeakPolarHBondContact O-CG 3.31Å; Q118-L122 PolarHBondContact O-N 2.74Å
119	L	93.2	Very high	93.3	Very high	102 Å²	102	94.2 Å²	94.2	53%	0.534	51%	0.511	S	S	.	.	H	α-helix	trans	-63.5	-46.9	176.8	-72.5	171.7	0	0	0	111.5	Q115 A116 N121 L122 E123	Q115-L119 WeakPolarHBondContact O-CG 3.42Å; Q115-L119 PolarHBondContact O-N 3.18Å; A116-L119 PolarHBondContact O-N 3.04Å; L119-N121 VanDerWaalsContact C-N 3.31Å; L119-N121 PolarHBondContact O-N 3.37Å; L119-L122 CarbonylContact O-C 3.59Å; L119-L122 WeakPolarHBondContact O-CA 3.27Å; L119-L122 WeakPolarHBondContact O-CB 3.28Å; L119-L122 PolarHBondContact O-N 3.25Å; L119-E123 WeakPolarHBondContact O-CG 3.41Å; L119-E123 PolarHBondContact O-N 3.06Å
120	L	92.1	Very high	93.1	Very high	119 Å²	119	93.7 Å²	93.7	62%	0.623	51%	0.508	S	S	*	.	H	α-helix	trans	-59.2	-39.4	176.6	-71.5	169.8	0	0	0	112.7	A116 E123 G124	A116-L120 PolarHBondContact O-N 2.92Å; L120-E123 PolarHBondContact O-N 3.34Å; L120-G124 PolarHBondContact O-N 3.06Å
121	N	92.2	Very high	92.9	Very high	99 Å²	99	93.5 Å²	93.5	53%	0.529	51%	0.512	S	S	.	.	H	α-helix	trans	-64.8	-41.5	174.3	-169.8	-83.1	0	0	0	111.9	S117 Q118 L119 R125	S117-N121 PolarHBondContact O-N 2.93Å; Q118-N121 PolarHBondContact O-N 3.46Å; L119-N121 VanDerWaalsContact C-N 3.31Å; L119-N121 PolarHBondContact O-N 3.37Å; N121-R125 WeakPolarHBondContact O-CB 3.25Å; N121-R125 VanDerWaalsContact O-CG 3.25Å; N121-R125 WeakPolarHBondContact O-CG 3.46Å; N121-R125 PolarHBondContact O-N 2.62Å; N121-R125 VanDerWaalsContact OD1-CD 3.27Å; N121-R125 WeakPolarHBondContact OD1-CD 3.44Å
122	L	90.1	Very high	92.8	Very high	99 Å²	99	93.7 Å²	93.7	52%	0.518	51%	0.512	S	S	.	.	H	α-helix	trans	-65.2	-40.2	176.7	-71.9	170	0	0	0	111.8	Q118 L119 R125 T126	Q118-L122 VanDerWaalsContact O-CG 3.31Å; Q118-L122 WeakPolarHBondContact O-CG 3.31Å; Q118-L122 PolarHBondContact O-N 2.74Å; L119-L122 CarbonylContact O-C 3.59Å; L119-L122 WeakPolarHBondContact O-CA 3.27Å; L119-L122 WeakPolarHBondContact O-CB 3.28Å; L119-L122 PolarHBondContact O-N 3.25Å; L122-R125 CarbonylContact O-C 3.57Å; L122-R125 PolarHBondContact O-N 3.44Å; L122-T126 PolarHBondContact O-N 3.44Å; L122-T126 PolarHBondContact O-OG1 2.85Å
123	E	90.8	Very high	92.6	Very high	120 Å²	120	94.1 Å²	94.1	56%	0.561	51%	0.511	S	S	*	.	H	α-helix	trans	-64.3	-45.1	176.8	-74.4	174.9	176.2	0	0	112.3	L119 L120 R125 T126 G127	L119-E123 WeakPolarHBondContact O-CG 3.41Å; L119-E123 PolarHBondContact O-N 3.06Å; L120-E123 PolarHBondContact O-N 3.34Å; E123-R125 VanDerWaalsContact C-N 3.28Å; E123-R125 PolarHBondContact O-N 2.9Å; E123-T126 WeakPolarHBondContact CA-OG1 3.45Å; E123-T126 PolarHBondContact O-N 3.04Å; E123-T126 PolarHBondContact O-OG1 3.21Å; E123-G127 PolarHBondContact O-N 3.01Å
124	G	89.4	Confident	92.4	Very high	47 Å²	47	92.4 Å²	92.4	49%	0.485	51%	0.51	S	S	.	.	H	α-helix	trans	-59.8	-39.1	172.5	0	0	0	0	0	112.3	L120 T128	L120-G124 PolarHBondContact O-N 3.06Å; G124-T128 WeakPolarHBondContact O-CG2 3.22Å; G124-T128 PolarHBondContact O-N 2.86Å; G124-T128 VanDerWaalsContact O-N 3.1Å; G124-T128 PolarHBondContact O-OG1 2.81Å
125	R	88.3	Confident	92.3	Very high	168 Å²	168	94.2 Å²	94.2	63%	0.634	51%	0.513	S	S	*	.	H	α-helix	trans	-69.4	-37.9	175.4	-72.1	176.1	67.8	154.6	4.9	112.7	N121 L122 E123 T128 A129	N121-R125 WeakPolarHBondContact O-CB 3.25Å; N121-R125 VanDerWaalsContact O-CG 3.25Å; N121-R125 WeakPolarHBondContact O-CG 3.46Å; N121-R125 PolarHBondContact O-N 2.62Å; N121-R125 VanDerWaalsContact OD1-CD 3.27Å; N121-R125 WeakPolarHBondContact OD1-CD 3.44Å; L122-R125 CarbonylContact O-C 3.57Å; L122-R125 PolarHBondContact O-N 3.44Å; E123-R125 VanDerWaalsContact C-N 3.28Å; E123-R125 PolarHBondContact O-N 2.9Å; R125-T128 PolarHBondContact O-OG1 3.4Å; R125-A129 WeakPolarHBondContact O-CB 3.42Å; R125-A129 PolarHBondContact O-N 3.13Å; R125-A129 VanDerWaalsContact O-N 3.09Å
126	T	91.1	Very high	92.1	Very high	65 Å²	65	93.1 Å²	93.1	40%	0.399	52%	0.515	S	S	.	.	H	α-helix	trans	-68.8	-41.6	174.6	48.5	0	0	0	0	111.4	L122 E123 T128 A129 E130	L122-T126 PolarHBondContact O-N 3.44Å; L122-T126 PolarHBondContact O-OG1 2.85Å; E123-T126 WeakPolarHBondContact CA-OG1 3.45Å; E123-T126 PolarHBondContact O-N 3.04Å; E123-T126 PolarHBondContact O-OG1 3.21Å; T126-T128 PolarHBondContact O-N 3.08Å; T126-A129 CarbonylContact O-C 3.37Å; T126-A129 WeakPolarHBondContact O-CA 3.41Å; T126-A129 WeakPolarHBondContact O-CB 3.33Å; T126-A129 PolarHBondContact O-N 3.1Å; T126-E130 WeakPolarHBondContact O-CG 3.5Å; T126-E130 PolarHBondContact O-N 3.38Å
127	G	90.2	Very high	92.1	Very high	33 Å²	33	97.1 Å²	97.1	34%	0.34	53%	0.526	S	S	.	.	H	α-helix	trans	-60.4	-40.6	176	0	0	0	0	0	113.3	E123 E130 K131	E123-G127 PolarHBondContact O-N 3.01Å; G127-E130 PolarHBondContact O-N 3.15Å; G127-K131 PolarHBondContact O-N 3.32Å
128	T	90.5	Very high	92	Very high	85 Å²	85	99.5 Å²	99.5	52%	0.521	53%	0.527	S	S	.	.	H	α-helix	trans	-68.5	-31.3	172.8	55.9	0	0	0	0	113.3	G124 R125 T126 K132	G124-T128 WeakPolarHBondContact O-CG2 3.22Å; G124-T128 PolarHBondContact O-N 2.86Å; G124-T128 VanDerWaalsContact O-N 3.1Å; G124-T128 PolarHBondContact O-OG1 2.81Å; R125-T128 PolarHBondContact O-OG1 3.4Å; T126-T128 PolarHBondContact O-N 3.08Å; T128-K132 WeakPolarHBondContact O-CG 3.09Å; T128-K132 PolarHBondContact O-N 2.83Å
129	A	90.4	Very high	92	Very high	56 Å²	56	97.3 Å²	97.3	46%	0.463	52%	0.522	S	S	.	.	H	α-helix	trans	-72.2	-38	173.4	0	0	0	0	0	112.3	R125 T126 K132 L133	R125-A129 WeakPolarHBondContact O-CB 3.42Å; R125-A129 PolarHBondContact O-N 3.13Å; R125-A129 VanDerWaalsContact O-N 3.09Å; T126-A129 CarbonylContact O-C 3.37Å; T126-A129 WeakPolarHBondContact O-CA 3.41Å; T126-A129 WeakPolarHBondContact O-CB 3.33Å; T126-A129 PolarHBondContact O-N 3.1Å; A129-K132 PolarHBondContact O-N 2.9Å; A129-L133 WeakPolarHBondContact O-CB 3.46Å; A129-L133 PolarHBondContact O-N 3.46Å
130	E	91.8	Very high	92	Very high	103 Å²	103	95.4 Å²	95.4	48%	0.481	52%	0.521	S	S	.	.	H	α-helix	trans	-64.3	-44.7	174.8	-75.9	169.9	-177.7	0	0	111.5	T126 G127 K132 L133 A134 L510	T126-E130 WeakPolarHBondContact O-CG 3.5Å; T126-E130 PolarHBondContact O-N 3.38Å; G127-E130 PolarHBondContact O-N 3.15Å; E130-K132 PolarHBondContact O-N 3.35Å; E130-L133 WeakPolarHBondContact O-CB 3.36Å; E130-L133 PolarHBondContact O-N 3.19Å; E130-L133 VanDerWaalsContact O-N 3.12Å; E130-A134 PolarHBondContact O-N 3.38Å; E130-L510 HydrophobicContact CG-CD2 4.07Å
131	K	92.8	Very high	92.1	Very high	147 Å²	147	93.6 Å²	93.6	64%	0.639	52%	0.515	S	S	*	.	H	α-helix	trans	-58.3	-47.9	173.6	-174.9	175.4	178.9	178.9	0	111.7	G127 L133 A134 D135	G127-K131 PolarHBondContact O-N 3.32Å; K131-L133 VanDerWaalsContact C-N 3.26Å; K131-L133 PolarHBondContact O-N 3.15Å; K131-A134 PolarHBondContact O-N 3.29Å; K131-D135 PolarHBondContact O-N 3.07Å
132	K	93.1	Very high	92.2	Very high	146 Å²	146	93.6 Å²	93.6	64%	0.635	51%	0.512	S	S	*	.	H	α-helix	trans	-60.8	-34.9	175.4	-73.4	177.7	-179.8	-173.1	0	112.5	T128 A129 E130 C136	T128-K132 WeakPolarHBondContact O-CG 3.09Å; T128-K132 PolarHBondContact O-N 2.83Å; A129-K132 PolarHBondContact O-N 2.9Å; E130-K132 PolarHBondContact O-N 3.35Å; K132-C136 WeakPolarHBondContact O-CB 3.5Å; K132-C136 PolarHBondContact O-N 3.34Å; K132-C136 PolarHBondContact O-SG 3.04Å
133	L	94	Very high	92.4	Very high	93 Å²	93	95.1 Å²	95.1	49%	0.487	51%	0.514	S	S	.	.	H	α-helix	trans	-68.3	-40.5	176.2	-173.7	63.8	0	0	0	111.5	A129 E130 K131 C136 E137	A129-L133 WeakPolarHBondContact O-CB 3.46Å; A129-L133 PolarHBondContact O-N 3.46Å; E130-L133 WeakPolarHBondContact O-CB 3.36Å; E130-L133 PolarHBondContact O-N 3.19Å; E130-L133 VanDerWaalsContact O-N 3.12Å; K131-L133 VanDerWaalsContact C-N 3.26Å; K131-L133 PolarHBondContact O-N 3.15Å; L133-C136 PolarHBondContact O-N 3.23Å; L133-E137 WeakPolarHBondContact O-CB 3.48Å; L133-E137 PolarHBondContact O-N 3.09Å
134	A	93.1	Very high	92.5	Very high	54 Å²	54	90.6 Å²	90.6	45%	0.446	50%	0.5	S	S	.	.	H	α-helix	trans	-65.8	-40.7	174.8	0	0	0	0	0	112.5	E130 K131 E137 K138	E130-A134 PolarHBondContact O-N 3.38Å; K131-A134 PolarHBondContact O-N 3.29Å; A134-E137 PolarHBondContact O-N 3.39Å; A134-K138 PolarHBondContact O-N 3.1Å
135	D	93	Very high	92.7	Very high	87 Å²	87	92.5 Å²	92.5	47%	0.465	50%	0.499	S	S	.	.	H	α-helix	trans	-63	-41.2	173.8	-66	-33.2	0	0	0	111.2	K131 K138 T139	K131-D135 PolarHBondContact O-N 3.07Å; D135-K138 PolarHBondContact O-N 2.88Å; D135-T139 PolarHBondContact O-N 3.24Å; D135-T139 VanDerWaalsContact O-N 3.12Å; D135-T139 PolarHBondContact O-OG1 2.8Å
136	C	92.8	Very high	93	Very high	79 Å²	79	90.1 Å²	90.1	53%	0.534	50%	0.495	S	S	.	.	H	α-helix	trans	-65.5	-35.8	172.4	-75.3	0	0	0	0	113.2	K132 L133 T139 A140	K132-C136 WeakPolarHBondContact O-CB 3.5Å; K132-C136 PolarHBondContact O-N 3.34Å; K132-C136 PolarHBondContact O-SG 3.04Å; L133-C136 PolarHBondContact O-N 3.23Å; C136-T139 WeakPolarHBondContact CA-OG1 3.48Å; C136-T139 PolarHBondContact O-OG1 3.21Å; C136-T139 VanDerWaalsContact O-OG1 3.08Å; C136-A140 WeakPolarHBondContact O-CB 3.49Å; C136-A140 PolarHBondContact O-N 2.96Å; C136-A140 VanDerWaalsContact O-N 3.11Å
137	E	94.9	Very high	93	Very high	129 Å²	129	90.2 Å²	90.2	60%	0.603	49%	0.492	S	S	*	.	H	α-helix	trans	-67.1	-44.1	175.6	-177.5	168	-172.2	0	0	111	L133 A134 T139 A140 V141	L133-E137 WeakPolarHBondContact O-CB 3.48Å; L133-E137 PolarHBondContact O-N 3.09Å; A134-E137 PolarHBondContact O-N 3.39Å; E137-T139 PolarHBondContact O-N 2.96Å; E137-A140 PolarHBondContact O-N 3.42Å; E137-V141 WeakPolarHBondContact O-CG2 3.1Å; E137-V141 PolarHBondContact O-N 3.09Å
138	K	94.7	Very high	93.2	Very high	131 Å²	131	95.1 Å²	95.1	57%	0.57	51%	0.506	S	S	*	.	H	α-helix	trans	-58.3	-50	176.5	-171.8	-175.2	178.7	-156.7	0	112.1	A134 D135 A140 V141 E142	A134-K138 PolarHBondContact O-N 3.1Å; D135-K138 PolarHBondContact O-N 2.88Å; K138-A140 VanDerWaalsContact C-N 3.29Å; K138-A140 PolarHBondContact O-N 2.8Å; K138-V141 PolarHBondContact O-N 3.42Å; K138-V141 VanDerWaalsContact O-N 3.17Å; K138-E142 WeakPolarHBondContact CE-OE1 3.35Å; K138-E142 IonicContact NZ-OE1 3.4Å; K138-E142 WeakPolarHBondContact O-CG 3.47Å; K138-E142 PolarHBondContact O-N 2.82Å
139	T	93.7	Very high	93.3	Very high	82 Å²	82	94.4 Å²	94.4	50%	0.503	50%	0.504	S	S	.	.	H	α-helix	trans	-64.6	-32.9	178.7	51.8	0	0	0	0	112.6	D135 C136 E137 F143	D135-T139 PolarHBondContact O-N 3.24Å; D135-T139 VanDerWaalsContact O-N 3.12Å; D135-T139 PolarHBondContact O-OG1 2.8Å; C136-T139 WeakPolarHBondContact CA-OG1 3.48Å; C136-T139 PolarHBondContact O-OG1 3.21Å; C136-T139 VanDerWaalsContact O-OG1 3.08Å; E137-T139 PolarHBondContact O-N 2.96Å; T139-F143 WeakPolarHBondContact O-CB 3.49Å; T139-F143 PolarHBondContact O-N 3.23Å
140	A	93.4	Very high	93.5	Very high	62 Å²	62	97 Å²	97	51%	0.512	51%	0.505	S	S	.	.	H	α-helix	trans	-68.1	-36.8	173.2	0	0	0	0	0	113	C136 E137 K138 G144	C136-A140 WeakPolarHBondContact O-CB 3.49Å; C136-A140 PolarHBondContact O-N 2.96Å; C136-A140 VanDerWaalsContact O-N 3.11Å; E137-A140 PolarHBondContact O-N 3.42Å; K138-A140 VanDerWaalsContact C-N 3.29Å; K138-A140 PolarHBondContact O-N 2.8Å; A140-G144 PolarHBondContact O-N 3.02Å
141	V	94.3	Very high	93.6	Very high	81 Å²	81	100.1 Å²	100.1	49%	0.491	51%	0.513	S	S	.	.	H	α-helix	trans	-68.2	-44.7	173.9	171.6	0	0	0	0	111	E137 K138 F143 G144 N145	E137-V141 WeakPolarHBondContact O-CG2 3.1Å; E137-V141 PolarHBondContact O-N 3.09Å; K138-V141 PolarHBondContact O-N 3.42Å; K138-V141 VanDerWaalsContact O-N 3.17Å; V141-F143 VanDerWaalsContact C-N 3.34Å; V141-F143 PolarHBondContact O-N 2.99Å; V141-G144 WeakPolarHBondContact O-CA 3.35Å; V141-G144 PolarHBondContact O-N 3.06Å; V141-G144 VanDerWaalsContact O-N 3.12Å; V141-N145 VanDerWaalsContact O-CG 3.28Å; V141-N145 PolarHBondContact O-N 3.18Å; V141-N145 PolarHBondContact O-OD1 3.33Å
142	E	93.7	Very high	93.7	Very high	98 Å²	98	96 Å²	96	46%	0.458	51%	0.506	S	S	.	.	H	α-helix	trans	-59.1	-43.6	175.8	-71.9	170	173.5	0	0	111.7	K138 N145 H146	K138-E142 WeakPolarHBondContact CE-OE1 3.35Å; K138-E142 IonicContact NZ-OE1 3.4Å; K138-E142 WeakPolarHBondContact O-CG 3.47Å; K138-E142 PolarHBondContact O-N 2.82Å; E142-N145 PolarHBondContact O-N 3.22Å; E142-H146 PolarHBondContact O-N 3.13Å
143	F	95.1	Very high	93.8	Very high	131 Å²	131	93.2 Å²	93.2	58%	0.575	50%	0.501	S	S	*	.	H	α-helix	trans	-63.4	-40.3	173.4	-176.1	-97.1	0	0	0	112.4	T139 V141 H146 M147	T139-F143 WeakPolarHBondContact O-CB 3.49Å; T139-F143 PolarHBondContact O-N 3.23Å; V141-F143 VanDerWaalsContact C-N 3.34Å; V141-F143 PolarHBondContact O-N 2.99Å; F143-H146 PolarHBondContact O-N 3.05Å; F143-M147 HydrophobicContact CD1-CG 4.08Å; F143-M147 HydrophobicContact CE1-CG 3.65Å; F143-M147 HydrophobicContact CE1-SD 4.38Å; F143-M147 HydrophobicContact CE2-CG 4.32Å; F143-M147 HydrophobicContact CE2-SD 4.45Å; F143-M147 HydrophobicContact CZ-CG 3.78Å; F143-M147 HydrophobicContact CZ-SD 3.96Å; F143-M147 VanDerWaalsContact O-CG 3.32Å; F143-M147 WeakPolarHBondContact O-CG 3.43Å; F143-M147 PolarHBondContact O-N 3.07Å
144	G	93.4	Very high	93.8	Very high	26 Å²	26	92.7 Å²	92.7	27%	0.268	50%	0.498	S	S	.	.	H	α-helix	trans	-56.3	-52.4	173.4	0	0	0	0	0	112.1	A140 V141 H146 M147 E148	A140-G144 PolarHBondContact O-N 3.02Å; V141-G144 WeakPolarHBondContact O-CA 3.35Å; V141-G144 PolarHBondContact O-N 3.06Å; V141-G144 VanDerWaalsContact O-N 3.12Å; G144-H146 VanDerWaalsContact C-N 3.34Å; G144-H146 PolarHBondContact O-N 2.88Å; G144-M147 PolarHBondContact O-N 3.29Å; G144-E148 WeakPolarHBondContact O-CG 3.46Å; G144-E148 PolarHBondContact O-N 2.66Å
145	N	93.3	Very high	93.8	Very high	87 Å²	87	92 Å²	92	47%	0.465	50%	0.496	S	S	.	.	H	α-helix	trans	-60.6	-40	178.9	-63.6	-16.6	0	0	0	112.5	V141 E142 E148 S149	V141-N145 VanDerWaalsContact O-CG 3.28Å; V141-N145 PolarHBondContact O-N 3.18Å; V141-N145 PolarHBondContact O-OD1 3.33Å; E142-N145 PolarHBondContact O-N 3.22Å; N145-E148 PolarHBondContact O-N 3.28Å; N145-S149 WeakPolarHBondContact O-CB 3.48Å; N145-S149 PolarHBondContact O-N 2.83Å; N145-S149 PolarHBondContact O-OG 3.37Å
146	H	93.2	Very high	93.8	Very high	118 Å²	118	91.3 Å²	91.3	55%	0.546	50%	0.495	S	S	.	.	H	α-helix	trans	-65.1	-41.4	176.3	-173.6	60.5	0	0	0	112.2	E142 F143 G144 K150	E142-H146 PolarHBondContact O-N 3.13Å; F143-H146 PolarHBondContact O-N 3.05Å; G144-H146 VanDerWaalsContact C-N 3.34Å; G144-H146 PolarHBondContact O-N 2.88Å; H146-K150 PolarHBondContact O-N 3.19Å; H146-K150 VanDerWaalsContact O-N 3.1Å
147	M	92.2	Very high	93.9	Very high	67 Å²	67	91.9 Å²	91.9	33%	0.33	49%	0.493	S	S	.	.	H	α-helix	trans	-66.2	-45.8	174.8	-69.8	-63.6	-70.5	0	0	111.2	F143 G144 S149 K150 W151	F143-M147 HydrophobicContact CD1-CG 4.08Å; F143-M147 HydrophobicContact CE1-CG 3.65Å; F143-M147 HydrophobicContact CE1-SD 4.38Å; F143-M147 HydrophobicContact CE2-CG 4.32Å; F143-M147 HydrophobicContact CE2-SD 4.45Å; F143-M147 HydrophobicContact CZ-CG 3.78Å; F143-M147 HydrophobicContact CZ-SD 3.96Å; F143-M147 VanDerWaalsContact O-CG 3.32Å; F143-M147 WeakPolarHBondContact O-CG 3.43Å; F143-M147 PolarHBondContact O-N 3.07Å; G144-M147 PolarHBondContact O-N 3.29Å; M147-S149 VanDerWaalsContact C-N 3.32Å; M147-S149 PolarHBondContact O-N 3.27Å; M147-K150 PolarHBondContact O-N 2.8Å; M147-W151 PolarHBondContact O-N 2.84Å
148	E	93.6	Very high	93.7	Very high	135 Å²	135	91.9 Å²	91.9	63%	0.631	50%	0.496	S	S	*	.	H	α-helix	trans	-58.9	-41.5	176.7	-73.4	-177.6	179	0	0	112.3	G144 N145 K150 W151 A152	G144-E148 WeakPolarHBondContact O-CG 3.46Å; G144-E148 PolarHBondContact O-N 2.66Å; N145-E148 PolarHBondContact O-N 3.28Å; E148-K150 PolarHBondContact O-N 3.48Å; E148-W151 PolarHBondContact O-N 3.15Å; E148-A152 WeakPolarHBondContact O-CB 3.38Å; E148-A152 PolarHBondContact O-N 3.09Å
149	S	93.6	Very high	93.6	Very high	70 Å²	70	92.8 Å²	92.8	49%	0.49	50%	0.502	S	S	.	.	H	α-helix	trans	-60.9	-44.3	174.8	-56.5	0	0	0	0	111.9	N145 M147 A152 V153	N145-S149 WeakPolarHBondContact O-CB 3.48Å; N145-S149 PolarHBondContact O-N 2.83Å; N145-S149 PolarHBondContact O-OG 3.37Å; M147-S149 VanDerWaalsContact C-N 3.32Å; M147-S149 PolarHBondContact O-N 3.27Å; S149-A152 PolarHBondContact O-N 3.24Å; S149-V153 PolarHBondContact O-N 2.88Å
150	K	94.3	Very high	93.6	Very high	110 Å²	110	94.3 Å²	94.3	48%	0.478	50%	0.504	S	S	.	.	H	α-helix	trans	-65.7	-41.3	175.2	-77.4	175.2	164.5	171.5	0	112.5	H146 M147 E148 A152 V153 L154	H146-K150 PolarHBondContact O-N 3.19Å; H146-K150 VanDerWaalsContact O-N 3.1Å; M147-K150 PolarHBondContact O-N 2.8Å; E148-K150 PolarHBondContact O-N 3.48Å; K150-A152 VanDerWaalsContact C-N 3.29Å; K150-A152 PolarHBondContact O-N 2.89Å; K150-V153 PolarHBondContact O-N 2.87Å; K150-L154 WeakPolarHBondContact O-CG 3.49Å; K150-L154 PolarHBondContact O-N 3.49Å
151	W	94.3	Very high	93.5	Very high	170 Å²	170	98.5 Å²	98.5	64%	0.644	51%	0.507	S	S	*	.	H	α-helix	trans	-64.3	-33.2	175.4	-74.9	118.2	0	0	0	112.4	M147 E148 L154 G155	M147-W151 PolarHBondContact O-N 2.84Å; E148-W151 PolarHBondContact O-N 3.15Å; W151-L154 HydrophobicContact CE3-CD1 4.01Å; W151-L154 HydrophobicContact CZ3-CD1 4.18Å; W151-G155 PolarHBondContact O-N 3.46Å
152	A	94.2	Very high	93.4	Very high	60 Å²	60	95.8 Å²	95.8	50%	0.496	50%	0.496	S	S	.	.	H	α-helix	trans	-65.3	-46	173.9	0	0	0	0	0	111.9	E148 S149 K150 G155 T156	E148-A152 WeakPolarHBondContact O-CB 3.38Å; E148-A152 PolarHBondContact O-N 3.09Å; S149-A152 PolarHBondContact O-N 3.24Å; K150-A152 VanDerWaalsContact C-N 3.29Å; K150-A152 PolarHBondContact O-N 2.89Å; A152-G155 WeakPolarHBondContact O-CA 3.35Å; A152-G155 PolarHBondContact O-N 3.11Å; A152-G155 VanDerWaalsContact O-N 3.1Å; A152-T156 PolarHBondContact O-N 3.5Å
153	V	95.1	Very high	93.3	Very high	88 Å²	88	95.2 Å²	95.2	53%	0.533	50%	0.495	S	S	.	.	H	α-helix	trans	-63.2	-40.7	176	175.6	0	0	0	0	111.8	S149 K150 G155 T156 L157	S149-V153 PolarHBondContact O-N 2.88Å; K150-V153 PolarHBondContact O-N 2.87Å; V153-G155 VanDerWaalsContact C-N 3.3Å; V153-G155 PolarHBondContact O-N 3.31Å; V153-T156 PolarHBondContact O-N 3.4Å; V153-T156 PolarHBondContact O-OG1 3.13Å; V153-L157 HydrophobicContact CG1-CD1 4.2Å; V153-L157 WeakPolarHBondContact O-CG 3.39Å; V153-L157 PolarHBondContact O-N 2.73Å
154	L	93.7	Very high	93.1	Very high	81 Å²	81	94.1 Å²	94.1	42%	0.424	50%	0.495	S	S	.	.	H	α-helix	trans	-62	-41.2	171.8	-70.9	172.9	0	0	0	111.1	K150 W151 T156 L157 L158	K150-L154 WeakPolarHBondContact O-CG 3.49Å; K150-L154 PolarHBondContact O-N 3.49Å; W151-L154 HydrophobicContact CE3-CD1 4.01Å; W151-L154 HydrophobicContact CZ3-CD1 4.18Å; L154-T156 VanDerWaalsContact C-N 3.34Å; L154-T156 PolarHBondContact O-N 3.39Å; L154-L157 PolarHBondContact O-N 3.38Å; L154-L158 WeakPolarHBondContact O-CB 3.42Å; L154-L158 WeakPolarHBondContact O-CD1 3.46Å; L154-L158 PolarHBondContact O-N 3.48Å
155	G	93.6	Very high	93	Very high	39 Å²	39	98.3 Å²	98.3	40%	0.402	51%	0.507	S	S	.	.	H	α-helix	trans	-57.3	-42	175.5	0	0	0	0	0	113.6	W151 A152 V153 Q159	W151-G155 PolarHBondContact O-N 3.46Å; A152-G155 WeakPolarHBondContact O-CA 3.35Å; A152-G155 PolarHBondContact O-N 3.11Å; A152-G155 VanDerWaalsContact O-N 3.1Å; V153-G155 VanDerWaalsContact C-N 3.3Å; V153-G155 PolarHBondContact O-N 3.31Å; G155-Q159 PolarHBondContact O-N 3.17Å; G155-Q159 VanDerWaalsContact O-N 3.15Å
156	T	93.3	Very high	92.8	Very high	73 Å²	73	102 Å²	102	45%	0.448	52%	0.515	S	S	.	.	H	α-helix	trans	-69.5	-43.2	176.1	53.7	0	0	0	0	111.9	A152 V153 L154 L158 Q159 E160	A152-T156 PolarHBondContact O-N 3.5Å; V153-T156 PolarHBondContact O-N 3.4Å; V153-T156 PolarHBondContact O-OG1 3.13Å; L154-T156 VanDerWaalsContact C-N 3.34Å; L154-T156 PolarHBondContact O-N 3.39Å; T156-L158 PolarHBondContact O-N 3.46Å; T156-Q159 WeakPolarHBondContact O-CB 3.4Å; T156-Q159 PolarHBondContact O-N 3.34Å; T156-Q159 VanDerWaalsContact O-N 3.08Å; T156-E160 WeakPolarHBondContact O-CG 3.49Å; T156-E160 PolarHBondContact O-N 3.12Å
157	L	93.5	Very high	92.6	Very high	92 Å²	92	104.3 Å²	104.3	48%	0.482	52%	0.519	S	S	.	.	H	α-helix	trans	-61.4	-40.8	176.7	-71.1	169.6	0	0	0	112.4	V153 L154 Q159 E160 Y161	V153-L157 HydrophobicContact CG1-CD1 4.2Å; V153-L157 WeakPolarHBondContact O-CG 3.39Å; V153-L157 PolarHBondContact O-N 2.73Å; L154-L157 PolarHBondContact O-N 3.38Å; L157-Q159 VanDerWaalsContact C-N 3.31Å; L157-Q159 PolarHBondContact O-N 3Å; L157-E160 PolarHBondContact O-N 3.42Å; L157-Y161 WeakPolarHBondContact O-CB 3.46Å; L157-Y161 PolarHBondContact O-N 2.89Å
158	L	92.3	Very high	92.5	Very high	128 Å²	128	106.8 Å²	106.8	67%	0.67	53%	0.533	S	S	*	.	H	α-helix	trans	-63.1	-35.6	173.4	-91	135.1	0	0	0	112.4	L154 T156 G162	L154-L158 WeakPolarHBondContact O-CB 3.42Å; L154-L158 WeakPolarHBondContact O-CD1 3.46Å; L154-L158 PolarHBondContact O-N 3.48Å; T156-L158 PolarHBondContact O-N 3.46Å; L158-G162 PolarHBondContact O-N 3.41Å; L158-G162 VanDerWaalsContact O-N 3.12Å
159	Q	91.9	Very high	92.1	Very high	151 Å²	151	105.7 Å²	105.7	71%	0.706	53%	0.528	S	S	*	.	H	α-helix	trans	-71.2	-40.9	175.5	-178.7	176.2	-16.6	0	0	112.1	G155 T156 L157 G162 L163	G155-Q159 PolarHBondContact O-N 3.17Å; G155-Q159 VanDerWaalsContact O-N 3.15Å; T156-Q159 WeakPolarHBondContact O-CB 3.4Å; T156-Q159 PolarHBondContact O-N 3.34Å; T156-Q159 VanDerWaalsContact O-N 3.08Å; L157-Q159 VanDerWaalsContact C-N 3.31Å; L157-Q159 PolarHBondContact O-N 3Å; Q159-G162 PolarHBondContact O-N 2.94Å; Q159-L163 PolarHBondContact O-N 2.92Å; Q159-L163 VanDerWaalsContact O-N 3.08Å
160	E	92.7	Very high	91.5	Very high	113 Å²	113	107.1 Å²	107.1	53%	0.528	53%	0.53	S	S	.	.	H	α-helix	trans	-64.8	-44.3	175.1	-73.2	178.3	167.7	0	0	111.6	T156 L157 G162 L163 L164	T156-E160 WeakPolarHBondContact O-CG 3.49Å; T156-E160 PolarHBondContact O-N 3.12Å; L157-E160 PolarHBondContact O-N 3.42Å; E160-G162 VanDerWaalsContact C-N 3.34Å; E160-G162 PolarHBondContact O-N 2.9Å; E160-L163 WeakPolarHBondContact O-CA 3.49Å; E160-L163 WeakPolarHBondContact O-CB 3.48Å; E160-L163 PolarHBondContact O-N 3.26Å; E160-L164 PolarHBondContact O-N 3Å
161	Y	92.8	Very high	90.7	Very high	151 Å²	151	107 Å²	107	59%	0.592	53%	0.534	S	S	*	.	H	α-helix	trans	-56.8	-46.5	173.6	-176.9	-95	0	0	0	111.6	L157 L163 L164 Q165	L157-Y161 WeakPolarHBondContact O-CB 3.46Å; L157-Y161 PolarHBondContact O-N 2.89Å; Y161-L163 VanDerWaalsContact C-N 3.25Å; Y161-L163 PolarHBondContact O-N 3.09Å; Y161-L164 PolarHBondContact O-N 3.17Å; Y161-Q165 WeakPolarHBondContact O-CB 3.35Å; Y161-Q165 PolarHBondContact O-N 2.95Å
162	G	91.8	Very high	90.1	Very high	24 Å²	24	102.8 Å²	102.8	25%	0.247	52%	0.521	C	S	.	.	H	α-helix	trans	-64.1	-24.9	175.3	0	0	0	0	0	114.5	L158 Q159 E160 R166	L158-G162 PolarHBondContact O-N 3.41Å; L158-G162 VanDerWaalsContact O-N 3.12Å; Q159-G162 PolarHBondContact O-N 2.94Å; E160-G162 VanDerWaalsContact C-N 3.34Å; E160-G162 PolarHBondContact O-N 2.9Å; G162-R166 WeakPolarHBondContact O-CD 3.42Å; G162-R166 WeakPolarHBondContact O-CG 3.25Å
163	L	91.4	Very high	89.3	Confident	85 Å²	85	103.7 Å²	103.7	45%	0.445	52%	0.518	S	S	.	.	H	α-helix	trans	-78.8	-43	171.9	-178.8	64.1	0	0	0	111.7	Q159 E160 Y161 R166 R167	Q159-L163 PolarHBondContact O-N 2.92Å; Q159-L163 VanDerWaalsContact O-N 3.08Å; E160-L163 WeakPolarHBondContact O-CA 3.49Å; E160-L163 WeakPolarHBondContact O-CB 3.48Å; E160-L163 PolarHBondContact O-N 3.26Å; Y161-L163 VanDerWaalsContact C-N 3.25Å; Y161-L163 PolarHBondContact O-N 3.09Å; L163-R166 PolarHBondContact O-N 3.23Å; L163-R167 WeakPolarHBondContact O-CG 3.18Å; L163-R167 PolarHBondContact O-N 3.38Å
164	L	90.9	Very high	88.3	Confident	108 Å²	108	103.3 Å²	103.3	57%	0.565	51%	0.512	S	S	*	.	H	α-helix	trans	-59	-46.3	174.4	-104.8	66.7	0	0	0	111.1	E160 Y161 R166 R167 L168	E160-L164 PolarHBondContact O-N 3Å; Y161-L164 PolarHBondContact O-N 3.17Å; L164-R166 VanDerWaalsContact C-N 3.33Å; L164-R166 PolarHBondContact O-N 2.88Å; L164-R167 WeakPolarHBondContact O-CB 3.22Å; L164-R167 PolarHBondContact O-N 3.21Å; L164-L168 WeakPolarHBondContact O-CB 3.29Å; L164-L168 PolarHBondContact O-N 3.06Å
165	Q	91.2	Very high	87.1	Confident	114 Å²	114	104 Å²	104	53%	0.533	52%	0.516	S	S	.	.	H	α-helix	trans	-60.4	-40.7	-179.9	-168.9	172	-2.9	0	0	112	Y161 L168 E169	Y161-Q165 WeakPolarHBondContact O-CB 3.35Å; Y161-Q165 PolarHBondContact O-N 2.95Å; Q165-L168 PolarHBondContact O-N 3.3Å; Q165-E169 WeakPolarHBondContact O-CB 3.18Å; Q165-E169 PolarHBondContact O-N 2.97Å
166	R	89.7	Confident	86.1	Confident	166 Å²	166	110.5 Å²	110.5	63%	0.626	53%	0.528	S	S	*	.	H	α-helix	trans	-66.1	-36.5	173	-71.7	169.8	-178.7	152.3	1.6	113.2	G162 L163 L164 L168 N170	G162-R166 WeakPolarHBondContact O-CD 3.42Å; G162-R166 WeakPolarHBondContact O-CG 3.25Å; L163-R166 PolarHBondContact O-N 3.23Å; L164-R166 VanDerWaalsContact C-N 3.33Å; L164-R166 PolarHBondContact O-N 2.88Å; R166-L168 VanDerWaalsContact C-N 3.33Å; R166-N170 WeakPolarHBondContact O-CB 3.39Å; R166-N170 PolarHBondContact O-N 3.34Å; R166-N170 PolarHBondContact O-ND2 2.9Å
167	R	89.2	Confident	84.8	Confident	165 Å²	165	111.9 Å²	111.9	62%	0.623	53%	0.533	S	S	*	.	H	α-helix	trans	-65.7	-39.5	174	-72.5	178.2	176.6	-167.5	-0	111.1	L163 L164 N170 L171	L163-R167 WeakPolarHBondContact O-CG 3.18Å; L163-R167 PolarHBondContact O-N 3.38Å; L164-R167 WeakPolarHBondContact O-CB 3.22Å; L164-R167 PolarHBondContact O-N 3.21Å; R167-N170 PolarHBondContact O-N 3.08Å; R167-L171 WeakPolarHBondContact O-CB 3.09Å; R167-L171 PolarHBondContact O-N 2.71Å
168	L	88.8	Confident	83	Confident	120 Å²	120	117.8 Å²	117.8	63%	0.628	55%	0.549	S	S	*	.	H	α-helix	trans	-69.6	-42.7	179.1	-160.9	148.5	0	0	0	111.3	L164 Q165 R166 N170 L171 E172	L164-L168 WeakPolarHBondContact O-CB 3.29Å; L164-L168 PolarHBondContact O-N 3.06Å; Q165-L168 PolarHBondContact O-N 3.3Å; R166-L168 VanDerWaalsContact C-N 3.33Å; L168-N170 PolarHBondContact O-N 2.98Å; L168-L171 WeakPolarHBondContact O-CB 3.45Å; L168-L171 PolarHBondContact O-N 3.45Å; L168-E172 PolarHBondContact O-N 3.19Å
169	E	86.1	Confident	81.1	Confident	112 Å²	112	118.5 Å²	118.5	52%	0.523	55%	0.554	S	S	.	*	H	α-helix	trans	-61.6	-41.1	171.1	-177.3	178.8	-165.1	0	0	112	Q165 L171 E172 N173	Q165-E169 WeakPolarHBondContact O-CB 3.18Å; Q165-E169 PolarHBondContact O-N 2.97Å; E169-L171 VanDerWaalsContact C-N 3.34Å; E169-L171 PolarHBondContact O-N 2.95Å; E169-E172 PolarHBondContact O-N 3.21Å; E169-N173 WeakPolarHBondContact O-CB 3.48Å; E169-N173 PolarHBondContact O-N 2.96Å; E169-N173 PolarHBondContact O-ND2 3.48Å
170	N	81	Confident	78.9	Confident	100 Å²	100	118.3 Å²	118.3	54%	0.535	55%	0.551	S	S	.	*	H	α-helix	trans	-62.8	-40.7	172.9	-75.5	-17.4	0	0	0	111.9	R166 R167 L168 N173 L174	R166-N170 WeakPolarHBondContact O-CB 3.39Å; R166-N170 PolarHBondContact O-N 3.34Å; R166-N170 PolarHBondContact O-ND2 2.9Å; R167-N170 PolarHBondContact O-N 3.08Å; L168-N170 PolarHBondContact O-N 2.98Å; N170-N173 PolarHBondContact O-N 3.25Å; N170-L174 WeakPolarHBondContact O-CG 3.41Å; N170-L174 PolarHBondContact O-N 3.23Å
171	L	77.1	Confident	76.6	Confident	106 Å²	106	121.2 Å²	121.2	56%	0.555	56%	0.557	S	S	*	*	H	α-helix	trans	-65.3	-43.7	176.5	-157.7	91.8	0	0	0	111.1	R167 L168 E169 N173 L174 L175	R167-L171 WeakPolarHBondContact O-CB 3.09Å; R167-L171 PolarHBondContact O-N 2.71Å; L168-L171 WeakPolarHBondContact O-CB 3.45Å; L168-L171 PolarHBondContact O-N 3.45Å; E169-L171 VanDerWaalsContact C-N 3.34Å; E169-L171 PolarHBondContact O-N 2.95Å; L171-N173 PolarHBondContact O-N 3.06Å; L171-L174 PolarHBondContact O-N 2.79Å; L171-L175 HydrophobicContact CD2-CD1 4.24Å; L171-L175 HydrophobicContact CG-CD1 4.4Å; L171-L175 WeakPolarHBondContact O-CG 3.49Å; L171-L175 PolarHBondContact O-N 3.43Å
172	E	81.7	Confident	74.2	Confident	83 Å²	83	119 Å²	119	39%	0.388	56%	0.559	S	S	.	*	H	α-helix	trans	-61.6	-42.7	175.9	-164.8	-166.5	150.5	0	0	111.3	L168 E169 L174 L175 R176	L168-E172 PolarHBondContact O-N 3.19Å; E169-E172 PolarHBondContact O-N 3.21Å; E172-L174 VanDerWaalsContact C-N 3.34Å; E172-L174 PolarHBondContact O-N 2.93Å; E172-L175 PolarHBondContact O-N 3.02Å; E172-R176 WeakPolarHBondContact O-CB 3.43Å; E172-R176 WeakPolarHBondContact O-CG 3.38Å; E172-R176 PolarHBondContact O-N 3.19Å; E172-R176 IonicContact OE1-CZ 3.15Å; E172-R176 IonicContact OE1-NE 2.76Å; E172-R176 PolarHBondContact OE1-NE 3.08Å; E172-R176 IonicContact OE1-NH2 2.69Å; E172-R176 PolarHBondContact OE1-NH2 3.39Å
173	N	77.3	Confident	71.6	Confident	79 Å²	79	123.7 Å²	123.7	42%	0.422	58%	0.577	S	S	.	*	H	α-helix	trans	-63.5	-37.4	175	-78.9	-56.2	0	0	0	112.6	E169 N170 L171 N177	E169-N173 WeakPolarHBondContact O-CB 3.48Å; E169-N173 PolarHBondContact O-N 2.96Å; E169-N173 PolarHBondContact O-ND2 3.48Å; N170-N173 PolarHBondContact O-N 3.25Å; L171-N173 PolarHBondContact O-N 3.06Å; N173-N177 PolarHBondContact O-N 2.87Å; N173-N177 VanDerWaalsContact O-N 3.11Å
174	L	74.9	Confident	68.8	Low	80 Å²	80	131.4 Å²	131.4	42%	0.419	60%	0.601	S	S	.	*	H	α-helix	trans	-67.2	-38.2	173.2	-72.5	168.5	0	0	0	112.1	N170 L171 E172 N177	N170-L174 WeakPolarHBondContact O-CG 3.41Å; N170-L174 PolarHBondContact O-N 3.23Å; L171-L174 PolarHBondContact O-N 2.79Å; E172-L174 VanDerWaalsContact C-N 3.34Å; E172-L174 PolarHBondContact O-N 2.93Å; L174-N177 CarbonylContact O-C 3.2Å; L174-N177 PolarHBondContact O-N 2.8Å
175	L	68.1	Low	66.3	Low	96 Å²	96	130.7 Å²	130.7	50%	0.503	60%	0.597	S	S	.	*	H	α-helix	trans	-71.3	-39.2	176.4	-70.8	167	0	0	0	112.6	L171 E172 N177	L171-L175 HydrophobicContact CD2-CD1 4.24Å; L171-L175 HydrophobicContact CG-CD1 4.4Å; L171-L175 WeakPolarHBondContact O-CG 3.49Å; L171-L175 PolarHBondContact O-N 3.43Å; E172-L175 PolarHBondContact O-N 3.02Å; L175-N177 VanDerWaalsContact C-N 3.26Å; L175-N177 PolarHBondContact O-N 2.89Å
176	R	71.9	Confident	63.5	Low	174 Å²	174	130.3 Å²	130.3	66%	0.657	61%	0.605	S	S	*	*	H	α-helix	trans	-61.5	-35.3	172.5	-76.3	176.6	179.7	-99.1	2.1	111.5	E172 R178	E172-R176 WeakPolarHBondContact O-CB 3.43Å; E172-R176 WeakPolarHBondContact O-CG 3.38Å; E172-R176 PolarHBondContact O-N 3.19Å; E172-R176 IonicContact OE1-CZ 3.15Å; E172-R176 IonicContact OE1-NE 2.76Å; E172-R176 PolarHBondContact OE1-NE 3.08Å; E172-R176 IonicContact OE1-NH2 2.69Å; E172-R176 PolarHBondContact OE1-NH2 3.39Å; R176-R178 PolarHBondContact O-N 3.47Å
177	N	66.5	Low	61.2	Low	103 Å²	103	127.9 Å²	127.9	55%	0.551	61%	0.61	S	S	*	*	S	Bend	trans	-73.6	71	167.2	-80	-29.9	0	0	0	111.3	N173 L174 L175 N179 F180	N173-N177 PolarHBondContact O-N 2.87Å; N173-N177 VanDerWaalsContact O-N 3.11Å; L174-N177 CarbonylContact O-C 3.2Å; L174-N177 PolarHBondContact O-N 2.8Å; L175-N177 VanDerWaalsContact C-N 3.26Å; L175-N177 PolarHBondContact O-N 2.89Å; N177-N179 PolarHBondContact O-N 3.3Å; N177-F180 PolarHBondContact O-N 2.92Å
178	R	56.3	Low	59	Low	216 Å²	216	121.7 Å²	121.7	82%	0.815	60%	0.597	S	S	*	*	G	3₁₀ helix	trans	-41.8	-27.3	176.8	-75.2	177.8	158	172.3	-8.1	115.1	R176 F180	R176-R178 PolarHBondContact O-N 3.47Å; R178-F180 VanDerWaalsContact C-N 3.27Å; R178-F180 PolarHBondContact O-N 3.13Å
179	N	51	Low	57.4	Low	143 Å²	143	122.2 Å²	122.2	77%	0.765	61%	0.611	S	S	*	*	G	3₁₀ helix	trans	-67.1	-16.6	179.2	-61	-19.7	0	0	0	114.9	N177	N177-N179 PolarHBondContact O-N 3.3Å
180	F	46	Very low	55.8	Low	147 Å²	147	125.8 Å²	125.8	65%	0.645	63%	0.625	S	S	*	*	G	3₁₀ helix	trans	-81.7	-30.7	-177.3	-155.1	-90.7	0	0	0	113.3	N177 R178	N177-F180 PolarHBondContact O-N 2.92Å; R178-F180 VanDerWaalsContact C-N 3.27Å; R178-F180 PolarHBondContact O-N 3.13Å
181	W	45.3	Very low	54.3	Low	174 Å²	174	124.2 Å²	124.2	66%	0.659	63%	0.632	S	S	*	*	S	Bend	trans	-94	8.8	178.1	-68.6	105.2	0	0	0	114	L183	W181-L183 PolarHBondContact O-N 2.76Å
182	V	41.6	Very low	52.4	Low	105 Å²	105	126.6 Å²	126.6	64%	0.636	64%	0.641	S	S	*	*	S	Bend	trans	-67.9	81.9	148.9	-174.4	0	0	0	0	106.4	R184	V182-R184 PolarHBondContact O-N 2.73Å; V182-R184 VanDerWaalsContact O-N 3.09Å
183	L	38.2	Very low	50.5	Low	121 Å²	121	126.7 Å²	126.7	63%	0.634	66%	0.655	S	S	*	*			trans	-40.8	121.6	159	-79.2	163.4	0	0	0	106.3	W181 L185	W181-L183 PolarHBondContact O-N 2.76Å; L183-L185 HydrophobicContact CB-CG 4.33Å; L183-L185 PolarHBondContact O-N 2.83Å
184	R	30.9	Very low	48.8	Very low	247 Å²	247	126.2 Å²	126.2	93%	0.932	66%	0.657	S	S	*	*			trans	-70.5	59	170.8	-76.6	-176.1	167.5	-158.4	-0.7	109.7	V182 P186	V182-R184 PolarHBondContact O-N 2.73Å; V182-R184 VanDerWaalsContact O-N 3.09Å; R184-P186 WeakPolarHBondContact O-CD 3.44Å
185	L	39.1	Very low	47.5	Very low	93 Å²	93	131.2 Å²	131.2	49%	0.487	68%	0.675	S	S	.	*	P	Polyproline II helix	trans	-58	117.9	150.4	-67.6	173.3	0	0	0	105	L183 V196	L183-L185 HydrophobicContact CB-CG 4.33Å; L183-L185 PolarHBondContact O-N 2.83Å; L185-V196 HydrophobicContact CD1-CG2 4.39Å
186	P	32.6	Very low	46.8	Very low	107 Å²	107	131.3 Å²	131.3	70%	0.695	68%	0.679	S	S	*	*	P	Polyproline II helix	trans	-53.5	137.2	176.1	-24.2	34.3	0	0	0	108.6	R184 G188	R184-P186 WeakPolarHBondContact O-CD 3.44Å; P186-G188 PolarHBondContact O-N 3.21Å
187	P	41	Very low	46.1	Very low	115 Å²	115	128 Å²	128	75%	0.747	68%	0.681	S	S	*	*	P	Polyproline II helix	trans	-55.7	121.3	-179.7	22.6	-32.6	0	0	0	108.8
188	G	43.4	Very low	45.6	Very low	34 Å²	34	127.2 Å²	127.2	35%	0.351	68%	0.679	S	S	.	*	P	Polyproline II helix	trans	-53.9	148.9	170.9	0	0	0	0	0	109.2	P186 K190 G191	P186-G188 PolarHBondContact O-N 3.21Å; G188-K190 PolarHBondContact O-N 2.82Å; G188-G191 PolarHBondContact O-N 2.66Å
189	S	55.2	Low	46.2	Very low	131 Å²	131	120.1 Å²	120.1	92%	0.916	66%	0.66	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64	9.7	-165.7	53.4	0	0	0	0	116.5
190	K	52.7	Low	47	Very low	187 Å²	187	116.5 Å²	116.5	81%	0.813	64%	0.638	S	S	*	*	T	Hydrogen-bonded Turn	trans	-130.3	8.9	174.1	-65	-172.3	177.5	-179.8	0	114.7	G188 E192	G188-K190 PolarHBondContact O-N 2.82Å; K190-E192 PolarHBondContact O-N 3.19Å
191	G	49.1	Very low	48	Very low	67 Å²	67	114 Å²	114	69%	0.691	63%	0.634	S	S	*	*	S	Bend	trans	75.8	-2.6	172.6	0	0	0	0	0	116.2	G188	G188-G191 PolarHBondContact O-N 2.66Å
192	E	38.7	Very low	49.1	Very low	157 Å²	157	111 Å²	111	73%	0.734	63%	0.631	S	S	*	*			trans	-69.1	129.5	165.1	-68.9	178.4	134.1	0	0	109.4	K190 P194	K190-E192 PolarHBondContact O-N 3.19Å; E192-P194 WeakPolarHBondContact O-CD 3.44Å
193	A	41.6	Very low	50.5	Low	84 Å²	84	108.9 Å²	108.9	69%	0.694	62%	0.616	S	S	*	*			trans	-60.6	125.1	168.3	0	0	0	0	0	108.1	K195	A193-K195 PolarHBondContact O-N 3.06Å
194	P	41.7	Very low	52.2	Low	69 Å²	69	103.9 Å²	103.9	45%	0.448	59%	0.591	S	S	.	*			trans	-60.5	106.3	175.9	-22.4	33.7	0	0	0	109.1	E192 V196	E192-P194 WeakPolarHBondContact O-CD 3.44Å; P194-V196 HydrophobicContact CB-CG2 4.29Å; P194-V196 PolarHBondContact O-N 3.13Å
195	K	46.9	Very low	54.4	Low	185 Å²	185	96.2 Å²	96.2	80%	0.804	57%	0.572	S	S	*	*			trans	-69.5	75	165.9	-68	-177.1	178.8	-176.4	0	107.6	A193 P197	A193-K195 PolarHBondContact O-N 3.06Å; K195-P197 WeakPolarHBondContact O-CD 3.43Å
196	V	52.5	Low	56.3	Low	98 Å²	98	98.7 Å²	98.7	59%	0.594	58%	0.576	S	S	*	*			trans	-64.6	114.8	166	-177.5	0	0	0	0	105.5	L185 P194 V198	L185-V196 HydrophobicContact CD1-CG2 4.39Å; P194-V196 HydrophobicContact CB-CG2 4.29Å; P194-V196 PolarHBondContact O-N 3.13Å; V196-V198 PolarHBondContact O-N 3.39Å; V196-V198 VanDerWaalsContact O-N 3.1Å
197	P	57.3	Low	58.7	Low	105 Å²	105	97.5 Å²	97.5	68%	0.682	56%	0.56	S	S	*	*			trans	-65.6	115.8	178.6	-15.8	30.9	0	0	0	107.5	K195 T199	K195-P197 WeakPolarHBondContact O-CD 3.43Å; P197-T199 PolarHBondContact O-N 3.07Å
198	V	56.6	Low	60.7	Low	87 Å²	87	94.8 Å²	94.8	53%	0.527	54%	0.543	S	S	.	.			trans	-76.1	112.4	172.4	-177.3	0	0	0	0	106.4	V196 D202 I203 L234	V196-V198 PolarHBondContact O-N 3.39Å; V196-V198 VanDerWaalsContact O-N 3.1Å; V198-D202 HydrophobicContact CG1-CB 4.22Å; V198-I203 HydrophobicContact CG1-CD1 3.79Å; V198-I203 HydrophobicContact CG1-CG1 3.85Å; V198-L234 HydrophobicContact CB-CD2 4.46Å; V198-L234 HydrophobicContact CG1-CD2 4.37Å; V198-L234 VanDerWaalsContact O-CD2 3.3Å; V198-L234 WeakPolarHBondContact O-CD2 3.35Å
199	T	68.6	Low	62.7	Low	66 Å²	66	99.8 Å²	99.8	41%	0.405	56%	0.558	S	S	.	*			trans	-88.5	164.6	179.7	73.2	0	0	0	0	110.4	P197 V201 D202	P197-T199 PolarHBondContact O-N 3.07Å; T199-V201 PolarHBondContact O-N 3Å; T199-V201 PolarHBondContact OG1-N 3.39Å; T199-D202 WeakPolarHBondContact CA-OD2 3.45Å; T199-D202 WeakPolarHBondContact CB-OD2 3.45Å; T199-D202 PolarHBondContact N-OD2 3.23Å; T199-D202 PolarHBondContact O-N 3.33Å; T199-D202 VanDerWaalsContact O-N 3.11Å; T199-D202 PolarHBondContact OG1-OD2 3Å
200	F	67.5	Low	64.2	Low	68 Å²	68	98.6 Å²	98.6	30%	0.298	54%	0.541	S	S	.	.	H	α-helix	trans	-59.1	-29.9	172.3	-176.6	-99.7	0	0	0	112.4	D202 I203 A204 V227 N230 L234	F200-D202 VanDerWaalsContact C-N 3.26Å; F200-D202 PolarHBondContact O-N 3.31Å; F200-I203 PolarHBondContact O-N 2.93Å; F200-A204 HydrophobicContact CD1-CB 3.96Å; F200-A204 HydrophobicContact CE1-CB 3.6Å; F200-A204 HydrophobicContact CZ-CB 4.01Å; F200-A204 WeakPolarHBondContact O-CB 3.41Å; F200-A204 PolarHBondContact O-N 3.16Å; F200-V227 HydrophobicContact CE2-CG1 4.27Å; F200-V227 HydrophobicContact CZ-CG1 3.84Å; F200-V227 HydrophobicContact CZ-CG2 4.37Å; F200-N230 HydrophobicContact CE2-CB 4.36Å; F200-L234 HydrophobicContact CB-CD1 3.86Å; F200-L234 HydrophobicContact CD2-CD1 4.05Å; F200-L234 HydrophobicContact CG-CD1 4.47Å
201	V	67.2	Low	65.8	Low	95 Å²	95	94.7 Å²	94.7	58%	0.576	53%	0.526	S	S	*	.	H	α-helix	trans	-65.4	-29.4	178	-175.7	0	0	0	0	111.9	T199 I203	T199-V201 PolarHBondContact O-N 3Å; T199-V201 PolarHBondContact OG1-N 3.39Å; V201-I203 VanDerWaalsContact C-N 3.3Å; V201-I203 PolarHBondContact O-N 3.08Å
202	D	69.2	Low	67.7	Low	111 Å²	111	95.7 Å²	95.7	59%	0.594	51%	0.509	S	S	*	.	H	α-helix	trans	-76.3	-18.2	178.8	-55.8	-64.9	0	0	0	113.2	V198 T199 F200	V198-D202 HydrophobicContact CG1-CB 4.22Å; T199-D202 WeakPolarHBondContact CA-OD2 3.45Å; T199-D202 WeakPolarHBondContact CB-OD2 3.45Å; T199-D202 PolarHBondContact N-OD2 3.23Å; T199-D202 PolarHBondContact O-N 3.33Å; T199-D202 VanDerWaalsContact O-N 3.11Å; T199-D202 PolarHBondContact OG1-OD2 3Å; F200-D202 VanDerWaalsContact C-N 3.26Å; F200-D202 PolarHBondContact O-N 3.31Å
203	I	71.2	Confident	70.1	Confident	60 Å²	60	93.9 Å²	93.9	31%	0.308	50%	0.498	S	S	.	.	H	α-helix	trans	-108.8	-27.3	-178.3	-52.6	-177.2	0	0	0	111.6	V198 F200 V201 V205 N230 L234	V198-I203 HydrophobicContact CG1-CD1 3.79Å; V198-I203 HydrophobicContact CG1-CG1 3.85Å; F200-I203 PolarHBondContact O-N 2.93Å; V201-I203 VanDerWaalsContact C-N 3.3Å; V201-I203 PolarHBondContact O-N 3.08Å; I203-V205 PolarHBondContact O-N 3.11Å; I203-N230 HydrophobicContact CG2-CB 4.06Å; I203-N230 WeakPolarHBondContact CG2-ND2 3.48Å; I203-L234 HydrophobicContact CD1-CD1 4.17Å; I203-L234 HydrophobicContact CD1-CD2 3.84Å; I203-L234 HydrophobicContact CD1-CG 4.07Å
204	A	72.7	Confident	72.5	Confident	15 Å²	15	96.3 Å²	96.3	12%	0.124	50%	0.5	C	S	.	.	P	Polyproline II helix	trans	-67.9	123.8	-176.5	0	0	0	0	0	112.3	F200 Y206	F200-A204 HydrophobicContact CD1-CB 3.96Å; F200-A204 HydrophobicContact CE1-CB 3.6Å; F200-A204 HydrophobicContact CZ-CB 4.01Å; F200-A204 WeakPolarHBondContact O-CB 3.41Å; F200-A204 PolarHBondContact O-N 3.16Å; A204-Y206 HydrophobicContact CB-CE1 4.28Å; A204-Y206 HydrophobicContact CB-CE2 3.8Å
205	V	78.1	Confident	74.7	Confident	87 Å²	87	94.3 Å²	94.3	53%	0.527	49%	0.485	S	S	.	.	P	Polyproline II helix	trans	-88.8	122.6	166.2	179.8	0	0	0	0	107.6	I203 Y223	I203-V205 PolarHBondContact O-N 3.11Å; V205-Y223 WeakPolarHBondContact O-CE2 3.25Å; V205-Y223 PolarHBondContact O-OH 3.3Å
206	Y	78.2	Confident	76.7	Confident	144 Å²	144	89.9 Å²	89.9	57%	0.565	47%	0.471	S	S	*	.	P	Polyproline II helix	trans	-99.2	136.3	176.8	-58.7	-85.4	0	0	0	110	A204	A204-Y206 HydrophobicContact CB-CE1 4.28Å; A204-Y206 HydrophobicContact CB-CE2 3.8Å
207	F	82.4	Confident	78.5	Confident	83 Å²	83	91.8 Å²	91.8	36%	0.364	47%	0.473	S	S	.	.	P	Polyproline II helix	trans	-96.5	144.7	167.6	-67.9	-77.8	0	0	0	109.8	E211 W212 L215 Y223	F207-E211 HydrophobicContact CB-CB 4.32Å; F207-E211 HydrophobicContact CD1-CB 4.16Å; F207-W212 HydrophobicContact CB-CB 4.36Å; F207-W212 HydrophobicContact CB-CE3 4.26Å; F207-W212 AromaticContact CD2-CE3 3.8Å; F207-W212 HydrophobicContact CD2-CE3 3.8Å; F207-W212 AromaticContact CD2-CZ3 3.99Å; F207-W212 HydrophobicContact CD2-CZ3 3.99Å; F207-W212 HydrophobicContact CE2-CZ3 4.39Å; F207-W212 HydrophobicContact CG-CE3 4.25Å; F207-L215 HydrophobicContact CD1-CD1 4.2Å; F207-L215 HydrophobicContact CD2-CD1 4.16Å; F207-L215 HydrophobicContact CE1-CD1 4.12Å; F207-L215 HydrophobicContact CE2-CD1 4.07Å; F207-L215 HydrophobicContact CG-CD1 4.22Å; F207-L215 HydrophobicContact CZ-CD1 4.05Å; F207-Y223 HydrophobicContact CD2-CD2 4.24Å; F207-Y223 HydrophobicContact CD2-CE2 4.18Å; F207-Y223 AromaticContact CE2-CD2 3.6Å; F207-Y223 HydrophobicContact CE2-CD2 3.6Å; F207-Y223 AromaticContact CE2-CE2 3.91Å; F207-Y223 HydrophobicContact CE2-CE2 3.91Å; F207-Y223 HydrophobicContact CE2-CG 4.08Å
208	S	84.6	Confident	80.1	Confident	57 Å²	57	94.5 Å²	94.5	40%	0.399	47%	0.469	S	S	.	.	P	Polyproline II helix	trans	-67.7	160.6	163.5	64.4	0	0	0	0	110.9	D210 E211 W212	S208-D210 PolarHBondContact O-N 2.86Å; S208-E211 VanDerWaalsContact CB-OE2 3.3Å; S208-E211 WeakPolarHBondContact CB-OE2 3.48Å; S208-E211 PolarHBondContact N-OE2 2.86Å; S208-E211 PolarHBondContact O-N 3.24Å; S208-E211 WeakPolarHBondContact OG-CB 3.35Å; S208-E211 WeakPolarHBondContact OG-CG 3.32Å; S208-E211 PolarHBondContact OG-N 3.41Å; S208-E211 PolarHBondContact OG-OE2 2.79Å; S208-W212 WeakPolarHBondContact O-CB 3.49Å; S208-W212 PolarHBondContact O-N 3.37Å
209	E	84.9	Confident	81.5	Confident	140 Å²	140	93.4 Å²	93.4	65%	0.654	46%	0.459	S	S	*	.	H	α-helix	trans	-61.3	-33.2	-178.2	-157.4	-166.5	133.1	0	0	112.3	K213	E209-K213 WeakPolarHBondContact O-CD 3.43Å; E209-K213 VanDerWaalsContact O-CG 3.28Å; E209-K213 WeakPolarHBondContact O-CG 3.34Å; E209-K213 PolarHBondContact O-N 3.12Å; E209-K213 VanDerWaalsContact O-N 3.16Å; E209-K213 WeakPolarHBondContact OE1-CE 3.34Å; E209-K213 IonicContact OE1-NZ 3.96Å; E209-K213 PolarHBondContact OE1-NZ 3.46Å
210	D	87.4	Confident	82.4	Confident	106 Å²	106	91.7 Å²	91.7	57%	0.567	45%	0.446	S	S	*	.	H	α-helix	trans	-76.9	-37.2	178.3	-61.8	-38.3	0	0	0	112.2	S208 K213 N214	S208-D210 PolarHBondContact O-N 2.86Å; D210-K213 IonicContact OD1-NZ 3.61Å; D210-N214 PolarHBondContact O-N 2.98Å; D210-N214 PolarHBondContact O-ND2 3.04Å
211	E	85.4	Confident	83.4	Confident	105 Å²	105	92.5 Å²	92.5	49%	0.491	45%	0.45	S	S	.	.	H	α-helix	trans	-63.5	-42.9	170.4	-72.1	163.5	142.2	0	0	110.9	F207 S208 K213 N214 L215	F207-E211 HydrophobicContact CB-CB 4.32Å; F207-E211 HydrophobicContact CD1-CB 4.16Å; S208-E211 VanDerWaalsContact CB-OE2 3.3Å; S208-E211 WeakPolarHBondContact CB-OE2 3.48Å; S208-E211 PolarHBondContact N-OE2 2.86Å; S208-E211 PolarHBondContact O-N 3.24Å; S208-E211 WeakPolarHBondContact OG-CB 3.35Å; S208-E211 WeakPolarHBondContact OG-CG 3.32Å; S208-E211 PolarHBondContact OG-N 3.41Å; S208-E211 PolarHBondContact OG-OE2 2.79Å; E211-K213 VanDerWaalsContact C-N 3.33Å; E211-K213 PolarHBondContact O-N 3.37Å; E211-N214 PolarHBondContact O-N 3.43Å; E211-L215 PolarHBondContact O-N 2.79Å
212	W	89.3	Confident	84.2	Confident	88 Å²	88	93.2 Å²	93.2	33%	0.333	45%	0.45	S	S	.	.	H	α-helix	trans	-63.4	-35.8	179.8	-172.7	-101.2	0	0	0	113.2	F207 S208 N214 L215 K220 Y223	F207-W212 HydrophobicContact CB-CB 4.36Å; F207-W212 HydrophobicContact CB-CE3 4.26Å; F207-W212 AromaticContact CD2-CE3 3.8Å; F207-W212 HydrophobicContact CD2-CE3 3.8Å; F207-W212 AromaticContact CD2-CZ3 3.99Å; F207-W212 HydrophobicContact CD2-CZ3 3.99Å; F207-W212 HydrophobicContact CE2-CZ3 4.39Å; F207-W212 HydrophobicContact CG-CE3 4.25Å; S208-W212 WeakPolarHBondContact O-CB 3.49Å; S208-W212 PolarHBondContact O-N 3.37Å; W212-N214 VanDerWaalsContact C-N 3.3Å; W212-N214 PolarHBondContact O-N 2.91Å; W212-L215 HydrophobicContact CD2-CD1 4.42Å; W212-L215 HydrophobicContact CE3-CD1 3.66Å; W212-L215 HydrophobicContact CZ3-CD1 4.03Å; W212-L215 PolarHBondContact O-N 3.29Å; W212-K220 HydrophobicContact CH2-CB 3.84Å; W212-K220 HydrophobicContact CH2-CG 3.84Å; W212-K220 HydrophobicContact CZ2-CB 3.93Å; W212-K220 HydrophobicContact CZ2-CD 4.03Å; W212-K220 HydrophobicContact CZ2-CG 3.73Å; W212-K220 HydrophobicContact CZ3-CG 4.3Å; W212-K220 WeakPolarHBondContact O-CE 3.37Å; W212-Y223 AromaticContact CH2-CD1 3.59Å; W212-Y223 HydrophobicContact CH2-CD1 3.59Å; W212-Y223 HydrophobicContact CH2-CE1 4.18Å; W212-Y223 HydrophobicContact CH2-CG 4.35Å; W212-Y223 AromaticContact CZ3-CD1 3.48Å; W212-Y223 HydrophobicContact CZ3-CD1 3.48Å; W212-Y223 VanDerWaalsContact CZ3-CD1 3.48Å; W212-Y223 AromaticContact CZ3-CE1 3.95Å; W212-Y223 HydrophobicContact CZ3-CE1 3.95Å; W212-Y223 AromaticContact CZ3-CG 3.97Å; W212-Y223 HydrophobicContact CZ3-CG 3.97Å
213	K	88.6	Confident	85	Confident	118 Å²	118	90.3 Å²	90.3	51%	0.513	43%	0.431	S	S	.	.	H	α-helix	trans	-66.6	-30.5	173	-72.9	163.3	-168.2	156.7	0	113	E209 D210 E211	E209-K213 WeakPolarHBondContact O-CD 3.43Å; E209-K213 VanDerWaalsContact O-CG 3.28Å; E209-K213 WeakPolarHBondContact O-CG 3.34Å; E209-K213 PolarHBondContact O-N 3.12Å; E209-K213 VanDerWaalsContact O-N 3.16Å; E209-K213 WeakPolarHBondContact OE1-CE 3.34Å; E209-K213 IonicContact OE1-NZ 3.96Å; E209-K213 PolarHBondContact OE1-NZ 3.46Å; D210-K213 IonicContact OD1-NZ 3.61Å; E211-K213 VanDerWaalsContact C-N 3.33Å; E211-K213 PolarHBondContact O-N 3.37Å
214	N	91.5	Very high	85.7	Confident	136 Å²	136	90.3 Å²	90.3	73%	0.727	43%	0.432	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.4	-3.2	-178.6	-70.6	-40.4	0	0	0	114	D210 E211 W212	D210-N214 PolarHBondContact O-N 2.98Å; D210-N214 PolarHBondContact O-ND2 3.04Å; E211-N214 PolarHBondContact O-N 3.43Å; W212-N214 VanDerWaalsContact C-N 3.3Å; W212-N214 PolarHBondContact O-N 2.91Å
215	L	87.6	Confident	86.3	Confident	27 Å²	27	92.6 Å²	92.6	14%	0.141	44%	0.442	C	S	.	.	S	Bend	trans	-81.6	138.2	174.4	-69.9	170.1	0	0	0	111.6	F207 E211 W212 Q219 K220	F207-L215 HydrophobicContact CD1-CD1 4.2Å; F207-L215 HydrophobicContact CD2-CD1 4.16Å; F207-L215 HydrophobicContact CE1-CD1 4.12Å; F207-L215 HydrophobicContact CE2-CD1 4.07Å; F207-L215 HydrophobicContact CG-CD1 4.22Å; F207-L215 HydrophobicContact CZ-CD1 4.05Å; E211-L215 PolarHBondContact O-N 2.79Å; W212-L215 HydrophobicContact CD2-CD1 4.42Å; W212-L215 HydrophobicContact CE3-CD1 3.66Å; W212-L215 HydrophobicContact CZ3-CD1 4.03Å; W212-L215 PolarHBondContact O-N 3.29Å; L215-Q219 HydrophobicContact CB-CB 4.26Å; L215-Q219 HydrophobicContact CD2-CB 3.97Å; L215-Q219 HydrophobicContact CD2-CG 4.5Å; L215-K220 HydrophobicContact CB-CG 4.03Å; L215-K220 WeakPolarHBondContact O-CE 3.37Å; L215-K220 PolarHBondContact O-NZ 2.99Å; L215-K220 VanDerWaalsContact O-NZ 3.11Å
216	D	89.7	Confident	86.6	Confident	92 Å²	92	92.4 Å²	92.4	49%	0.492	44%	0.438	S	S	.	.			trans	-64.1	153.4	166.7	-67.9	-32.8	0	0	0	110.8	W218 Q219 K220	D216-W218 VanDerWaalsContact C-N 3.25Å; D216-W218 HydrophobicContact CB-CG 4.28Å; D216-W218 VanDerWaalsContact CB-NE1 3.34Å; D216-W218 PolarHBondContact O-N 2.83Å; D216-W218 PolarHBondContact OD2-NE1 2.86Å; D216-Q219 HydrophobicContact CB-CG 4.14Å; D216-Q219 WeakPolarHBondContact O-CA 3.45Å; D216-Q219 WeakPolarHBondContact O-CB 3.27Å; D216-Q219 PolarHBondContact O-N 3.26Å; D216-K220 PolarHBondContact O-N 2.72Å; D216-K220 VanDerWaalsContact O-N 3.1Å
217	E	90.3	Very high	86.9	Confident	137 Å²	137	87.5 Å²	87.5	64%	0.64	42%	0.423	S	S	*	.	H	α-helix	trans	-57.7	-34.5	178.3	-65.4	-53.1	125.4	0	0	113.6	Q219 K220 E221	E217-Q219 VanDerWaalsContact C-N 3.29Å; E217-Q219 PolarHBondContact O-N 3.28Å; E217-K220 PolarHBondContact O-N 2.94Å; E217-K220 IonicContact OE1-NZ 3.63Å; E217-K220 PolarHBondContact OE1-NZ 2.85Å; E217-E221 PolarHBondContact O-N 3.35Å
218	W	90.1	Very high	86.7	Confident	162 Å²	162	88.1 Å²	88.1	61%	0.614	43%	0.425	S	S	*	.	H	α-helix	trans	-68	-28.9	175.9	74.7	-92.6	0	0	0	112.5	D216 L222	D216-W218 VanDerWaalsContact C-N 3.25Å; D216-W218 HydrophobicContact CB-CG 4.28Å; D216-W218 VanDerWaalsContact CB-NE1 3.34Å; D216-W218 PolarHBondContact O-N 2.83Å; D216-W218 PolarHBondContact OD2-NE1 2.86Å; W218-L222 HydrophobicContact CZ3-CD2 4.33Å; W218-L222 WeakPolarHBondContact O-CB 3.43Å; W218-L222 PolarHBondContact O-N 2.98Å
219	Q	86.7	Confident	86.3	Confident	64 Å²	64	91.1 Å²	91.1	30%	0.299	43%	0.433	S	S	.	.	H	α-helix	trans	-75.4	-38.8	175.5	-60.3	176.8	-58.6	0	0	111	L215 D216 E217 E221 L222 Y223	L215-Q219 HydrophobicContact CB-CB 4.26Å; L215-Q219 HydrophobicContact CD2-CB 3.97Å; L215-Q219 HydrophobicContact CD2-CG 4.5Å; D216-Q219 HydrophobicContact CB-CG 4.14Å; D216-Q219 WeakPolarHBondContact O-CA 3.45Å; D216-Q219 WeakPolarHBondContact O-CB 3.27Å; D216-Q219 PolarHBondContact O-N 3.26Å; E217-Q219 VanDerWaalsContact C-N 3.29Å; E217-Q219 PolarHBondContact O-N 3.28Å; Q219-E221 VanDerWaalsContact C-N 3.34Å; Q219-L222 PolarHBondContact O-N 3.44Å; Q219-Y223 PolarHBondContact O-N 3.18Å
220	K	88.1	Confident	85.9	Confident	31 Å²	31	86 Å²	86	14%	0.135	41%	0.41	C	S	.	.	H	α-helix	trans	-61.9	-42.2	172.8	-63.5	174	-169.8	153.8	0	111.1	W212 L215 D216 E217 Y223 N224	W212-K220 HydrophobicContact CH2-CB 3.84Å; W212-K220 HydrophobicContact CH2-CG 3.84Å; W212-K220 HydrophobicContact CZ2-CB 3.93Å; W212-K220 HydrophobicContact CZ2-CD 4.03Å; W212-K220 HydrophobicContact CZ2-CG 3.73Å; W212-K220 HydrophobicContact CZ3-CG 4.3Å; W212-K220 WeakPolarHBondContact O-CE 3.37Å; L215-K220 HydrophobicContact CB-CG 4.03Å; L215-K220 WeakPolarHBondContact O-CE 3.37Å; L215-K220 PolarHBondContact O-NZ 2.99Å; L215-K220 VanDerWaalsContact O-NZ 3.11Å; D216-K220 PolarHBondContact O-N 2.72Å; D216-K220 VanDerWaalsContact O-N 3.1Å; E217-K220 PolarHBondContact O-N 2.94Å; E217-K220 IonicContact OE1-NZ 3.63Å; E217-K220 PolarHBondContact OE1-NZ 2.85Å; K220-Y223 WeakPolarHBondContact O-CB 3.15Å; K220-Y223 PolarHBondContact O-N 2.9Å; K220-N224 PolarHBondContact O-N 3.21Å; K220-N224 PolarHBondContact O-ND2 3.09Å
221	E	88	Confident	85.5	Confident	85 Å²	85	87.5 Å²	87.5	40%	0.397	41%	0.409	S	S	.	.	H	α-helix	trans	-69.5	-36.1	176.3	-174.3	51.7	-153.5	0	0	112.7	E217 Q219 Y223 N224 N225 K228	E217-E221 PolarHBondContact O-N 3.35Å; Q219-E221 VanDerWaalsContact C-N 3.34Å; E221-Y223 VanDerWaalsContact C-N 3.35Å; E221-N224 PolarHBondContact O-N 2.96Å; E221-N224 PolarHBondContact OE2-ND2 3.17Å; E221-N225 PolarHBondContact O-N 3.11Å; E221-N225 PolarHBondContact O-ND2 3.09Å; E221-N225 PolarHBondContact OE1-ND2 3.06Å; E221-N225 PolarHBondContact OE1-OD1 3.46Å; E221-K228 IonicContact OE1-NZ 3.57Å; E221-K228 PolarHBondContact OE1-NZ 3.2Å
222	L	84.5	Confident	85.1	Confident	109 Å²	109	88.8 Å²	88.8	57%	0.571	41%	0.413	S	S	*	.	H	α-helix	trans	-60.3	-44.8	170.8	-179.5	63	0	0	0	111.5	W218 Q219 N225 L226	W218-L222 HydrophobicContact CZ3-CD2 4.33Å; W218-L222 WeakPolarHBondContact O-CB 3.43Å; W218-L222 PolarHBondContact O-N 2.98Å; Q219-L222 PolarHBondContact O-N 3.44Å; L222-N225 PolarHBondContact O-N 3.28Å; L222-L226 PolarHBondContact O-N 3.08Å
223	Y	85.2	Confident	84.3	Confident	50 Å²	50	88 Å²	88	20%	0.196	42%	0.418	C	S	.	.	H	α-helix	trans	-61.1	-46.1	175	175.6	-101.4	0	0	0	112.2	V205 F207 W212 Q219 K220 E221 N225 L226 V227	V205-Y223 WeakPolarHBondContact O-CE2 3.25Å; V205-Y223 PolarHBondContact O-OH 3.3Å; F207-Y223 HydrophobicContact CD2-CD2 4.24Å; F207-Y223 HydrophobicContact CD2-CE2 4.18Å; F207-Y223 AromaticContact CE2-CD2 3.6Å; F207-Y223 HydrophobicContact CE2-CD2 3.6Å; F207-Y223 AromaticContact CE2-CE2 3.91Å; F207-Y223 HydrophobicContact CE2-CE2 3.91Å; F207-Y223 HydrophobicContact CE2-CG 4.08Å; W212-Y223 AromaticContact CH2-CD1 3.59Å; W212-Y223 HydrophobicContact CH2-CD1 3.59Å; W212-Y223 HydrophobicContact CH2-CE1 4.18Å; W212-Y223 HydrophobicContact CH2-CG 4.35Å; W212-Y223 AromaticContact CZ3-CD1 3.48Å; W212-Y223 HydrophobicContact CZ3-CD1 3.48Å; W212-Y223 VanDerWaalsContact CZ3-CD1 3.48Å; W212-Y223 AromaticContact CZ3-CE1 3.95Å; W212-Y223 HydrophobicContact CZ3-CE1 3.95Å; W212-Y223 AromaticContact CZ3-CG 3.97Å; W212-Y223 HydrophobicContact CZ3-CG 3.97Å; Q219-Y223 PolarHBondContact O-N 3.18Å; K220-Y223 WeakPolarHBondContact O-CB 3.15Å; K220-Y223 PolarHBondContact O-N 2.9Å; E221-Y223 VanDerWaalsContact C-N 3.35Å; Y223-N225 VanDerWaalsContact C-N 3.26Å; Y223-N225 PolarHBondContact O-N 2.81Å; Y223-L226 PolarHBondContact O-N 3.2Å; Y223-V227 HydrophobicContact CD1-CG2 4.25Å; Y223-V227 HydrophobicContact CD2-CG2 4.29Å; Y223-V227 HydrophobicContact CE1-CG2 3.83Å; Y223-V227 HydrophobicContact CE2-CG2 3.86Å; Y223-V227 HydrophobicContact CG-CG2 4.5Å; Y223-V227 WeakPolarHBondContact O-CB 3.36Å; Y223-V227 WeakPolarHBondContact O-CG2 3.31Å; Y223-V227 PolarHBondContact O-N 3.25Å
224	N	86.2	Confident	83.5	Confident	61 Å²	61	83 Å²	83	33%	0.326	40%	0.397	S	S	.	.	H	α-helix	trans	-57.5	-39.8	176	-71.2	-27.6	0	0	0	111.9	K220 E221 K228	K220-N224 PolarHBondContact O-N 3.21Å; K220-N224 PolarHBondContact O-ND2 3.09Å; E221-N224 PolarHBondContact O-N 2.96Å; E221-N224 PolarHBondContact OE2-ND2 3.17Å; N224-K228 WeakPolarHBondContact O-CB 3.24Å; N224-K228 WeakPolarHBondContact O-CD 3.46Å; N224-K228 WeakPolarHBondContact O-CG 3.41Å; N224-K228 PolarHBondContact O-N 3.28Å
225	N	84.9	Confident	82.5	Confident	63 Å²	63	80.7 Å²	80.7	34%	0.337	38%	0.382	S	S	.	.	H	α-helix	trans	-72.6	-40.2	178.2	-70	-46.8	0	0	0	112.6	E221 L222 Y223 V227 K228 E229	E221-N225 PolarHBondContact O-N 3.11Å; E221-N225 PolarHBondContact O-ND2 3.09Å; E221-N225 PolarHBondContact OE1-ND2 3.06Å; E221-N225 PolarHBondContact OE1-OD1 3.46Å; L222-N225 PolarHBondContact O-N 3.28Å; Y223-N225 VanDerWaalsContact C-N 3.26Å; Y223-N225 PolarHBondContact O-N 2.81Å; N225-V227 PolarHBondContact O-N 3.38Å; N225-K228 PolarHBondContact O-N 2.9Å; N225-K228 PolarHBondContact OD1-NZ 2.87Å; N225-E229 WeakPolarHBondContact O-CG 3.5Å; N225-E229 PolarHBondContact O-N 3.1Å
226	L	84.6	Confident	81.8	Confident	82 Å²	82	83 Å²	83	43%	0.429	40%	0.401	S	S	.	.	H	α-helix	trans	-58.8	-45.1	172	-178.2	66.5	0	0	0	111.8	L222 Y223 E229 N230	L222-L226 PolarHBondContact O-N 3.08Å; Y223-L226 PolarHBondContact O-N 3.2Å; L226-E229 PolarHBondContact O-N 3.42Å; L226-N230 WeakPolarHBondContact O-CB 3.47Å; L226-N230 VanDerWaalsContact O-CG 3.25Å; L226-N230 PolarHBondContact O-N 2.83Å; L226-N230 PolarHBondContact O-ND2 2.93Å
227	V	84.3	Confident	80.5	Confident	41 Å²	41	83.9 Å²	83.9	25%	0.248	41%	0.405	C	S	.	.	H	α-helix	trans	-61.6	-44.4	175.8	164.6	0	0	0	0	111.5	F200 Y223 N225 E229 N230 Y231	F200-V227 HydrophobicContact CE2-CG1 4.27Å; F200-V227 HydrophobicContact CZ-CG1 3.84Å; F200-V227 HydrophobicContact CZ-CG2 4.37Å; Y223-V227 HydrophobicContact CD1-CG2 4.25Å; Y223-V227 HydrophobicContact CD2-CG2 4.29Å; Y223-V227 HydrophobicContact CE1-CG2 3.83Å; Y223-V227 HydrophobicContact CE2-CG2 3.86Å; Y223-V227 HydrophobicContact CG-CG2 4.5Å; Y223-V227 WeakPolarHBondContact O-CB 3.36Å; Y223-V227 WeakPolarHBondContact O-CG2 3.31Å; Y223-V227 PolarHBondContact O-N 3.25Å; N225-V227 PolarHBondContact O-N 3.38Å; V227-E229 VanDerWaalsContact C-N 3.34Å; V227-E229 PolarHBondContact O-N 3.21Å; V227-N230 PolarHBondContact O-N 3.24Å; V227-Y231 WeakPolarHBondContact O-CB 3.33Å; V227-Y231 PolarHBondContact O-N 2.72Å
228	K	79.1	Confident	78.9	Confident	97 Å²	97	82.4 Å²	82.4	42%	0.422	40%	0.401	S	S	.	.	H	α-helix	trans	-61.6	-39.2	175.2	-70.5	163.4	-157	160.9	0	111.9	E221 N224 N225 K232	E221-K228 IonicContact OE1-NZ 3.57Å; E221-K228 PolarHBondContact OE1-NZ 3.2Å; N224-K228 WeakPolarHBondContact O-CB 3.24Å; N224-K228 WeakPolarHBondContact O-CD 3.46Å; N224-K228 WeakPolarHBondContact O-CG 3.41Å; N224-K228 PolarHBondContact O-N 3.28Å; N225-K228 PolarHBondContact O-N 2.9Å; N225-K228 PolarHBondContact OD1-NZ 2.87Å; K228-K232 VanDerWaalsContact O-CG 3.25Å; K228-K232 WeakPolarHBondContact O-CG 3.35Å; K228-K232 PolarHBondContact O-N 3.18Å; K228-K232 VanDerWaalsContact O-N 3.15Å
229	E	76.1	Confident	77.1	Confident	120 Å²	120	78.3 Å²	78.3	56%	0.561	40%	0.402	S	S	*	.	H	α-helix	trans	-70.5	-45.6	177.7	-73.4	-170.5	161.3	0	0	112.2	N225 L226 V227 Y231 K232 T233	N225-E229 WeakPolarHBondContact O-CG 3.5Å; N225-E229 PolarHBondContact O-N 3.1Å; L226-E229 PolarHBondContact O-N 3.42Å; V227-E229 VanDerWaalsContact C-N 3.34Å; V227-E229 PolarHBondContact O-N 3.21Å; E229-Y231 VanDerWaalsContact C-N 3.27Å; E229-Y231 PolarHBondContact O-N 2.86Å; E229-K232 WeakPolarHBondContact O-CB 3.49Å; E229-K232 PolarHBondContact O-N 3.11Å; E229-K232 VanDerWaalsContact O-N 3.09Å; E229-T233 PolarHBondContact O-N 3.37Å; E229-T233 PolarHBondContact O-OG1 3.37Å
230	N	77.2	Confident	75	Confident	33 Å²	33	83.6 Å²	83.6	18%	0.176	43%	0.427	C	S	.	.	H	α-helix	trans	-60.1	-36.2	175.4	-70.5	-19.5	0	0	0	112.4	F200 I203 L226 V227 T233 L234	F200-N230 HydrophobicContact CE2-CB 4.36Å; I203-N230 HydrophobicContact CG2-CB 4.06Å; I203-N230 WeakPolarHBondContact CG2-ND2 3.48Å; L226-N230 WeakPolarHBondContact O-CB 3.47Å; L226-N230 VanDerWaalsContact O-CG 3.25Å; L226-N230 PolarHBondContact O-N 2.83Å; L226-N230 PolarHBondContact O-ND2 2.93Å; V227-N230 PolarHBondContact O-N 3.24Å; N230-T233 WeakPolarHBondContact CA-OG1 3.37Å; N230-T233 PolarHBondContact O-OG1 3.47Å; N230-L234 WeakPolarHBondContact O-CG 3.39Å; N230-L234 PolarHBondContact O-N 3.3Å
231	Y	77.2	Confident	73.2	Confident	137 Å²	137	84.2 Å²	84.2	54%	0.537	44%	0.442	S	S	.	.	H	α-helix	trans	-66.7	-43.5	173	-173.9	-93.4	0	0	0	112.1	V227 E229 T233 L234 M235	V227-Y231 WeakPolarHBondContact O-CB 3.33Å; V227-Y231 PolarHBondContact O-N 2.72Å; E229-Y231 VanDerWaalsContact C-N 3.27Å; E229-Y231 PolarHBondContact O-N 2.86Å; Y231-T233 PolarHBondContact O-N 2.94Å; Y231-L234 PolarHBondContact O-N 2.9Å; Y231-M235 HydrophobicContact CD1-CG 4Å; Y231-M235 HydrophobicContact CE1-CG 3.58Å; Y231-M235 HydrophobicContact CE1-SD 4.25Å; Y231-M235 HydrophobicContact CE2-CG 4.46Å; Y231-M235 VanDerWaalsContact O-CG 3.27Å; Y231-M235 WeakPolarHBondContact O-CG 3.44Å; Y231-M235 PolarHBondContact O-N 3.39Å
232	K	77.3	Confident	70.7	Confident	132 Å²	132	84.6 Å²	84.6	57%	0.574	45%	0.454	S	S	*	.	H	α-helix	trans	-62.9	-39.6	177.3	-72.6	166.2	-174.1	173.6	0	112.7	K228 E229 S236	K228-K232 VanDerWaalsContact O-CG 3.25Å; K228-K232 WeakPolarHBondContact O-CG 3.35Å; K228-K232 PolarHBondContact O-N 3.18Å; K228-K232 VanDerWaalsContact O-N 3.15Å; E229-K232 WeakPolarHBondContact O-CB 3.49Å; E229-K232 PolarHBondContact O-N 3.11Å; E229-K232 VanDerWaalsContact O-N 3.09Å; K232-S236 WeakPolarHBondContact O-CB 3.48Å; K232-S236 PolarHBondContact O-N 2.71Å; K232-S236 PolarHBondContact O-OG 3.42Å
233	T	72.8	Confident	68.1	Low	71 Å²	71	85.1 Å²	85.1	44%	0.436	46%	0.462	S	S	.	.	H	α-helix	trans	-68.8	-42.7	179.6	52.5	0	0	0	0	111.5	E229 N230 Y231 S236 L237	E229-T233 PolarHBondContact O-N 3.37Å; E229-T233 PolarHBondContact O-OG1 3.37Å; N230-T233 WeakPolarHBondContact CA-OG1 3.37Å; N230-T233 PolarHBondContact O-OG1 3.47Å; Y231-T233 PolarHBondContact O-N 2.94Å; T233-S236 PolarHBondContact O-N 3.24Å; T233-L237 WeakPolarHBondContact O-CG 3.4Å; T233-L237 PolarHBondContact O-N 3.45Å
234	L	71.3	Confident	65.6	Low	13 Å²	13	88.6 Å²	88.6	7%	0.068	49%	0.49	C	S	.	.	H	α-helix	trans	-59.2	-49	172.5	-72.6	172.3	0	0	0	112.1	V198 F200 I203 N230 Y231 S236 L237 D238	V198-L234 HydrophobicContact CB-CD2 4.46Å; V198-L234 HydrophobicContact CG1-CD2 4.37Å; V198-L234 VanDerWaalsContact O-CD2 3.3Å; V198-L234 WeakPolarHBondContact O-CD2 3.35Å; F200-L234 HydrophobicContact CB-CD1 3.86Å; F200-L234 HydrophobicContact CD2-CD1 4.05Å; F200-L234 HydrophobicContact CG-CD1 4.47Å; I203-L234 HydrophobicContact CD1-CD1 4.17Å; I203-L234 HydrophobicContact CD1-CD2 3.84Å; I203-L234 HydrophobicContact CD1-CG 4.07Å; N230-L234 WeakPolarHBondContact O-CG 3.39Å; N230-L234 PolarHBondContact O-N 3.3Å; Y231-L234 PolarHBondContact O-N 2.9Å; L234-S236 PolarHBondContact O-N 3.27Å; L234-L237 PolarHBondContact O-N 3.46Å; L234-D238 PolarHBondContact O-N 2.93Å
235	M	71.1	Confident	62.8	Low	87 Å²	87	94.1 Å²	94.1	43%	0.429	51%	0.512	S	S	.	.	H	α-helix	trans	-61.9	-28.9	177.2	-66.7	-68.9	94.4	0	0	113.5	Y231 D238 A239	Y231-M235 HydrophobicContact CD1-CG 4Å; Y231-M235 HydrophobicContact CE1-CG 3.58Å; Y231-M235 HydrophobicContact CE1-SD 4.25Å; Y231-M235 HydrophobicContact CE2-CG 4.46Å; Y231-M235 VanDerWaalsContact O-CG 3.27Å; Y231-M235 WeakPolarHBondContact O-CG 3.44Å; Y231-M235 PolarHBondContact O-N 3.39Å; M235-D238 WeakPolarHBondContact CE-OD2 3.47Å; M235-A239 WeakPolarHBondContact O-CB 3.28Å; M235-A239 PolarHBondContact O-N 2.95Å
236	S	72.9	Confident	60.4	Low	75 Å²	75	96.7 Å²	96.7	52%	0.524	53%	0.532	S	S	.	.	H	α-helix	trans	-74.8	-35.9	174.5	-59.6	0	0	0	0	112.2	K232 T233 L234	K232-S236 WeakPolarHBondContact O-CB 3.48Å; K232-S236 PolarHBondContact O-N 2.71Å; K232-S236 PolarHBondContact O-OG 3.42Å; T233-S236 PolarHBondContact O-N 3.24Å; L234-S236 PolarHBondContact O-N 3.27Å
237	L	62.5	Low	57.9	Low	111 Å²	111	100.3 Å²	100.3	58%	0.581	55%	0.551	S	S	*	*	H	α-helix	trans	-68.6	-40.3	175.2	-70.1	167.2	0	0	0	112.1	T233 L234 A239 E240	T233-L237 WeakPolarHBondContact O-CG 3.4Å; T233-L237 PolarHBondContact O-N 3.45Å; L234-L237 PolarHBondContact O-N 3.46Å; L237-A239 VanDerWaalsContact C-N 3.31Å; L237-A239 PolarHBondContact O-N 3.17Å; L237-E240 PolarHBondContact O-N 2.86Å
238	D	56	Low	55.2	Low	106 Å²	106	102.8 Å²	102.8	57%	0.567	58%	0.576	S	S	*	*	H	α-helix	trans	-66	-34.3	176.8	-72.7	-32.4	0	0	0	112.2	L234 M235 E240 G241	L234-D238 PolarHBondContact O-N 2.93Å; M235-D238 WeakPolarHBondContact CE-OD2 3.47Å; D238-E240 VanDerWaalsContact C-N 3.3Å; D238-E240 PolarHBondContact O-N 3.07Å; D238-G241 PolarHBondContact O-N 2.99Å
239	A	52.1	Low	53.3	Low	76 Å²	76	104.1 Å²	104.1	63%	0.628	60%	0.595	S	S	*	*	H	α-helix	trans	-66.3	-26.6	178.5	0	0	0	0	0	113.8	M235 L237 G241	M235-A239 WeakPolarHBondContact O-CB 3.28Å; M235-A239 PolarHBondContact O-N 2.95Å; L237-A239 VanDerWaalsContact C-N 3.31Å; L237-A239 PolarHBondContact O-N 3.17Å; A239-G241 VanDerWaalsContact C-N 3.33Å
240	E	44.5	Very low	51.1	Low	175 Å²	175	105.2 Å²	105.2	82%	0.818	61%	0.609	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.5	-11.1	173	-65.1	-172	173.8	0	0	112.8	L237 D238	L237-E240 PolarHBondContact O-N 2.86Å; D238-E240 VanDerWaalsContact C-N 3.3Å; D238-E240 PolarHBondContact O-N 3.07Å
241	G	49	Very low	48.5	Very low	45 Å²	45	112.7 Å²	112.7	46%	0.464	64%	0.643	S	S	.	*	T	Hydrogen-bonded Turn	trans	-88	-18.5	-169.6	0	0	0	0	0	116.8	D238 A239	D238-G241 PolarHBondContact O-N 2.99Å; A239-G241 VanDerWaalsContact C-N 3.33Å
242	S	37.1	Very low	46.2	Very low	93 Å²	93	111 Å²	111	65%	0.65	66%	0.657	S	S	*	*			trans	-139.7	129.3	-175	-55.1	0	0	0	0	108.8
243	V	27.9	Very low	43.7	Very low	119 Å²	119	113.5 Å²	113.5	72%	0.721	67%	0.671	S	S	*	*			cis	-155.2	129.7	40.9	166.8	0	0	0	0	110	K245	V243-K245 PolarHBondContact O-N 2.97Å
244	P	33.6	Very low	41.7	Very low	123 Å²	123	115.1 Å²	115.1	80%	0.799	68%	0.683	S	S	*	*	P	Polyproline II helix	trans	-69.4	123.6	156.2	-15.3	31	0	0	0	109.6
245	K	27.5	Very low	39.6	Very low	178 Å²	178	125.9 Å²	125.9	77%	0.774	72%	0.722	S	S	*	*	P	Polyproline II helix	trans	-56.8	134.8	-178.9	-173.3	179.6	-179.3	-177	0	111.2	V243 D247	V243-K245 PolarHBondContact O-N 2.97Å; K245-D247 PolarHBondContact O-N 3.38Å
246	P	33.9	Very low	37.6	Very low	117 Å²	117	131 Å²	131	76%	0.76	75%	0.745	S	S	*	*	P	Polyproline II helix	trans	-77	118.5	-178.8	29.9	-33.3	0	0	0	111.1
247	D	32.3	Very low	35.3	Very low	157 Å²	157	136.3 Å²	136.3	84%	0.84	76%	0.762	S	S	*	*	P	Polyproline II helix	trans	-84.5	160.3	165.1	-78.9	-47.2	0	0	0	111.6	K245	K245-D247 PolarHBondContact O-N 3.38Å
248	A	28.4	Very low	33.8	Very low	93 Å²	93	136.1 Å²	136.1	77%	0.769	77%	0.767	S	S	*	*	P	Polyproline II helix	trans	-71.8	165.5	-160.5	0	0	0	0	0	115.2
249	P	37.8	Very low	32.5	Very low	125 Å²	125	137.4 Å²	137.4	81%	0.812	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-88.5	151.5	-154.9	34.8	-36.2	0	0	0	115.1
250	V	30	Very low	31	Very low	143 Å²	143	138.4 Å²	138.4	87%	0.867	78%	0.781	S	S	*	*			trans	-124.8	128.2	160.5	175.7	0	0	0	0	108.8
251	Q	24.1	Very low	29.9	Very low	190 Å²	190	142.2 Å²	142.2	89%	0.888	79%	0.788	S	S	*	*			trans	-76.7	135.4	178	-64.9	167.8	-43.8	0	0	111.5
252	A	28.1	Very low	28.6	Very low	101 Å²	101	148.1 Å²	148.1	84%	0.835	80%	0.804	S	S	*	*			trans	-157.2	136.3	147.5	0	0	0	0	0	110.3
253	E	24.6	Very low	28	Very low	185 Å²	185	152.3 Å²	152.3	86%	0.864	81%	0.813	S	S	*	*			trans	-64.7	158.3	-166.6	-77.8	-76.2	110.6	0	0	116.6
254	P	30.1	Very low	27.8	Very low	105 Å²	105	158.3 Å²	158.3	68%	0.682	82%	0.823	S	S	*	*			trans	-91.1	145.6	-174.7	36.2	-33.6	0	0	0	113.4
255	R	28	Very low	27.3	Very low	239 Å²	239	160.8 Å²	160.8	90%	0.902	82%	0.824	S	S	*	*			trans	-145.6	148.8	159.3	-73.2	-163.2	171.6	-160.4	-4.6	111.7
256	E	29.5	Very low	27.4	Very low	194 Å²	194	157.3 Å²	157.3	91%	0.907	82%	0.819	S	S	*	*			trans	86.6	101.3	169.7	-58.3	-178.6	-178.4	0	0	116.5
257	E	23.7	Very low	26.9	Very low	187 Å²	187	160.9 Å²	160.9	87%	0.874	83%	0.825	S	S	*	*			trans	-75.8	-170.4	170.8	-49.5	170.9	125.7	0	0	111
258	P	30.9	Very low	26.6	Very low	107 Å²	107	162.2 Å²	162.2	70%	0.695	83%	0.827	S	S	*	*				-128.7	156.4	-57.3	31.4	-15.8	0	0	0	112.2
259	C	28.5	Very low	26.3	Very low	133 Å²	133	168 Å²	168	90%	0.899	83%	0.829	S	S	*	*			trans	-134.2	101.3	157.8	-100.6	0	0	0	0	110.1
260	V	21.8	Very low	25.6	Very low	98 Å²	98	169.6 Å²	169.6	59%	0.594	83%	0.825	S	S	*	*			trans	-77.4	122.4	175.9	170.6	0	0	0	0	110	E262	V260-E262 HydrophobicContact CG1-CB 4.26Å; V260-E262 HydrophobicContact CG1-CG 3.88Å; V260-E262 VanDerWaalsContact CG1-OE2 3.31Å; V260-E262 WeakPolarHBondContact CG1-OE2 3.44Å
261	W	20.4	Very low	25.3	Very low	254 Å²	254	169.9 Å²	169.9	96%	0.962	82%	0.821	S	S	*	*			trans	-127.8	81.3	151.6	-69.9	-22.3	0	0	0	108.3	Q263	W261-Q263 PolarHBondContact O-N 3.24Å
262	E	22.5	Very low	25.5	Very low	169 Å²	169	166.6 Å²	166.6	79%	0.79	82%	0.815	S	S	*	*			trans	-68.7	127.6	177.4	-84.6	163	127.1	0	0	111.7	V260 R264	V260-E262 HydrophobicContact CG1-CB 4.26Å; V260-E262 HydrophobicContact CG1-CG 3.88Å; V260-E262 VanDerWaalsContact CG1-OE2 3.31Å; V260-E262 WeakPolarHBondContact CG1-OE2 3.44Å; E262-R264 PolarHBondContact O-N 3.49Å
263	Q	24.2	Very low	25.1	Very low	182 Å²	182	169.4 Å²	169.4	85%	0.85	81%	0.813	S	S	*	*			trans	-68.1	117	169.8	-68.4	172.8	-3	0	0	109.3	W261 H265	W261-Q263 PolarHBondContact O-N 3.24Å; Q263-H265 PolarHBondContact O-N 3.2Å; Q263-H265 VanDerWaalsContact O-N 3.11Å
264	R	24.3	Very low	25.4	Very low	245 Å²	245	167.9 Å²	167.9	93%	0.925	81%	0.811	S	S	*	*			trans	-75.9	96.1	166.5	-75.8	-170.8	177.3	-174.1	-0.5	109.8	E262	E262-R264 PolarHBondContact O-N 3.49Å
265	H	23.6	Very low	25.8	Very low	175 Å²	175	167.9 Å²	167.9	81%	0.81	81%	0.811	S	S	*	*			trans	-76.5	129	156.3	-130.2	-85.6	0	0	0	108.4	Q263	Q263-H265 PolarHBondContact O-N 3.2Å; Q263-H265 VanDerWaalsContact O-N 3.11Å
266	P	29.7	Very low	25.6	Very low	104 Å²	104	165.4 Å²	165.4	68%	0.675	81%	0.81	S	S	*	*			trans	-90.3	123.1	176	32.7	-29.7	0	0	0	110.8
267	E	22.7	Very low	25.6	Very low	192 Å²	192	161.3 Å²	161.3	90%	0.897	81%	0.809	S	S	*	*			trans	-173.4	167.2	144	-107	163.6	-174.2	0	0	111
268	E	25.3	Very low	25.6	Very low	186 Å²	186	156.3 Å²	156.3	87%	0.869	81%	0.808	S	S	*	*			trans	80.6	78.1	174.9	-49.8	-157.7	128.3	0	0	120
269	R	22.6	Very low	25.7	Very low	213 Å²	213	156.3 Å²	156.3	80%	0.804	82%	0.817	S	S	*	*				54.6	111.8	103.6	176	166.9	-175	147.3	8.2	120.2
270	E	23.6	Very low	25.5	Very low	160 Å²	160	157.9 Å²	157.9	75%	0.748	81%	0.811	S	S	*	*				174.4	165.3	113.6	-74.5	-125.9	138.6	0	0	112.9
271	I	23.4	Very low	25.9	Very low	149 Å²	149	158.1 Å²	158.1	76%	0.764	82%	0.815	S	S	*	*			trans	-128.9	136.9	-158.9	-61.2	157.9	0	0	0	111.3
272	P	27.6	Very low	26.4	Very low	120 Å²	120	153.4 Å²	153.4	78%	0.779	81%	0.808	S	S	*	*				-143.3	130.3	119.7	25	-4.8	0	0	0	113.2
273	M	20.5	Very low	26.6	Very low	161 Å²	161	151.7 Å²	151.7	79%	0.793	81%	0.808	S	S	*	*				61.3	107.1	78.7	-82.5	-69.8	179.6	0	0	116.1
274	D	30.4	Very low	27.6	Very low	153 Å²	153	148.3 Å²	148.3	82%	0.818	80%	0.802	S	S	*	*				-171.3	172.8	117.8	-113.7	-28	0	0	0	111.2
275	P	37.8	Very low	27.8	Very low	105 Å²	105	140.8 Å²	140.8	68%	0.682	79%	0.792	S	S	*	*				-133.1	-168.7	-128.1	42.4	-22.6	0	0	0	116.8
276	E	25	Very low	27.9	Very low	186 Å²	186	140.5 Å²	140.5	87%	0.869	79%	0.791	S	S	*	*			trans	118.2	143.8	157.2	-65.3	-141.7	120.1	0	0	118.4
277	A	28.5	Very low	27.9	Very low	109 Å²	109	142 Å²	142	90%	0.901	79%	0.794	S	S	*	*			trans	59.8	117.4	175.3	0	0	0	0	0	117.6
278	G	24.8	Very low	28	Very low	82 Å²	82	137 Å²	137	85%	0.845	79%	0.786	S	S	*	*			cis	133.3	93.3	0.9	0	0	0	0	0	112.1
279	A	32.6	Very low	28	Very low	107 Å²	107	134 Å²	134	88%	0.884	78%	0.784	S	S	*	*			trans	-164.8	78	170.1	0	0	0	0	0	112.8
280	E	23.5	Very low	28.4	Very low	165 Å²	165	129.4 Å²	129.4	77%	0.771	79%	0.785	S	S	*	*			trans	-78.9	155.9	151.1	-105	-86	126.8	0	0	107.4	L282	E280-L282 PolarHBondContact OE2-N 2.99Å
281	P	30.6	Very low	28.6	Very low	103 Å²	103	130.6 Å²	130.6	67%	0.669	79%	0.791	S	S	*	*				-159.9	168.3	65.3	43.2	-21.2	0	0	0	120.8
282	L	31.2	Very low	28.6	Very low	156 Å²	156	129.2 Å²	129.2	82%	0.817	79%	0.789	S	S	*	*			trans	104.9	128.8	147.7	-56.6	-176.1	0	0	0	121	E280	E280-L282 PolarHBondContact OE2-N 2.99Å
283	V	25.5	Very low	28.8	Very low	132 Å²	132	131.5 Å²	131.5	80%	0.8	79%	0.787	S	S	*	*			trans	-113.1	-166.8	174.9	-130.3	0	0	0	0	108.2
284	P	46.9	Very low	28.9	Very low	112 Å²	112	135.2 Å²	135.2	73%	0.727	79%	0.792	S	S	*	*			cis	-136.3	-170	-26.1	34.7	-13.2	0	0	0	115.3
285	A	26.9	Very low	28.7	Very low	87 Å²	87	134.8 Å²	134.8	72%	0.719	79%	0.785	S	S	*	*			trans	79.2	151.6	149.7	0	0	0	0	0	119.6
286	Q	26.3	Very low	28.1	Very low	168 Å²	168	137.1 Å²	137.1	79%	0.785	79%	0.792	S	S	*	*			cis	-162.6	175.5	-15.7	-117.3	-175.6	-39.2	0	0	111.8
287	D	29.4	Very low	28.2	Very low	137 Å²	137	134.3 Å²	134.3	73%	0.733	79%	0.788	S	S	*	*			trans	81	101.3	153.8	-63.5	-26.7	0	0	0	124.9
288	A	25.3	Very low	28.1	Very low	87 Å²	87	137 Å²	137	72%	0.719	79%	0.786	S	S	*	*				62.6	103.1	109.7	0	0	0	0	0	123.8
289	S	25.5	Very low	28	Very low	121 Å²	121	139 Å²	139	85%	0.846	79%	0.786	S	S	*	*				33.1	110.8	123.2	-57.1	0	0	0	0	123.1
290	S	31.5	Very low	27.9	Very low	118 Å²	118	140.8 Å²	140.8	83%	0.825	79%	0.785	S	S	*	*				179.6	110.6	125.8	50.4	0	0	0	0	110.2
291	Q	27.1	Very low	27.8	Very low	184 Å²	184	144.9 Å²	144.9	86%	0.86	79%	0.794	S	S	*	*				66.1	125.8	81.7	-110.5	-158.2	26.3	0	0	117.9
292	V	23.4	Very low	27.7	Very low	120 Å²	120	143.4 Å²	143.4	73%	0.727	80%	0.797	S	S	*	*			trans	71.5	108.9	154.8	-174.9	0	0	0	0	118.9
293	K	32.5	Very low	27.4	Very low	168 Å²	168	143.8 Å²	143.8	73%	0.73	80%	0.795	S	S	*	*				-157.2	143.1	105.5	-136.7	177.8	176.6	-157.1	0	113.4	E295	K293-E295 WeakPolarHBondContact CD-OE1 3.47Å; K293-E295 WeakPolarHBondContact CE-OE1 3.46Å; K293-E295 IonicContact NZ-OE1 3.89Å; K293-E295 PolarHBondContact NZ-OE1 2.87Å; K293-E295 IonicContact NZ-OE2 2.74Å
294	R	22.3	Very low	27.4	Very low	239 Å²	239	148.3 Å²	148.3	90%	0.902	80%	0.797	S	S	*	*			trans	-103.5	139.4	163.1	-59.2	171.4	-178.9	154.5	-1.8	107.4
295	E	25.9	Very low	26.5	Very low	145 Å²	145	146.1 Å²	146.1	68%	0.678	80%	0.795	S	S	*	*			trans	-169.9	143.2	143.8	47.2	-150.7	131.8	0	0	110.9	K293	K293-E295 WeakPolarHBondContact CD-OE1 3.47Å; K293-E295 WeakPolarHBondContact CE-OE1 3.46Å; K293-E295 IonicContact NZ-OE1 3.89Å; K293-E295 PolarHBondContact NZ-OE1 2.87Å; K293-E295 IonicContact NZ-OE2 2.74Å
296	D	25	Very low	26.3	Very low	153 Å²	153	150.3 Å²	150.3	82%	0.818	81%	0.805	S	S	*	*			trans	-67.7	159	179.6	-48.2	-89.7	0	0	0	112.2
297	T	27.7	Very low	26.1	Very low	128 Å²	128	151.1 Å²	151.1	79%	0.785	81%	0.809	S	S	*	*			trans	176.1	116.4	139.1	-79.3	0	0	0	0	113.3
298	L	26.7	Very low	25.9	Very low	166 Å²	166	152.8 Å²	152.8	87%	0.869	81%	0.812	S	S	*	*			trans	61.1	138.2	148.9	-64.2	171.3	0	0	0	123.5
299	C	23	Very low	25.8	Very low	124 Å²	124	159.5 Å²	159.5	84%	0.838	82%	0.818	S	S	*	*			trans	-65.6	145.4	167.5	-51.3	0	0	0	0	113.8
300	V	29.1	Very low	25.7	Very low	143 Å²	143	158.4 Å²	158.4	87%	0.867	82%	0.817	S	S	*	*			trans	-131.3	126	144.8	176.6	0	0	0	0	109.8	G302	V300-G302 PolarHBondContact O-N 2.75Å
301	R	22.8	Very low	25.4	Very low	252 Å²	252	160.6 Å²	160.6	95%	0.951	82%	0.818	S	S	*	*			trans	-76.1	107.3	172.8	172.1	-177.1	-77.7	165.8	-5.7	109.1
302	G	27.6	Very low	25.4	Very low	72 Å²	72	156.5 Å²	156.5	74%	0.742	81%	0.807	S	S	*	*			trans	-136.9	132.4	-179	0	0	0	0	0	112.7	V300	V300-G302 PolarHBondContact O-N 2.75Å
303	Q	24.6	Very low	25.5	Very low	164 Å²	164	157.2 Å²	157.2	77%	0.766	81%	0.812	S	S	*	*			trans	-82.1	148.4	-167	-54.5	174	14.9	0	0	115
304	R	25.6	Very low	25.5	Very low	226 Å²	226	157.3 Å²	157.3	85%	0.853	82%	0.815	S	S	*	*			trans	75.6	128.2	136.1	-164.1	-170.2	-52.5	-100.9	-0.3	119.9
305	G	27.3	Very low	25.6	Very low	67 Å²	67	150.3 Å²	150.3	69%	0.691	80%	0.802	S	S	*	*			trans	109.9	104	179.5	0	0	0	0	0	109.3
306	L	23.2	Very low	25.8	Very low	174 Å²	174	150.1 Å²	150.1	91%	0.911	81%	0.805	S	S	*	*				43	87.6	55.7	-97.1	177.7	0	0	0	111.9
307	E	23	Very low	26	Very low	186 Å²	186	148.7 Å²	148.7	87%	0.869	80%	0.802	S	S	*	*				-161.6	178.2	112	-79.1	-121.8	120.3	0	0	109.4
308	E	24.9	Very low	26.3	Very low	171 Å²	171	149.9 Å²	149.9	80%	0.799	80%	0.803	S	S	*	*			trans	-76.2	139	-154.9	-93.1	-179.3	91.8	0	0	118.4
309	R	23	Very low	26.8	Very low	228 Å²	228	146.4 Å²	146.4	86%	0.86	79%	0.793	S	S	*	*				41.3	99.6	124.7	-165.2	178.8	-169.2	126.6	5.8	118.8
310	A	24	Very low	27.8	Very low	98 Å²	98	146.6 Å²	146.6	81%	0.81	79%	0.793	S	S	*	*			trans	-156	109.8	130.2	0	0	0	0	0	110.5
311	I	23.8	Very low	28.5	Very low	165 Å²	165	143.6 Å²	143.6	85%	0.846	77%	0.771	S	S	*	*			trans	-127.7	136.7	161.7	-63.5	-178	0	0	0	106.8
312	P	28.5	Very low	30.1	Very low	98 Å²	98	134.5 Å²	134.5	64%	0.636	75%	0.746	S	S	*	*			trans	-81.1	160.7	-154.2	-16.7	33.9	0	0	0	115.6	E314	P312-E314 PolarHBondContact O-N 2.86Å
313	T	25.9	Very low	31.4	Very low	135 Å²	135	134.3 Å²	134.3	83%	0.828	74%	0.737	S	S	*	*			trans	-73.2	84.9	170.8	-51.5	0	0	0	0	110.6	S315	T313-S315 PolarHBondContact O-N 2.81Å
314	E	31	Very low	33.1	Very low	169 Å²	169	133.5 Å²	133.5	79%	0.79	73%	0.733	S	S	*	*			trans	-74.4	102.7	164.9	-58.3	-56.4	143.6	0	0	108.8	P312	P312-E314 PolarHBondContact O-N 2.86Å
315	S	25.8	Very low	35.2	Very low	92 Å²	92	127 Å²	127	64%	0.643	72%	0.716	S	S	*	*			trans	-75.3	-174.7	169.3	56.9	0	0	0	0	111	T313	T313-S315 PolarHBondContact O-N 2.81Å
316	I	28.3	Very low	36.7	Very low	142 Å²	142	128 Å²	128	73%	0.728	71%	0.705	S	S	*	*			trans	85.1	82.3	-176.5	-50.5	163.7	0	0	0	110.9
317	T	29.2	Very low	38.5	Very low	122 Å²	122	124.8 Å²	124.8	75%	0.748	69%	0.688	S	S	*	*				47.7	91.7	87.5	71.2	0	0	0	0	113.3
318	D	34.8	Very low	40.5	Very low	154 Å²	154	119.2 Å²	119.2	82%	0.824	67%	0.669	S	S	*	*			trans	-152.3	135.8	134.9	-116.7	-38.6	0	0	0	113.2
319	S	37.6	Very low	42.5	Very low	93 Å²	93	117.6 Å²	117.6	65%	0.65	66%	0.656	S	S	*	*			trans	1.1	145.3	163.2	-53	0	0	0	0	120.8	I321	S319-I321 PolarHBondContact O-N 3.26Å
320	P	43.7	Very low	44	Very low	128 Å²	128	111.2 Å²	111.2	83%	0.831	64%	0.638	S	S	*	*	P	Polyproline II helix	trans	-59.7	128	-175.1	25.7	-35.3	0	0	0	112.7	S322	P320-S322 PolarHBondContact O-N 2.81Å
321	I	42.9	Very low	45.9	Very low	80 Å²	80	113 Å²	113	41%	0.41	63%	0.628	S	S	.	*	P	Polyproline II helix	trans	-51.6	119.2	176.1	-61.6	175.4	0	0	0	109.1	S319 D325 L326	S319-I321 PolarHBondContact O-N 3.26Å; I321-D325 HydrophobicContact CG2-CB 3.47Å; I321-D325 VanDerWaalsContact CG2-CB 3.47Å; I321-L326 HydrophobicContact CG2-CD2 4.37Å; I321-L326 HydrophobicContact CG2-CG 4.17Å
322	S	57.2	Low	47.1	Very low	60 Å²	60	111 Å²	111	42%	0.42	61%	0.614	S	S	.	*	P	Polyproline II helix	trans	-57.9	146.7	-179	175.8	0	0	0	0	110.7	P320 Q324 D325 L326	P320-S322 PolarHBondContact O-N 2.81Å; S322-Q324 PolarHBondContact O-N 3.17Å; S322-D325 WeakPolarHBondContact O-CB 3.4Å; S322-D325 PolarHBondContact O-N 3.01Å; S322-L326 PolarHBondContact O-N 3.31Å
323	A	54.7	Low	47.8	Very low	68 Å²	68	111.6 Å²	111.6	56%	0.562	61%	0.609	S	S	*	*	H	α-helix	trans	-55.4	-26.4	177.4	0	0	0	0	0	112.9	L327	A323-L327 WeakPolarHBondContact O-CB 3.39Å; A323-L327 PolarHBondContact O-N 3.2Å
324	Q	61.4	Low	48.5	Very low	147 Å²	147	112 Å²	112	69%	0.687	60%	0.601	S	S	*	*	H	α-helix	trans	-69.7	-32.5	173.9	-74.5	177.3	-45.7	0	0	113.4	S322 S328	S322-Q324 PolarHBondContact O-N 3.17Å; Q324-S328 WeakPolarHBondContact O-CB 3.47Å; Q324-S328 PolarHBondContact O-N 2.98Å; Q324-S328 PolarHBondContact O-OG 3.2Å
325	D	68.7	Low	48.8	Very low	91 Å²	91	111.1 Å²	111.1	49%	0.487	60%	0.597	S	S	.	*	H	α-helix	trans	-74.9	-35.8	174.1	-73.4	-37.6	0	0	0	111.4	I321 S322 S328 R329	I321-D325 HydrophobicContact CG2-CB 3.47Å; I321-D325 VanDerWaalsContact CG2-CB 3.47Å; S322-D325 WeakPolarHBondContact O-CB 3.4Å; S322-D325 PolarHBondContact O-N 3.01Å; D325-S328 PolarHBondContact O-N 3.41Å; D325-R329 WeakPolarHBondContact O-CB 3.49Å; D325-R329 WeakPolarHBondContact O-CG 3.38Å; D325-R329 PolarHBondContact O-N 3.49Å
326	L	60.2	Low	49.1	Very low	87 Å²	87	113.4 Å²	113.4	46%	0.455	60%	0.597	S	S	.	*	H	α-helix	trans	-62.2	-46.6	170.1	-71.3	174.5	0	0	0	111.5	I321 S322 S328 R329 I330	I321-L326 HydrophobicContact CG2-CD2 4.37Å; I321-L326 HydrophobicContact CG2-CG 4.17Å; S322-L326 PolarHBondContact O-N 3.31Å; L326-S328 VanDerWaalsContact C-N 3.26Å; L326-S328 PolarHBondContact O-N 2.99Å; L326-R329 PolarHBondContact O-N 3.14Å; L326-I330 VanDerWaalsContact O-CG1 3.28Å; L326-I330 WeakPolarHBondContact O-CG1 3.47Å; L326-I330 PolarHBondContact O-N 2.89Å
327	L	60	Low	49.3	Very low	107 Å²	107	111 Å²	111	56%	0.56	59%	0.592	S	S	*	*	H	α-helix	trans	-62.6	-31.5	174.3	-91.1	149.1	0	0	0	113	A323 K331	A323-L327 WeakPolarHBondContact O-CB 3.39Å; A323-L327 PolarHBondContact O-N 3.2Å; L327-K331 WeakPolarHBondContact O-CG 3.47Å; L327-K331 PolarHBondContact O-N 3.31Å
328	S	66	Low	49.4	Very low	69 Å²	69	110 Å²	110	48%	0.483	59%	0.586	S	S	.	*	H	α-helix	trans	-74.6	-38.9	175.4	-59.2	0	0	0	0	112	Q324 D325 L326 K331 Q332	Q324-S328 WeakPolarHBondContact O-CB 3.47Å; Q324-S328 PolarHBondContact O-N 2.98Å; Q324-S328 PolarHBondContact O-OG 3.2Å; D325-S328 PolarHBondContact O-N 3.41Å; L326-S328 VanDerWaalsContact C-N 3.26Å; L326-S328 PolarHBondContact O-N 2.99Å; S328-K331 PolarHBondContact O-N 2.91Å; S328-Q332 WeakPolarHBondContact O-CB 3.21Å; S328-Q332 PolarHBondContact O-N 3.23Å
329	R	66.8	Low	49.3	Very low	137 Å²	137	113.8 Å²	113.8	52%	0.517	59%	0.589	S	S	.	*	H	α-helix	trans	-62.5	-46.8	171.5	-76.7	-179.2	179	-173.3	0.6	112	D325 L326 K331 Q332 E333	D325-R329 WeakPolarHBondContact O-CB 3.49Å; D325-R329 WeakPolarHBondContact O-CG 3.38Å; D325-R329 PolarHBondContact O-N 3.49Å; L326-R329 PolarHBondContact O-N 3.14Å; R329-K331 VanDerWaalsContact C-N 3.31Å; R329-K331 PolarHBondContact O-N 3.46Å; R329-Q332 CarbonylContact O-C 3.54Å; R329-Q332 WeakPolarHBondContact O-CA 3.22Å; R329-Q332 WeakPolarHBondContact O-CB 3.32Å; R329-Q332 PolarHBondContact O-N 2.68Å; R329-E333 WeakPolarHBondContact O-CG 3.26Å; R329-E333 PolarHBondContact O-N 3.2Å
330	I	53.3	Low	48.9	Very low	93 Å²	93	116 Å²	116	48%	0.477	59%	0.593	S	S	.	*	H	α-helix	trans	-59.7	-42.1	177.6	-67.9	162.5	0	0	0	111	L326 Q332 E333 E334	L326-I330 VanDerWaalsContact O-CG1 3.28Å; L326-I330 WeakPolarHBondContact O-CG1 3.47Å; L326-I330 PolarHBondContact O-N 2.89Å; I330-Q332 VanDerWaalsContact C-N 3.31Å; I330-Q332 PolarHBondContact O-N 3.46Å; I330-E333 PolarHBondContact O-N 3.01Å; I330-E334 PolarHBondContact O-N 3.02Å
331	K	64.4	Low	48.4	Very low	137 Å²	137	118.1 Å²	118.1	60%	0.596	59%	0.592	S	S	*	*	H	α-helix	trans	-65.5	-32.4	173.1	-78.6	-176.1	174.2	-174.8	0	113.4	L327 S328 R329 H335	L327-K331 WeakPolarHBondContact O-CG 3.47Å; L327-K331 PolarHBondContact O-N 3.31Å; S328-K331 PolarHBondContact O-N 2.91Å; R329-K331 VanDerWaalsContact C-N 3.31Å; R329-K331 PolarHBondContact O-N 3.46Å; K331-H335 PolarHBondContact O-CD2 3.46Å; K331-H335 PolarHBondContact O-N 3.24Å
332	Q	49.3	Very low	48	Very low	121 Å²	121	122.4 Å²	122.4	57%	0.565	61%	0.61	S	S	*	*	H	α-helix	trans	-74.3	-33.5	175.4	-167.4	169.6	-1.4	0	0	111.6	S328 R329 I330 H335 Q336	S328-Q332 WeakPolarHBondContact O-CB 3.21Å; S328-Q332 PolarHBondContact O-N 3.23Å; R329-Q332 CarbonylContact O-C 3.54Å; R329-Q332 WeakPolarHBondContact O-CA 3.22Å; R329-Q332 WeakPolarHBondContact O-CB 3.32Å; R329-Q332 PolarHBondContact O-N 2.68Å; I330-Q332 VanDerWaalsContact C-N 3.31Å; I330-Q332 PolarHBondContact O-N 3.46Å; Q332-H335 CarbonylContact O-C 3.55Å; Q332-H335 PolarHBondContact O-N 3.37Å; Q332-Q336 WeakPolarHBondContact O-CG 3.46Å; Q332-Q336 PolarHBondContact O-N 3.4Å
333	E	43.3	Very low	46.8	Very low	112 Å²	112	127.4 Å²	127.4	52%	0.523	63%	0.632	S	S	.	*	H	α-helix	trans	-69.8	-40.3	173.3	-74.5	175.4	163.2	0	0	112	R329 I330 H335 Q336 C337	R329-E333 WeakPolarHBondContact O-CG 3.26Å; R329-E333 PolarHBondContact O-N 3.2Å; I330-E333 PolarHBondContact O-N 3.01Å; E333-H335 PolarHBondContact O-N 2.75Å; E333-Q336 CarbonylContact O-C 3.51Å; E333-Q336 WeakPolarHBondContact O-CA 3.23Å; E333-Q336 PolarHBondContact O-N 2.98Å; E333-C337 PolarHBondContact O-N 3.4Å; E333-C337 PolarHBondContact O-SG 3.5Å
334	E	39.1	Very low	45.9	Very low	142 Å²	142	131.5 Å²	131.5	66%	0.664	64%	0.644	S	S	*	*	H	α-helix	trans	-56.4	-35.1	169.7	-80.1	-170.5	132	0	0	112.1	I330	I330-E334 PolarHBondContact O-N 3.02Å
335	H	38.4	Very low	44.5	Very low	152 Å²	152	128 Å²	128	70%	0.704	64%	0.641	S	S	*	*	H	α-helix	trans	-81.6	-18.3	174.7	-79.8	-117	0	0	0	113.9	K331 Q332 E333 V338	K331-H335 PolarHBondContact O-CD2 3.46Å; K331-H335 PolarHBondContact O-N 3.24Å; Q332-H335 CarbonylContact O-C 3.55Å; Q332-H335 PolarHBondContact O-N 3.37Å; E333-H335 PolarHBondContact O-N 2.75Å; H335-V338 WeakPolarHBondContact O-CG2 3.34Å
336	Q	32.5	Very low	42.8	Very low	139 Å²	139	131.5 Å²	131.5	65%	0.65	66%	0.659	S	S	*	*	H	α-helix	trans	-86.7	-16.6	171.1	-75	176.8	-12.1	0	0	112.5	Q332 E333 V338	Q332-Q336 WeakPolarHBondContact O-CG 3.46Å; Q332-Q336 PolarHBondContact O-N 3.4Å; E333-Q336 CarbonylContact O-C 3.51Å; E333-Q336 WeakPolarHBondContact O-CA 3.23Å; E333-Q336 PolarHBondContact O-N 2.98Å; Q336-V338 PolarHBondContact O-N 3.02Å
337	C	32	Very low	41.6	Very low	92 Å²	92	137.5 Å²	137.5	62%	0.622	68%	0.676	S	S	*	*			trans	-79.6	22.2	168	-67	0	0	0	0	114	E333 W339	E333-C337 PolarHBondContact O-N 3.4Å; E333-C337 PolarHBondContact O-SG 3.5Å; C337-W339 VanDerWaalsContact C-N 3.35Å; C337-W339 PolarHBondContact O-N 3.12Å
338	V	31.6	Very low	40.1	Very low	102 Å²	102	140.2 Å²	140.2	62%	0.618	69%	0.691	S	S	*	*	S	Bend	trans	-71.3	97.1	158.6	177.9	0	0	0	0	107.2	H335 Q336 D340	H335-V338 WeakPolarHBondContact O-CG2 3.34Å; Q336-V338 PolarHBondContact O-N 3.02Å; V338-D340 PolarHBondContact O-N 2.93Å
339	W	32.8	Very low	38.4	Very low	232 Å²	232	143.4 Å²	143.4	88%	0.879	70%	0.701	S	S	*	*			trans	-45	121.5	170.6	-66.2	83.3	0	0	0	110.2	C337 Q341	C337-W339 VanDerWaalsContact C-N 3.35Å; C337-W339 PolarHBondContact O-N 3.12Å; W339-Q341 PolarHBondContact O-N 3.43Å
340	D	28.2	Very low	36.7	Very low	141 Å²	141	143 Å²	143	75%	0.754	72%	0.716	S	S	*	*			trans	-54.5	96.9	-176.8	-84.2	-60.5	0	0	0	111.3	V338 Q342	V338-D340 PolarHBondContact O-N 2.93Å; D340-Q342 PolarHBondContact O-N 3.18Å
341	Q	34.6	Very low	35.5	Very low	171 Å²	171	144.5 Å²	144.5	80%	0.799	73%	0.73	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.8	7	-172.7	-158	167.9	99.1	0	0	112.4	W339	W339-Q341 PolarHBondContact O-N 3.43Å
342	Q	33.7	Very low	33.9	Very low	171 Å²	171	144.9 Å²	144.9	80%	0.799	74%	0.738	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.9	-15.2	-173.9	-79.9	172.5	-28.6	0	0	114.4	D340 L344	D340-Q342 PolarHBondContact O-N 3.18Å; Q342-L344 VanDerWaalsContact C-N 3.31Å
343	D	32.1	Very low	33.9	Very low	164 Å²	164	144.3 Å²	144.3	88%	0.877	75%	0.745	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.6	1.6	172.8	-112.7	-47.8	0	0	0	113.7
344	L	35.7	Very low	33.7	Very low	154 Å²	154	146.2 Å²	146.2	81%	0.806	76%	0.759	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108	10.1	176.6	-148	73.7	0	0	0	113.8	Q342	Q342-L344 VanDerWaalsContact C-N 3.31Å
345	A	33	Very low	33.5	Very low	75 Å²	75	144.8 Å²	144.8	62%	0.62	77%	0.765	S	S	*	*	S	Bend	trans	-80.5	-20.6	-176.9	0	0	0	0	0	114.6	R347	A345-R347 PolarHBondContact O-N 3.06Å
346	D	31.8	Very low	33.6	Very low	163 Å²	163	145 Å²	145	87%	0.872	77%	0.766	S	S	*	*	S	Bend	trans	-96.1	24.9	-169.3	-93.8	-26.6	0	0	0	115.2
347	R	35.4	Very low	34.3	Very low	214 Å²	214	144.1 Å²	144.1	81%	0.808	78%	0.775	S	S	*	*			trans	-134.4	77.4	175.2	-60.9	-162.5	76.5	150.7	4.7	113.1	A345 I349	A345-R347 PolarHBondContact O-N 3.06Å; R347-I349 PolarHBondContact O-N 3.1Å
348	D	28.8	Very low	34.8	Very low	164 Å²	164	145.9 Å²	145.9	88%	0.877	78%	0.778	S	S	*	*			trans	-53.2	95.8	167.1	-70.1	-61.9	0	0	0	112.6
349	I	30.4	Very low	35.4	Very low	135 Å²	135	147 Å²	147	69%	0.692	78%	0.779	S	S	*	*			trans	-132.9	118.9	159.5	-59.7	-176.6	0	0	0	107.3	R347 T351	R347-I349 PolarHBondContact O-N 3.1Å; I349-T351 PolarHBondContact O-N 3.18Å
350	P	29.5	Very low	36.4	Very low	130 Å²	130	138.7 Å²	138.7	84%	0.844	76%	0.756	S	S	*	*			trans	-60.2	129.4	-169	-27.6	35.3	0	0	0	114.9
351	T	28.8	Very low	37.5	Very low	124 Å²	124	135.3 Å²	135.3	76%	0.761	75%	0.748	S	S	*	*			trans	-72.4	121.4	169.7	-46.5	0	0	0	0	110.8	I349 P353	I349-T351 PolarHBondContact O-N 3.18Å; T351-P353 HydrophobicContact CG2-CB 4.32Å
352	D	31.8	Very low	38.4	Very low	144 Å²	144	133.6 Å²	133.6	77%	0.77	74%	0.74	S	S	*	*			trans	-94	108.5	156.2	-175.9	10.4	0	0	0	108.3	N354	D352-N354 PolarHBondContact O-N 2.98Å
353	P	48.8	Very low	39.9	Very low	110 Å²	110	129.5 Å²	129.5	71%	0.714	72%	0.723	S	S	*	*	S	Bend	trans	-87	66.2	-163.8	35.6	-37.3	0	0	0	112.9	T351	T351-P353 HydrophobicContact CG2-CB 4.32Å
354	N	39	Very low	41	Very low	152 Å²	152	126 Å²	126	81%	0.813	70%	0.704	S	S	*	*	S	Bend	trans	-153.9	34.2	167.6	-152.7	14.3	0	0	0	117.8	D352	D352-N354 PolarHBondContact O-N 2.98Å
355	S	34.8	Very low	42.2	Very low	112 Å²	112	124.1 Å²	124.1	78%	0.783	69%	0.694	S	S	*	*			trans	-155.5	37.4	169.5	74.1	0	0	0	0	117.8
356	E	40.8	Very low	43.7	Very low	157 Å²	157	123.1 Å²	123.1	73%	0.734	68%	0.682	S	S	*	*			trans	-118.9	61.5	170.2	-66.4	-133.2	142	0	0	112.9	L358	E356-L358 HydrophobicContact CB-CG 4.35Å; E356-L358 PolarHBondContact O-N 3.39Å; E356-L358 WeakPolarHBondContact OE2-CD1 3.33Å
357	S	46.2	Very low	44.4	Very low	120 Å²	120	124.3 Å²	124.3	84%	0.839	68%	0.675	S	S	*	*			trans	-73.4	67.8	148.1	-53.6	0	0	0	0	108.9	I359	S357-I359 PolarHBondContact O-N 2.88Å
358	L	42.7	Very low	45.2	Very low	129 Å²	129	117.6 Å²	117.6	68%	0.675	65%	0.654	S	S	*	*			trans	-60.6	109.3	165	-72.2	174.2	0	0	0	106.7	E356 S360	E356-L358 HydrophobicContact CB-CG 4.35Å; E356-L358 PolarHBondContact O-N 3.39Å; E356-L358 WeakPolarHBondContact OE2-CD1 3.33Å; L358-S360 PolarHBondContact O-N 3.38Å; L358-S360 VanDerWaalsContact O-N 3.08Å
359	I	44.5	Very low	46.5	Very low	125 Å²	125	117.2 Å²	117.2	64%	0.641	64%	0.644	S	S	*	*			trans	-54	117	178.8	-62.4	172	0	0	0	106.9	S357 D363 I364	S357-I359 PolarHBondContact O-N 2.88Å; I359-D363 HydrophobicContact CG2-CB 3.58Å; I359-I364 HydrophobicContact CG2-CG1 3.94Å
360	S	55	Low	46.9	Very low	58 Å²	58	117.9 Å²	117.9	41%	0.406	64%	0.644	S	S	.	*			trans	-62.6	150.4	-173.4	177.4	0	0	0	0	109.7	L358 H362 D363 I364	L358-S360 PolarHBondContact O-N 3.38Å; L358-S360 VanDerWaalsContact O-N 3.08Å; S360-H362 PolarHBondContact O-N 2.99Å; S360-H362 VanDerWaalsContact O-N 3.09Å; S360-H362 PolarHBondContact OG-N 3.43Å; S360-D363 WeakPolarHBondContact CB-OD2 3.14Å; S360-D363 PolarHBondContact N-OD2 2.92Å; S360-D363 WeakPolarHBondContact O-CA 3.41Å; S360-D363 WeakPolarHBondContact O-CB 3.42Å; S360-D363 PolarHBondContact O-N 3.47Å; S360-I364 PolarHBondContact O-N 3.11Å
361	A	50.3	Low	47.1	Very low	70 Å²	70	119 Å²	119	58%	0.579	64%	0.639	S	S	*	*	H	α-helix	trans	-53.4	-30.8	168.4	0	0	0	0	0	111.1	I364 L365	A361-I364 PolarHBondContact O-N 2.84Å; A361-L365 WeakPolarHBondContact O-CB 3.4Å; A361-L365 WeakPolarHBondContact O-CG 3.45Å; A361-L365 PolarHBondContact O-N 3.42Å
362	H	53.6	Low	47.3	Very low	134 Å²	134	120.1 Å²	120.1	62%	0.62	64%	0.635	S	S	*	*	H	α-helix	trans	-65	-37.4	172.7	-166	-74.7	0	0	0	113.2	S360 S366	S360-H362 PolarHBondContact O-N 2.99Å; S360-H362 VanDerWaalsContact O-N 3.09Å; S360-H362 PolarHBondContact OG-N 3.43Å; H362-S366 PolarHBondContact ND1-OG 3.02Å; H362-S366 VanDerWaalsContact O-CB 3.28Å; H362-S366 WeakPolarHBondContact O-CB 3.43Å; H362-S366 PolarHBondContact O-N 3.46Å; H362-S366 PolarHBondContact O-OG 2.81Å
363	D	64.5	Low	47.2	Very low	86 Å²	86	119.4 Å²	119.4	46%	0.46	63%	0.627	S	S	.	*	H	α-helix	trans	-69.8	-40	175.6	-64	-43.7	0	0	0	111	I359 S360 S366 W367	I359-D363 HydrophobicContact CG2-CB 3.58Å; S360-D363 WeakPolarHBondContact CB-OD2 3.14Å; S360-D363 PolarHBondContact N-OD2 2.92Å; S360-D363 WeakPolarHBondContact O-CA 3.41Å; S360-D363 WeakPolarHBondContact O-CB 3.42Å; S360-D363 PolarHBondContact O-N 3.47Å; D363-S366 PolarHBondContact O-N 2.87Å; D363-W367 WeakPolarHBondContact O-CB 3.48Å; D363-W367 PolarHBondContact O-N 2.73Å
364	I	56.6	Low	46.6	Very low	91 Å²	91	119.3 Å²	119.3	47%	0.467	63%	0.627	S	S	.	*	H	α-helix	trans	-61.3	-48.3	175.9	-60	175.2	0	0	0	110.1	I359 S360 A361 S366 W367 I368	I359-I364 HydrophobicContact CG2-CG1 3.94Å; S360-I364 PolarHBondContact O-N 3.11Å; A361-I364 PolarHBondContact O-N 2.84Å; I364-S366 VanDerWaalsContact C-N 3.34Å; I364-S366 PolarHBondContact O-N 3.46Å; I364-W367 WeakPolarHBondContact O-CB 3.32Å; I364-W367 PolarHBondContact O-N 2.96Å; I364-I368 HydrophobicContact CG2-CD1 3.98Å; I364-I368 WeakPolarHBondContact O-CG1 3.49Å; I364-I368 PolarHBondContact O-N 3.11Å
365	L	60.4	Low	46.2	Very low	114 Å²	114	121.4 Å²	121.4	60%	0.597	62%	0.624	S	S	*	*	H	α-helix	trans	-65.5	-36.3	176.8	-70	172.2	0	0	0	112.3	A361 W367 I368 K369	A361-L365 WeakPolarHBondContact O-CB 3.4Å; A361-L365 WeakPolarHBondContact O-CG 3.45Å; A361-L365 PolarHBondContact O-N 3.42Å; L365-W367 VanDerWaalsContact C-N 3.29Å; L365-W367 PolarHBondContact O-N 3.28Å; L365-I368 PolarHBondContact O-N 3.16Å; L365-K369 VanDerWaalsContact O-CB 3.22Å; L365-K369 WeakPolarHBondContact O-CB 3.33Å; L365-K369 PolarHBondContact O-N 3.09Å
366	S	63.1	Low	46.2	Very low	53 Å²	53	121.7 Å²	121.7	37%	0.371	62%	0.624	S	S	.	*	H	α-helix	trans	-64.2	-35.7	173.9	-60.8	0	0	0	0	111.8	H362 D363 I364 Q370	H362-S366 PolarHBondContact ND1-OG 3.02Å; H362-S366 VanDerWaalsContact O-CB 3.28Å; H362-S366 WeakPolarHBondContact O-CB 3.43Å; H362-S366 PolarHBondContact O-N 3.46Å; H362-S366 PolarHBondContact O-OG 2.81Å; D363-S366 PolarHBondContact O-N 2.87Å; I364-S366 VanDerWaalsContact C-N 3.34Å; I364-S366 PolarHBondContact O-N 3.46Å; S366-Q370 WeakPolarHBondContact O-CB 3.28Å; S366-Q370 PolarHBondContact O-N 3.23Å
367	W	48.4	Very low	45.6	Very low	189 Å²	189	125.5 Å²	125.5	72%	0.716	63%	0.631	S	S	*	*	H	α-helix	trans	-69.5	-47.3	176	-134.9	63.7	0	0	0	112	D363 I364 L365 K369 Q370 E371	D363-W367 WeakPolarHBondContact O-CB 3.48Å; D363-W367 PolarHBondContact O-N 2.73Å; I364-W367 WeakPolarHBondContact O-CB 3.32Å; I364-W367 PolarHBondContact O-N 2.96Å; L365-W367 VanDerWaalsContact C-N 3.29Å; L365-W367 PolarHBondContact O-N 3.28Å; W367-K369 VanDerWaalsContact C-N 3.34Å; W367-K369 PolarHBondContact O-N 3.2Å; W367-Q370 WeakPolarHBondContact O-CB 3.48Å; W367-Q370 PolarHBondContact O-N 3.03Å; W367-Q370 VanDerWaalsContact O-N 3.09Å; W367-E371 PolarHBondContact O-N 3.28Å; W367-E371 VanDerWaalsContact O-N 3.11Å
368	I	50.5	Low	44.6	Very low	73 Å²	73	122.3 Å²	122.3	37%	0.374	62%	0.618	S	S	.	*	H	α-helix	trans	-60.4	-45	176.6	-66.5	165.7	0	0	0	110.4	I364 L365 Q370 E371 E372	I364-I368 HydrophobicContact CG2-CD1 3.98Å; I364-I368 WeakPolarHBondContact O-CG1 3.49Å; I364-I368 PolarHBondContact O-N 3.11Å; L365-I368 PolarHBondContact O-N 3.16Å; I368-Q370 PolarHBondContact O-N 3.1Å; I368-Q370 VanDerWaalsContact O-N 3.16Å; I368-E371 CarbonylContact O-C 3.49Å; I368-E371 WeakPolarHBondContact O-CA 3.4Å; I368-E371 PolarHBondContact O-N 3.02Å; I368-E372 HydrophobicContact CG2-CG 4.31Å; I368-E372 PolarHBondContact O-N 3.12Å
369	K	55.9	Low	44.2	Very low	156 Å²	156	121.9 Å²	121.9	68%	0.678	62%	0.623	S	S	*	*	H	α-helix	trans	-65	-18.7	177.7	-164.7	170.6	-171.6	172.9	0	113.6	L365 W367	L365-K369 VanDerWaalsContact O-CB 3.22Å; L365-K369 WeakPolarHBondContact O-CB 3.33Å; L365-K369 PolarHBondContact O-N 3.09Å; W367-K369 VanDerWaalsContact C-N 3.34Å; W367-K369 PolarHBondContact O-N 3.2Å
370	Q	39.5	Very low	43.6	Very low	148 Å²	148	127.8 Å²	127.8	69%	0.692	64%	0.637	S	S	*	*	H	α-helix	trans	-88.3	-22	172.8	-165.4	165.3	15	0	0	112.6	S366 W367 I368	S366-Q370 WeakPolarHBondContact O-CB 3.28Å; S366-Q370 PolarHBondContact O-N 3.23Å; W367-Q370 WeakPolarHBondContact O-CB 3.48Å; W367-Q370 PolarHBondContact O-N 3.03Å; W367-Q370 VanDerWaalsContact O-N 3.09Å; I368-Q370 PolarHBondContact O-N 3.1Å; I368-Q370 VanDerWaalsContact O-N 3.16Å
371	E	34.6	Very low	42.3	Very low	155 Å²	155	132 Å²	132	72%	0.724	66%	0.655	S	S	*	*	H	α-helix	trans	-84.9	-29.9	172.6	-163.1	164.6	-145.1	0	0	112	W367 I368 Q373	W367-E371 PolarHBondContact O-N 3.28Å; W367-E371 VanDerWaalsContact O-N 3.11Å; I368-E371 CarbonylContact O-C 3.49Å; I368-E371 WeakPolarHBondContact O-CA 3.4Å; I368-E371 PolarHBondContact O-N 3.02Å; E371-Q373 VanDerWaalsContact C-N 3.34Å; E371-Q373 PolarHBondContact O-N 3.06Å
372	E	32.8	Very low	41.2	Very low	146 Å²	146	133.7 Å²	133.7	68%	0.682	66%	0.663	S	S	*	*	S	Bend	trans	-79.7	-3.9	175.8	-74.2	-168.6	143.1	0	0	115.2	I368 P374	I368-E372 HydrophobicContact CG2-CG 4.31Å; I368-E372 PolarHBondContact O-N 3.12Å; E372-P374 WeakPolarHBondContact O-CD 3.45Å; E372-P374 VanDerWaalsContact O-N 3.15Å
373	Q	29.2	Very low	40.1	Very low	129 Å²	129	135.5 Å²	135.5	60%	0.603	67%	0.673	S	S	*	*	S	Bend	trans	-64.7	112.5	171.4	-80.6	-70.1	-2.6	0	0	109.7	E371 Y375	E371-Q373 VanDerWaalsContact C-N 3.34Å; E371-Q373 PolarHBondContact O-N 3.06Å; Q373-Y375 PolarHBondContact O-N 2.78Å
374	P	35.3	Very low	38.4	Very low	109 Å²	109	138.5 Å²	138.5	71%	0.708	69%	0.69	S	S	*	*			trans	-70.3	109.9	-175.1	-15.9	31.7	0	0	0	109.3	E372 P376	E372-P374 WeakPolarHBondContact O-CD 3.45Å; E372-P374 VanDerWaalsContact O-N 3.15Å; P374-P376 WeakPolarHBondContact O-CD 3.46Å; P374-P376 VanDerWaalsContact O-N 3.12Å
375	Y	32	Very low	36.9	Very low	195 Å²	195	137.5 Å²	137.5	77%	0.765	70%	0.702	S	S	*	*			trans	-57	118.5	177.6	-89.7	-91.3	0	0	0	110	Q373 W377	Q373-Y375 PolarHBondContact O-N 2.78Å; Y375-W377 PolarHBondContact O-N 3.24Å
376	P	33.7	Very low	35.2	Very low	118 Å²	118	141 Å²	141	77%	0.766	72%	0.715	S	S	*	*			trans	-77.5	100.8	-165.3	28.8	-35.2	0	0	0	111.7	P374	P374-P376 WeakPolarHBondContact O-CD 3.46Å; P374-P376 VanDerWaalsContact O-N 3.12Å
377	W	28.2	Very low	33.7	Very low	237 Å²	237	146.6 Å²	146.6	90%	0.898	74%	0.74	S	S	*	*			trans	-98	62.8	160.4	-64	96.5	0	0	0	110.1	Y375	Y375-W377 PolarHBondContact O-N 3.24Å
378	G	25.6	Very low	32.4	Very low	54 Å²	54	141 Å²	141	56%	0.557	74%	0.741	S	S	*	*			trans	-72.8	133	154.6	0	0	0	0	0	108.5	R380	G378-R380 PolarHBondContact O-N 2.82Å
379	P	35.2	Very low	31.5	Very low	120 Å²	120	145.9 Å²	145.9	78%	0.779	77%	0.767	S	S	*	*			trans	-54.9	129	169.6	-23.2	34.1	0	0	0	109.5	D381	P379-D381 PolarHBondContact O-N 3.12Å; P379-D381 VanDerWaalsContact O-N 3.07Å
380	R	30.4	Very low	30	Very low	249 Å²	249	145.5 Å²	145.5	94%	0.94	77%	0.772	S	S	*	*			trans	-75.8	98.8	174.2	-69.6	178.7	73.1	-163.8	3.7	108	G378	G378-R380 PolarHBondContact O-N 2.82Å
381	D	28.8	Very low	29.5	Very low	145 Å²	145	143.9 Å²	143.9	78%	0.775	78%	0.777	S	S	*	*			trans	-57.8	140.3	169	-78	-51.7	0	0	0	111.2	P379	P379-D381 PolarHBondContact O-N 3.12Å; P379-D381 VanDerWaalsContact O-N 3.07Å
382	S	27.8	Very low	29.1	Very low	107 Å²	107	140 Å²	140	75%	0.748	78%	0.779	S	S	*	*			trans	33.3	115.9	150.7	-61.5	0	0	0	0	119.6
383	M	29.6	Very low	29.3	Very low	171 Å²	171	139.2 Å²	139.2	84%	0.842	79%	0.787	S	S	*	*				-146.7	110.1	121.8	-107.5	156	126.7	0	0	110.7
384	D	28.4	Very low	29.3	Very low	150 Å²	150	138.7 Å²	138.7	80%	0.802	80%	0.797	S	S	*	*			trans	65.8	132.2	146.7	-46.4	-36.9	0	0	0	121.6
385	G	25.8	Very low	29	Very low	70 Å²	70	140.6 Å²	140.6	72%	0.722	80%	0.802	S	S	*	*			trans	137.8	62.5	143	0	0	0	0	0	118.5	L387	G385-L387 PolarHBondContact O-N 2.97Å
386	E	23.5	Very low	28.8	Very low	187 Å²	187	135.9 Å²	135.9	87%	0.874	80%	0.797	S	S	*	*			trans	18.8	91.2	136.8	-80.7	-93	97.1	0	0	117.5
387	L	31.8	Very low	28.5	Very low	170 Å²	170	137.7 Å²	137.7	89%	0.89	80%	0.799	S	S	*	*			trans	-140.7	91.2	146.3	-79.6	-175	0	0	0	108.9	G385 L389	G385-L387 PolarHBondContact O-N 2.97Å; L387-L389 PolarHBondContact O-N 3.4Å
388	G	22.5	Very low	28.7	Very low	72 Å²	72	133.1 Å²	133.1	74%	0.742	79%	0.792	S	S	*	*			trans	-65.6	123.2	172.7	0	0	0	0	0	111.4
389	L	31.2	Very low	29	Very low	176 Å²	176	139.5 Å²	139.5	92%	0.921	81%	0.809	S	S	*	*			trans	-122.6	108.1	152.7	-74.9	179.1	0	0	0	107.7	L387	L387-L389 PolarHBondContact O-N 3.4Å
390	D	23.8	Very low	28.9	Very low	147 Å²	147	139.8 Å²	139.8	79%	0.786	81%	0.808	S	S	*	*			trans	-78.6	156.3	-178.3	-156.7	-35.1	0	0	0	111
391	S	29.1	Very low	29	Very low	114 Å²	114	137.3 Å²	137.3	80%	0.797	81%	0.805	S	S	*	*			trans	67	115.6	155.7	-67.3	0	0	0	0	120.6
392	G	27.2	Very low	29	Very low	74 Å²	74	137 Å²	137	76%	0.763	80%	0.803	S	S	*	*			trans	146.5	107.2	148.4	0	0	0	0	0	117
393	P	37	Very low	29.4	Very low	130 Å²	130	137.1 Å²	137.1	84%	0.844	80%	0.801	S	S	*	*			trans	-105.8	94.8	178.8	36.4	-28.3	0	0	0	114.1
394	S	27.7	Very low	29.8	Very low	117 Å²	117	134.4 Å²	134.4	82%	0.818	80%	0.796	S	S	*	*			trans	-156	146.3	161.6	-58.6	0	0	0	0	107.2
395	D	29.4	Very low	30.1	Very low	150 Å²	150	133.2 Å²	133.2	80%	0.802	80%	0.797	S	S	*	*			cis	-148.6	-177.8	2.7	-150.8	-33.6	0	0	0	109.3
396	S	27.3	Very low	30.4	Very low	96 Å²	96	134.1 Å²	134.1	67%	0.671	80%	0.798	S	S	*	*			trans	-70.1	177.3	-175	-54.6	0	0	0	0	114.6
397	L	29.3	Very low	31	Very low	155 Å²	155	130.5 Å²	130.5	81%	0.812	79%	0.79	S	S	*	*			trans	79.1	126.9	180	-84	82.7	0	0	0	114.8
398	L	31.8	Very low	31.1	Very low	142 Å²	142	128.4 Å²	128.4	74%	0.743	79%	0.787	S	S	*	*			cis	-139.4	121.4	6.7	-77.4	165.7	0	0	0	111.1
399	M	31.5	Very low	31.5	Very low	188 Å²	188	133.4 Å²	133.4	93%	0.926	79%	0.791	S	S	*	*			trans	-124.4	109.3	150.6	-94.8	-175	171.7	0	0	108.7	K401	M399-K401 PolarHBondContact O-N 3.18Å
400	V	33.7	Very low	31.7	Very low	125 Å²	125	130.5 Å²	130.5	76%	0.758	78%	0.782	S	S	*	*			trans	-71.2	81	177.1	-179.2	0	0	0	0	108.6	N402	V400-N402 PolarHBondContact O-N 3.49Å
401	K	31.7	Very low	32.1	Very low	197 Å²	197	132.1 Å²	132.1	86%	0.857	79%	0.785	S	S	*	*			trans	-77.3	103	171.3	-155.4	166.2	-173.9	173.6	0	106.6	M399	M399-K401 PolarHBondContact O-N 3.18Å
402	N	29.8	Very low	32.3	Very low	140 Å²	140	132.8 Å²	132.8	75%	0.749	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-47.8	128.3	177.8	-84	-71.2	0	0	0	109.5	V400	V400-N402 PolarHBondContact O-N 3.49Å
403	P	36.4	Very low	32.6	Very low	109 Å²	109	137.8 Å²	137.8	71%	0.708	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-62.9	141.7	-178.6	25.8	-33.4	0	0	0	109.7
404	P	38	Very low	32.4	Very low	113 Å²	113	137.7 Å²	137.7	73%	0.734	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-60.2	149.5	174.6	27	-34.1	0	0	0	110.1	A406	P404-A406 PolarHBondContact O-N 3.21Å
405	P	34.6	Very low	32.7	Very low	125 Å²	125	141 Å²	141	81%	0.812	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-59.2	134.2	-176.2	24.6	-34	0	0	0	110.8
406	A	31.7	Very low	32.7	Very low	90 Å²	90	139.2 Å²	139.2	74%	0.744	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-58.5	139.5	178.3	0	0	0	0	0	110.7	P404	P404-A406 PolarHBondContact O-N 3.21Å
407	P	34.7	Very low	32.7	Very low	110 Å²	110	140.7 Å²	140.7	71%	0.714	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-61.2	150.4	178.3	26.1	-34.2	0	0	0	111	Q409	P407-Q409 PolarHBondContact O-N 3.36Å
408	P	34.5	Very low	32.9	Very low	126 Å²	126	142.2 Å²	142.2	82%	0.818	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-61.5	122.6	-171.1	23.8	-33.7	0	0	0	111.8
409	Q	31.6	Very low	32.9	Very low	177 Å²	177	141.3 Å²	141.3	83%	0.827	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-60.3	133.1	169.3	-73.1	-81	-29.5	0	0	109.4	P407 Q411	P407-Q409 PolarHBondContact O-N 3.36Å; Q409-Q411 PolarHBondContact O-N 2.77Å
410	P	34.8	Very low	32.7	Very low	115 Å²	115	141.3 Å²	141.3	75%	0.747	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-58.9	137.9	-179.8	-24.9	34.6	0	0	0	112.3
411	Q	31.6	Very low	32.7	Very low	181 Å²	181	143.7 Å²	143.7	85%	0.846	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-63.9	137.8	175.9	-69.7	-172.3	-30.5	0	0	110.7	Q409 Q413	Q409-Q411 PolarHBondContact O-N 2.77Å; Q411-Q413 PolarHBondContact O-N 2.96Å
412	P	34.9	Very low	32.7	Very low	128 Å²	128	142.6 Å²	142.6	83%	0.831	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-66.9	123.2	-177.1	26.1	-33.4	0	0	0	111
413	Q	32.1	Very low	32.6	Very low	179 Å²	179	140.8 Å²	140.8	84%	0.836	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-69.7	149.9	172	-74	-169.5	-24.4	0	0	111.3	Q411 Q415	Q411-Q413 PolarHBondContact O-N 2.96Å; Q413-Q415 PolarHBondContact O-N 3.4Å
414	P	32.8	Very low	32.2	Very low	129 Å²	129	144 Å²	144	84%	0.838	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-72.1	128.9	-172.9	-13.2	29.1	0	0	0	111.5
415	Q	34.5	Very low	32.1	Very low	186 Å²	186	143.8 Å²	143.8	87%	0.869	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-84.6	140.5	170.2	-69.2	-157.3	-14.1	0	0	111.6	Q413	Q413-Q415 PolarHBondContact O-N 3.4Å
416	P	29	Very low	31.5	Very low	112 Å²	112	145.4 Å²	145.4	73%	0.727	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-74.8	157.5	178.6	31.8	-35.5	0	0	0	112.2
417	P	28.6	Very low	31.6	Very low	128 Å²	128	147.2 Å²	147.2	83%	0.831	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-76.3	138.3	-171.7	30.5	-35.3	0	0	0	113.1
418	Q	33.4	Very low	31.2	Very low	187 Å²	187	150 Å²	150	87%	0.874	81%	0.812	S	S	*	*			trans	-128.7	154.2	165.4	-78.3	-149.2	-20	0	0	111.6
419	P	31.1	Very low	31.1	Very low	122 Å²	122	150 Å²	150	79%	0.792	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-91.9	160.9	-147.1	34.2	-36	0	0	0	115.8	L421	P419-L421 PolarHBondContact O-N 2.9Å
420	Q	26.7	Very low	30.8	Very low	188 Å²	188	149.4 Å²	149.4	88%	0.879	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-56.1	124.4	178.1	-62	-86.3	-70	0	0	112.4
421	L	33.8	Very low	31.3	Very low	175 Å²	175	149 Å²	149	92%	0.916	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-97.1	126.4	163.7	-148.3	83.3	0	0	0	109.7	P419	P419-L421 PolarHBondContact O-N 2.9Å
422	Q	31.7	Very low	31.1	Very low	174 Å²	174	146 Å²	146	81%	0.813	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-82.6	140.9	-176	-74.4	176.4	-18.5	0	0	112.8
423	S	27.3	Very low	30.7	Very low	103 Å²	103	147.1 Å²	147.1	72%	0.72	81%	0.808	S	S	*	*			trans	51.6	129.4	133.4	-51.8	0	0	0	0	121.5
424	Q	28.8	Very low	30.2	Very low	176 Å²	176	143.1 Å²	143.1	82%	0.822	81%	0.805	S	S	*	*			trans	157.6	153.6	133.4	-84.2	-67.4	-45.5	0	0	109.8
425	P	35	Very low	30.1	Very low	108 Å²	108	143.5 Å²	143.5	70%	0.701	81%	0.805	S	S	*	*				-126.3	-173.6	-106.2	42.6	-28.9	0	0	0	115.9
426	Q	22.1	Very low	29.6	Very low	160 Å²	160	139 Å²	139	75%	0.748	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-62.1	148.3	-177.7	-62.7	-174.9	-33.2	0	0	115
427	P	33.6	Very low	29.5	Very low	127 Å²	127	142.8 Å²	142.8	83%	0.825	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-83.9	128.2	149.3	32.3	-26.6	0	0	0	110.7
428	Q	26.7	Very low	29.4	Very low	170 Å²	170	143.7 Å²	143.7	79%	0.794	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-97.3	140.7	164.7	-68.1	-168	-3.3	0	0	110.5
429	S	32.9	Very low	29.5	Very low	126 Å²	126	140.3 Å²	140.3	88%	0.881	80%	0.799	S	S	*	*			trans	-152.2	153.1	156.3	53.6	0	0	0	0	110.7
430	L	25.7	Very low	29.2	Very low	163 Å²	163	138.2 Å²	138.2	85%	0.853	80%	0.8	S	S	*	*			trans	-105.9	164.5	-154.8	-79.6	159.2	0	0	0	113.9
431	P	45.6	Very low	29.2	Very low	106 Å²	106	133 Å²	133	69%	0.688	80%	0.796	S	S	*	*			trans	-82.5	168.7	176.5	38.3	-37.9	0	0	0	111.8
432	P	26.8	Very low	29	Very low	120 Å²	120	130.4 Å²	130.4	78%	0.779	79%	0.79	S	S	*	*				-137.9	-168.1	95	33.1	-13.4	0	0	0	110.6
433	I	27.1	Very low	29.4	Very low	151 Å²	151	127.6 Å²	127.6	77%	0.774	79%	0.787	S	S	*	*			cis	-138.6	150.6	13.3	-58.4	165.1	0	0	0	108.8	V435	I433-V435 HydrophobicContact CG2-CG2 4.47Å
434	A	21.6	Very low	29.7	Very low	95 Å²	95	129 Å²	129	79%	0.785	80%	0.797	S	S	*	*			trans	-99.9	138.8	163.8	0	0	0	0	0	110.7
435	V	30	Very low	29.6	Very low	137 Å²	137	132.6 Å²	132.6	83%	0.83	80%	0.803	S	S	*	*			trans	-122.2	121	166.5	-179.9	0	0	0	0	108	I433	I433-V435 HydrophobicContact CG2-CG2 4.47Å
436	A	23.9	Very low	29.3	Very low	90 Å²	90	130.8 Å²	130.8	74%	0.744	80%	0.803	S	S	*	*			trans	-122.5	132.2	172.3	0	0	0	0	0	107.8
437	E	27.4	Very low	29.5	Very low	192 Å²	192	130.6 Å²	130.6	90%	0.897	81%	0.807	S	S	*	*			trans	-159.5	113.7	159.6	-113	164	171.7	0	0	111
438	N	27.1	Very low	29.1	Very low	148 Å²	148	132.1 Å²	132.1	79%	0.791	81%	0.807	S	S	*	*			trans	-80.1	173.4	146.8	-130	-97.2	0	0	0	106.3
439	P	34.7	Very low	29.1	Very low	116 Å²	116	131.6 Å²	131.6	75%	0.753	81%	0.81	S	S	*	*			cis	-148.3	175.9	17	40.1	-18.8	0	0	0	118.7
440	G	23.7	Very low	28.7	Very low	77 Å²	77	132.6 Å²	132.6	79%	0.794	81%	0.805	S	S	*	*			trans	87.7	126.3	131.5	0	0	0	0	0	120.2
441	G	27.3	Very low	28.7	Very low	78 Å²	78	127.8 Å²	127.8	80%	0.804	80%	0.795	S	S	*	*			trans	164	102.7	166	0	0	0	0	0	114.8
442	P	30.2	Very low	27.6	Very low	121 Å²	121	131.8 Å²	131.8	79%	0.786	80%	0.802	S	S	*	*			trans	-108.2	-165.5	177.7	43.1	-33.6	0	0	0	111.6
443	P	40	Very low	27.6	Very low	115 Å²	115	135.6 Å²	135.6	75%	0.747	81%	0.809	S	S	*	*				-125.1	151	-80.6	37.6	-22.7	0	0	0	113.4
444	S	34.4	Very low	27.4	Very low	133 Å²	133	133.3 Å²	133.3	93%	0.93	80%	0.802	S	S	*	*			trans	-109.3	105.4	173.7	-66	0	0	0	0	112.4
445	R	26.1	Very low	27.5	Very low	252 Å²	252	136.3 Å²	136.3	95%	0.951	80%	0.804	S	S	*	*			trans	-105.9	111	161.6	-72.2	175.9	81.7	165.4	3.7	108.9
446	G	28.4	Very low	27.8	Very low	69 Å²	69	135.8 Å²	135.8	71%	0.711	80%	0.804	S	S	*	*			trans	-155.8	101.9	165.4	0	0	0	0	0	105.7
447	L	26.4	Very low	27.8	Very low	157 Å²	157	134.9 Å²	134.9	82%	0.822	80%	0.803	S	S	*	*				69.6	94.6	74.2	-159.9	83.5	0	0	0	111.8
448	L	25	Very low	27.8	Very low	158 Å²	158	135.1 Å²	135.1	83%	0.827	80%	0.804	S	S	*	*			trans	35.7	110.6	139.8	-45.4	173.9	0	0	0	117.4
449	D	27.2	Very low	27.7	Very low	159 Å²	159	139 Å²	139	85%	0.85	81%	0.807	S	S	*	*			trans	-140.8	142	142.6	-166.8	-137.6	0	0	0	110.8
450	D	23.9	Very low	27.4	Very low	148 Å²	148	137.2 Å²	137.2	79%	0.791	81%	0.81	S	S	*	*			trans	-99.3	108.3	-178.8	-171.4	-87.4	0	0	0	108.2
451	G	26.5	Very low	27.5	Very low	62 Å²	62	139.1 Å²	139.1	64%	0.639	81%	0.811	S	S	*	*			trans	-138.4	73.2	-162.8	0	0	0	0	0	113.5	Q453	G451-Q453 PolarHBondContact O-N 3.3Å; G451-Q453 VanDerWaalsContact O-N 3.12Å
452	F	21.1	Very low	27.5	Very low	190 Å²	190	138.7 Å²	138.7	83%	0.833	81%	0.807	S	S	*	*			trans	-55.2	113.8	164.2	-109.4	-99.3	0	0	0	110.1	V454	F452-V454 HydrophobicContact CD1-CG2 3.98Å; F452-V454 HydrophobicContact CE1-CG2 4.46Å
453	Q	28.4	Very low	27.2	Very low	199 Å²	199	142.2 Å²	142.2	93%	0.93	81%	0.813	S	S	*	*			trans	-125.8	136.2	157.1	-74.2	-155.2	74	0	0	110.8	G451	G451-Q453 PolarHBondContact O-N 3.3Å; G451-Q453 VanDerWaalsContact O-N 3.12Å
454	V	22.1	Very low	26.5	Very low	104 Å²	104	141 Å²	141	63%	0.63	81%	0.813	S	S	*	*			trans	-131.5	139.6	-163.5	155.9	0	0	0	0	107.5	F452	F452-V454 HydrophobicContact CD1-CG2 3.98Å; F452-V454 HydrophobicContact CE1-CG2 4.46Å
455	L	24.6	Very low	26.4	Very low	157 Å²	157	140.4 Å²	140.4	82%	0.822	81%	0.806	S	S	*	*			trans	71.6	162.4	174.4	-67.5	165.6	0	0	0	116.8
456	P	35.3	Very low	26.7	Very low	127 Å²	127	134.8 Å²	134.8	83%	0.825	80%	0.802	S	S	*	*			cis	-110.1	168.6	-2	13.3	10.7	0	0	0	113.8
457	G	23.6	Very low	26.7	Very low	70 Å²	70	135.2 Å²	135.2	72%	0.722	81%	0.807	S	S	*	*			trans	-95.3	-178.3	-178.5	0	0	0	0	0	114.1
458	E	28.2	Very low	26.7	Very low	198 Å²	198	131.4 Å²	131.4	93%	0.925	81%	0.805	S	S	*	*			trans	-128.7	153	167.3	-84.5	-108.4	72.2	0	0	110.5
459	R	23.8	Very low	26.9	Very low	228 Å²	228	130.9 Å²	130.9	86%	0.86	80%	0.803	S	S	*	*			trans	-88.6	112	-167.2	176.7	-171	-71.9	-161.2	-4.4	110.6
460	G	29.3	Very low	27	Very low	79 Å²	79	134.2 Å²	134.2	81%	0.814	80%	0.804	S	S	*	*			trans	-118.3	70.6	178.1	0	0	0	0	0	113.4	G462	G460-G462 PolarHBondContact O-N 3.47Å
461	S	24.9	Very low	27.4	Very low	117 Å²	117	132.6 Å²	132.6	82%	0.818	80%	0.804	S	S	*	*			trans	-71.2	106	169.4	-54.7	0	0	0	0	109.4
462	G	28.7	Very low	27.7	Very low	70 Å²	70	135.9 Å²	135.9	72%	0.722	81%	0.812	S	S	*	*			trans	-125.6	118.2	173.9	0	0	0	0	0	109.9	G460	G460-G462 PolarHBondContact O-N 3.47Å
463	E	24	Very low	28	Very low	194 Å²	194	131 Å²	131	91%	0.907	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-67.2	144.2	-171.6	-73.7	156.5	85.9	0	0	113.5
464	A	23.9	Very low	28	Very low	90 Å²	90	125.2 Å²	125.2	74%	0.744	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-80.6	136.1	169.4	0	0	0	0	0	110.6
465	P	32.6	Very low	28.3	Very low	120 Å²	120	123.9 Å²	123.9	78%	0.779	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-77.9	132.2	158.9	31.5	-30.2	0	0	0	109.6
466	P	33.1	Very low	28.3	Very low	135 Å²	135	120.1 Å²	120.1	88%	0.877	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-78.4	129.5	174.9	31.3	-32.5	0	0	0	110.3
467	G	27.9	Very low	28.1	Very low	78 Å²	78	116.8 Å²	116.8	80%	0.804	80%	0.804	S	S	*	*			trans	-147.7	83.3	-170.4	0	0	0	0	0	115.2
468	G	27.7	Very low	28.5	Very low	76 Å²	76	119.3 Å²	119.3	78%	0.784	80%	0.801	S	S	*	*			trans	64.4	95.5	143.9	0	0	0	0	0	118.4	R470	G468-R470 PolarHBondContact O-N 2.98Å
469	D	27.3	Very low	28.6	Very low	148 Å²	148	113 Å²	113	79%	0.791	79%	0.79	S	S	*	*			trans	-57.1	114.9	161.2	-157.6	-51.6	0	0	0	110.9
470	R	30.3	Very low	28.8	Very low	228 Å²	228	106.4 Å²	106.4	86%	0.86	79%	0.792	S	S	*	*			trans	-139	87.6	161.9	-84.5	-162.8	168.8	-176.4	-3.5	110.4	G468 T472	G468-R470 PolarHBondContact O-N 2.98Å; R470-T472 PolarHBondContact O-N 3.33Å
471	S	32.2	Very low	28.8	Very low	114 Å²	114	105.7 Å²	105.7	80%	0.797	79%	0.785	S	S	*	*			trans	-49.3	107.3	160.5	-71.3	0	0	0	0	111.8
472	T	33.4	Very low	28.9	Very low	132 Å²	132	104 Å²	104	81%	0.81	79%	0.786	S	S	*	*			trans	-124	112.3	163	25.3	0	0	0	0	109.6	R470 G474	R470-T472 PolarHBondContact O-N 3.33Å; T472-G474 PolarHBondContact O-N 3.44Å
473	G	26.9	Very low	28.7	Very low	86 Å²	86	104.2 Å²	104.2	89%	0.887	79%	0.788	S	S	*	*			trans	-68.1	99.2	-178.2	0	0	0	0	0	112.2	G475	G473-G475 PolarHBondContact O-N 2.83Å
474	G	29.4	Very low	28.8	Very low	79 Å²	79	98.5 Å²	98.5	81%	0.814	78%	0.781	S	S	*	*			trans	-66.1	94.8	172.3	0	0	0	0	0	111.9	T472 G476	T472-G474 PolarHBondContact O-N 3.44Å; G474-G476 PolarHBondContact O-N 3.33Å; G474-G476 VanDerWaalsContact O-N 3.12Å
475	G	27.4	Very low	28.9	Very low	76 Å²	76	97.7 Å²	97.7	78%	0.784	78%	0.782	S	S	*	*			trans	-59	111.8	178.4	0	0	0	0	0	112.5	G473 G477	G473-G475 PolarHBondContact O-N 2.83Å; G475-G477 VanDerWaalsContact C-N 3.29Å; G475-G477 PolarHBondContact O-N 3.05Å
476	G	25.3	Very low	28.9	Very low	77 Å²	77	97 Å²	97	79%	0.794	79%	0.786	S	S	*	*			trans	-70.9	72.4	-178.7	0	0	0	0	0	114.2	G474 D478	G474-G476 PolarHBondContact O-N 3.33Å; G474-G476 VanDerWaalsContact O-N 3.12Å; G476-D478 PolarHBondContact O-N 2.82Å
477	G	30.8	Very low	28.8	Very low	58 Å²	58	99.7 Å²	99.7	60%	0.598	79%	0.787	S	S	*	*			trans	-83.2	82.3	169.8	0	0	0	0	0	111.8	G475 G479	G475-G477 VanDerWaalsContact C-N 3.29Å; G475-G477 PolarHBondContact O-N 3.05Å; G477-G479 PolarHBondContact O-N 2.89Å
478	D	30.9	Very low	28.9	Very low	122 Å²	122	100.7 Å²	100.7	65%	0.652	79%	0.788	S	S	*	*			trans	-52.7	93.3	173.6	-96	-78.8	0	0	0	110.5	G476 G480 K642	G476-D478 PolarHBondContact O-N 2.82Å; D478-G480 PolarHBondContact O-N 3.47Å; D478-K642 IonicContact OD1-NZ 3.89Å
479	G	31.3	Very low	29	Very low	67 Å²	67	100.3 Å²	100.3	69%	0.691	78%	0.784	S	S	*	*			trans	-65.1	120.3	172.2	0	0	0	0	0	109.4	G477 G481	G477-G479 PolarHBondContact O-N 2.89Å; G479-G481 PolarHBondContact O-N 3.11Å
480	G	28.3	Very low	29.1	Very low	88 Å²	88	100.6 Å²	100.6	91%	0.907	79%	0.791	S	S	*	*			trans	-68.9	51.5	-179.6	0	0	0	0	0	114.9	D478 G482	D478-G480 PolarHBondContact O-N 3.47Å; G480-G482 PolarHBondContact O-N 2.68Å
481	G	27.9	Very low	29	Very low	64 Å²	64	92.6 Å²	92.6	66%	0.66	78%	0.78	S	S	*	*			trans	-76.7	91.7	164.4	0	0	0	0	0	109.4	G479 G483	G479-G481 PolarHBondContact O-N 3.11Å; G481-G483 PolarHBondContact O-N 2.98Å
482	G	27.2	Very low	29.2	Very low	81 Å²	81	92.9 Å²	92.9	84%	0.835	79%	0.789	S	S	*	*			trans	-70.8	58.9	174.4	0	0	0	0	0	113.2	G480 G484	G480-G482 PolarHBondContact O-N 2.68Å; G482-G484 VanDerWaalsContact C-N 3.26Å; G482-G484 PolarHBondContact O-N 2.85Å
483	G	25	Very low	29.2	Very low	76 Å²	76	90.3 Å²	90.3	78%	0.784	79%	0.789	S	S	*	*			trans	-73.1	81.4	165.3	0	0	0	0	0	109.6	G481 G485	G481-G483 PolarHBondContact O-N 2.98Å; G483-G485 PolarHBondContact O-N 3.25Å
484	G	26.4	Very low	29.4	Very low	73 Å²	73	89.9 Å²	89.9	75%	0.753	79%	0.785	S	S	*	*			trans	-65.9	126.3	165.9	0	0	0	0	0	108.9	G482 A486	G482-G484 VanDerWaalsContact C-N 3.26Å; G482-G484 PolarHBondContact O-N 2.85Å; G484-A486 PolarHBondContact O-N 3.32Å
485	G	26.6	Very low	29.8	Very low	74 Å²	74	89.6 Å²	89.6	76%	0.763	78%	0.782	S	S	*	*			trans	-55.7	135.8	-177.7	0	0	0	0	0	111.9	G483 E487	G483-G485 PolarHBondContact O-N 3.25Å; G485-E487 PolarHBondContact O-N 3.31Å; G485-E487 VanDerWaalsContact O-N 3.14Å
486	A	31	Very low	30.3	Very low	105 Å²	105	90.5 Å²	90.5	87%	0.868	77%	0.774	S	S	*	*			trans	-78.3	91.1	170.6	0	0	0	0	0	108.8	G484 A488	G484-A486 PolarHBondContact O-N 3.32Å; A486-A488 PolarHBondContact O-N 2.76Å
487	E	31.3	Very low	31	Very low	191 Å²	191	89.6 Å²	89.6	89%	0.893	77%	0.765	S	S	*	*			trans	-69.9	122	157.9	-69.3	-173.7	125.7	0	0	107.6	G485 G489	G485-E487 PolarHBondContact O-N 3.31Å; G485-E487 VanDerWaalsContact O-N 3.14Å; E487-G489 PolarHBondContact O-N 3.16Å
488	A	29.9	Very low	31.7	Very low	100 Å²	100	91.2 Å²	91.2	83%	0.826	77%	0.768	S	S	*	*			trans	-75.7	64.8	-174.2	0	0	0	0	0	111.7	A486 T490	A486-A488 PolarHBondContact O-N 2.76Å; A488-T490 PolarHBondContact O-N 3.3Å
489	G	31.4	Very low	32.1	Very low	68 Å²	68	90 Å²	90	70%	0.701	77%	0.767	S	S	*	*			trans	-74.4	103.4	168.6	0	0	0	0	0	110.3	E487 G491	E487-G489 PolarHBondContact O-N 3.16Å; G489-G491 PolarHBondContact O-N 3.46Å
490	T	28.1	Very low	32.1	Very low	154 Å²	154	91.5 Å²	91.5	95%	0.945	77%	0.766	S	S	*	*			trans	-68.2	73.9	174.9	36	0	0	0	0	111.8	A488	A488-T490 PolarHBondContact O-N 3.3Å
491	G	29.3	Very low	32.9	Very low	60 Å²	60	91.8 Å²	91.8	62%	0.619	75%	0.752	S	S	*	*			trans	-124.3	90.9	176	0	0	0	0	0	111.5	G489 G493	G489-G491 PolarHBondContact O-N 3.46Å; G491-G493 VanDerWaalsContact C-N 3.31Å; G491-G493 PolarHBondContact O-N 2.64Å
492	A	34.9	Very low	33.2	Very low	120 Å²	120	91.9 Å²	91.9	99%	0.992	75%	0.753	S	S	*	*	S	Bend	trans	-69.1	83.9	174.6	0	0	0	0	0	110.8
493	G	33.4	Very low	33.4	Very low	78 Å²	78	91.1 Å²	91.1	80%	0.804	75%	0.745	S	S	*	*			trans	166.2	28.2	-176.7	0	0	0	0	0	115.9	G491 G495	G491-G493 VanDerWaalsContact C-N 3.31Å; G491-G493 PolarHBondContact O-N 2.64Å; G493-G495 PolarHBondContact O-N 3.17Å
494	G	32.7	Very low	34.1	Very low	77 Å²	77	94.8 Å²	94.8	79%	0.794	75%	0.746	S	S	*	*			trans	-86.9	82.1	-173.4	0	0	0	0	0	115
495	G	35.9	Very low	35	Very low	73 Å²	73	102.8 Å²	102.8	75%	0.753	75%	0.753	S	S	*	*			trans	-58.1	137	170.7	0	0	0	0	0	112.7	G493 G497	G493-G495 PolarHBondContact O-N 3.17Å; G495-G497 PolarHBondContact O-N 3.48Å
496	C	39.9	Very low	35.7	Very low	94 Å²	94	110.1 Å²	110.1	64%	0.635	76%	0.758	S	S	*	*			trans	-70.9	88.5	-171.1	53.7	0	0	0	0	113.7	S498 C499	C496-S498 PolarHBondContact O-N 2.97Å; C496-C499 PolarHBondContact O-N 3.34Å
497	G	39.4	Very low	36.2	Very low	58 Å²	58	108.8 Å²	108.8	60%	0.598	74%	0.743	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.7	15.3	179.1	0	0	0	0	0	117.1	G495 K614	G495-G497 PolarHBondContact O-N 3.48Å; G497-K614 PolarHBondContact O-NZ 2.78Å
498	S	45.1	Very low	37	Very low	93 Å²	93	107.9 Å²	107.9	65%	0.65	74%	0.743	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.3	-32	168.6	51.7	0	0	0	0	112.8	C496	C496-S498 PolarHBondContact O-N 2.97Å
499	C	38.9	Very low	37.8	Very low	95 Å²	95	110.7 Å²	110.7	64%	0.642	74%	0.743	S	S	*	*	S	Bend	trans	-88.5	-25.8	-164.5	-63.6	0	0	0	0	116.4	C496	C496-C499 PolarHBondContact O-N 3.34Å
500	C	31.4	Very low	38.4	Very low	99 Å²	99	112.5 Å²	112.5	67%	0.669	74%	0.736	S	S	*	*			trans	-130.4	102.1	-174.4	-59.9	0	0	0	0	112.7	G502	C500-G502 PolarHBondContact O-N 3.41Å
501	P	45.3	Very low	39.2	Very low	94 Å²	94	112.1 Å²	112.1	61%	0.61	72%	0.724	S	S	*	*	S	Bend	trans	-86.7	87	162.7	33.6	-27.4	0	0	0	109.6	F602	P501-F602 HydrophobicContact CB-CD1 4.48Å; P501-F602 HydrophobicContact CB-CE1 4.1Å; P501-F602 HydrophobicContact CG-CE1 4.18Å
502	G	33.3	Very low	39.7	Very low	66 Å²	66	112.3 Å²	112.3	68%	0.68	73%	0.725	S	S	*	*	S	Bend	trans	153	-17.5	172.5	0	0	0	0	0	117.5	C500 L504	C500-G502 PolarHBondContact O-N 3.41Å; G502-L504 PolarHBondContact O-N 2.96Å; G502-L504 VanDerWaalsContact O-N 3.09Å
503	G	33.2	Very low	40.2	Very low	65 Å²	65	110.9 Å²	110.9	67%	0.67	71%	0.714	S	S	*	*			trans	-80.9	86.2	-175.4	0	0	0	0	0	114.3
504	L	39.5	Very low	41.2	Very low	154 Å²	154	117.4 Å²	117.4	81%	0.806	71%	0.714	S	S	*	*			trans	-71.5	130.7	165.4	-91.8	79.2	0	0	0	111	G502 R506	G502-L504 PolarHBondContact O-N 2.96Å; G502-L504 VanDerWaalsContact O-N 3.09Å; L504-R506 PolarHBondContact O-N 3.33Å
505	R	45.1	Very low	42.6	Very low	240 Å²	240	118.1 Å²	118.1	91%	0.906	71%	0.707	S	S	*	*	S	Bend	trans	36.5	75.6	150.7	-64.7	-176.4	174.7	-107.1	2	117.9
506	R	41.1	Very low	44.4	Very low	229 Å²	229	119.4 Å²	119.4	86%	0.864	69%	0.692	S	S	*	*			trans	-159.7	-8.9	142.3	-122.1	174.8	178.2	-123.6	-0.7	116.1	L504 L508	L504-R506 PolarHBondContact O-N 3.33Å; R506-L508 PolarHBondContact O-N 3.49Å
507	S	41	Very low	46.3	Very low	77 Å²	77	118.9 Å²	118.9	54%	0.538	69%	0.687	S	S	.	*	T	Hydrogen-bonded Turn	trans	-68.4	18.7	-175	-56.3	0	0	0	0	117.7	H511	S507-H511 PolarHBondContact OG-NE2 2.43Å; S507-H511 VanDerWaalsContact OG-NE2 3.09Å
508	L	48.6	Very low	48.4	Very low	171 Å²	171	119.8 Å²	119.8	90%	0.895	67%	0.673	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.3	-18.1	-180	-138.1	81.7	0	0	0	113.6	R506	R506-L508 PolarHBondContact O-N 3.49Å
509	L	46.8	Very low	50.4	Low	159 Å²	159	118.9 Å²	118.9	83%	0.832	67%	0.667	S	S	*	*	S	Bend	trans	-122.2	-17.6	-169.9	-75.4	170	0	0	0	116.4
510	L	44.1	Very low	52.7	Low	107 Å²	107	114.4 Å²	114.4	56%	0.56	64%	0.637	S	S	*	*			trans	-150.7	65.1	-178.4	-141.7	71.6	0	0	0	114.8	E130	E130-L510 HydrophobicContact CG-CD2 4.07Å
511	H	43.4	Very low	55.3	Low	146 Å²	146	115.1 Å²	115.1	68%	0.676	64%	0.64	S	S	*	*			trans	-110.3	102.1	148.1	-79.3	-42	0	0	0	108.2	S507 A513	S507-H511 PolarHBondContact OG-NE2 2.43Å; S507-H511 VanDerWaalsContact OG-NE2 3.09Å; H511-A513 PolarHBondContact O-N 2.79Å
512	G	40.6	Very low	57.1	Low	63 Å²	63	115.9 Å²	115.9	65%	0.649	64%	0.635	S	S	*	*			trans	-42.5	124.7	169.8	0	0	0	0	0	109.6	R514	G512-R514 PolarHBondContact O-N 2.58Å
513	A	46.2	Very low	59.7	Low	91 Å²	91	114.9 Å²	114.9	75%	0.752	62%	0.618	S	S	*	*			trans	-65.8	103.8	-169.2	0	0	0	0	0	108.9	H511 S515	H511-A513 PolarHBondContact O-N 2.79Å; A513-S515 PolarHBondContact O-N 3.14Å
514	R	53.6	Low	62.2	Low	214 Å²	214	114.6 Å²	114.6	81%	0.808	61%	0.614	S	S	*	*			trans	-52.5	98.8	151.1	-73.3	-171.5	-177	-139.3	0.3	105.4	G512 K516	G512-R514 PolarHBondContact O-N 2.58Å; R514-K516 VanDerWaalsContact O-CD 3.27Å; R514-K516 WeakPolarHBondContact O-CD 3.32Å; R514-K516 VanDerWaalsContact O-CE 3.28Å; R514-K516 WeakPolarHBondContact O-CE 3.38Å; R514-K516 WeakPolarHBondContact O-CG 3.37Å; R514-K516 PolarHBondContact O-N 3.31Å; R514-K516 VanDerWaalsContact O-N 3.11Å
515	S	61.3	Low	64.4	Low	93 Å²	93	112.9 Å²	112.9	65%	0.65	60%	0.6	S	S	*	*			trans	-60.6	121.7	-171.6	58	0	0	0	0	106.8	A513 P517	A513-S515 PolarHBondContact O-N 3.14Å; S515-P517 WeakPolarHBondContact O-CD 3.48Å
516	K	74.5	Confident	66.3	Low	100 Å²	100	104.3 Å²	104.3	44%	0.435	58%	0.577	S	S	.	*			trans	-114.1	69.2	176.5	-66	133.4	-172	166.9	0	105.9	R514 Y518 S526 F527	R514-K516 VanDerWaalsContact O-CD 3.27Å; R514-K516 WeakPolarHBondContact O-CD 3.32Å; R514-K516 VanDerWaalsContact O-CE 3.28Å; R514-K516 WeakPolarHBondContact O-CE 3.38Å; R514-K516 WeakPolarHBondContact O-CG 3.37Å; R514-K516 PolarHBondContact O-N 3.31Å; R514-K516 VanDerWaalsContact O-N 3.11Å; K516-Y518 PolarHBondContact O-N 2.86Å; K516-S526 WeakPolarHBondContact CB-OG 3.32Å; K516-F527 CarbonylContact C-O 3.5Å; K516-F527 VanDerWaalsContact C-O 3.29Å; K516-F527 VanDerWaalsContact CA-O 3.27Å; K516-F527 WeakPolarHBondContact CA-O 3.46Å
517	P	80.4	Confident	68.5	Low	83 Å²	83	95.6 Å²	95.6	54%	0.539	55%	0.546	S	S	.	.			trans	-64.3	-16	-168.9	27.3	-35.9	0	0	0	112.5	S515	S515-P517 WeakPolarHBondContact O-CD 3.48Å
518	Y	83.4	Confident	70.7	Confident	76 Å²	76	94.2 Å²	94.2	30%	0.298	54%	0.543	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	88.6	-179	-53.7	-65.9	0	0	0	110.7	K516 S526 F527 R530	K516-Y518 PolarHBondContact O-N 2.86Å; Y518-S526 WeakPolarHBondContact O-CA 3.28Å; Y518-F527 PolarHBondContact N-O 3.27Å; Y518-F527 PolarHBondContact O-N 3.29Å; Y518-R530 HydrophobicContact CD1-CB 4.01Å; Y518-R530 HydrophobicContact CD1-CG 4.05Å; Y518-R530 HydrophobicContact CD2-CB 4.22Å; Y518-R530 HydrophobicContact CE1-CB 3.79Å; Y518-R530 HydrophobicContact CE1-CG 3.97Å; Y518-R530 HydrophobicContact CE2-CB 3.98Å; Y518-R530 HydrophobicContact CG-CB 4.22Å
519	S	87.8	Confident	72.5	Confident	74 Å²	74	90 Å²	90	52%	0.517	52%	0.524	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	144	172.1	52.5	0	0	0	0	112.4
520	C	87.3	Confident	74.5	Confident	2 Å²	2	90 Å²	90	1%	0.014	51%	0.513	C	S	.	.			trans	-85.3	125.1	170.8	177	0	0	0	0	110.2	E522 G524 K525 L533 H536 H540	C520-E522 VanDerWaalsContact C-N 3.35Å; C520-E522 PolarHBondContact O-N 2.76Å; C520-G524 VanDerWaalsContact O-CA 3.29Å; C520-G524 WeakPolarHBondContact O-CA 3.27Å; C520-G524 PolarHBondContact O-N 3.41Å; C520-K525 WeakPolarHBondContact CB-O 3.36Å; C520-K525 PolarHBondContact N-O 3.34Å; C520-L533 HydrophobicContact CB-CD1 3.71Å; C520-H536 PolarHBondContact SG-NE2 3.49Å; C520-H540 PolarHBondContact SG-NE2 3.42Å
521	P	84.9	Confident	76.6	Confident	114 Å²	114	92.6 Å²	92.6	74%	0.74	52%	0.52	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.3	-34.3	-180	26.7	-33.7	0	0	0	112.6	C523	P521-C523 PolarHBondContact O-N 3.49Å
522	E	82.5	Confident	78.8	Confident	109 Å²	109	88.2 Å²	88.2	51%	0.509	51%	0.506	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.2	-22.6	-174.4	-64.8	-176.9	-120.4	0	0	114.6	C520 H537 H540	C520-E522 VanDerWaalsContact C-N 3.35Å; C520-E522 PolarHBondContact O-N 2.76Å; E522-H537 IonicContact OE1-CE1 3.42Å; E522-H537 IonicContact OE1-ND1 3.76Å; E522-H540 WeakPolarHBondContact OE1-CB 3.47Å; E522-H540 IonicContact OE1-CG 2.66Å; E522-H540 WeakPolarHBondContact OE2-CB 3.42Å; E522-H540 IonicContact OE2-CG 2.92Å; E522-H540 IonicContact OE2-ND1 3.77Å
523	C	88.2	Confident	81.1	Confident	46 Å²	46	86.6 Å²	86.6	31%	0.311	48%	0.482	S	S	.	.	T	Hydrogen-bonded Turn	trans	-145.2	10.8	-178.6	71.5	0	0	0	0	115.8	P521 K525 H536 H540	P521-C523 PolarHBondContact O-N 3.49Å; C523-K525 PolarHBondContact O-N 2.99Å; C523-K525 VanDerWaalsContact SG-CD 3.59Å; C523-H536 PolarHBondContact SG-NE2 3.44Å; C523-H540 WeakPolarHBondContact CB-CE1 3.18Å; C523-H540 PolarHBondContact SG-CE1 3.29Å; C523-H540 PolarHBondContact SG-NE2 2.95Å
524	G	85.6	Confident	83.1	Confident	58 Å²	58	86 Å²	86	60%	0.598	47%	0.466	S	S	*	.			trans	68.1	-3.3	176.1	0	0	0	0	0	116.3	C520 S526	C520-G524 VanDerWaalsContact O-CA 3.29Å; C520-G524 WeakPolarHBondContact O-CA 3.27Å; C520-G524 PolarHBondContact O-N 3.41Å; G524-S526 PolarHBondContact O-N 3.17Å
525	K	86.1	Confident	84.8	Confident	119 Å²	119	78.7 Å²	78.7	52%	0.517	44%	0.442	S	S	.	.			trans	-65.4	130.2	-179.6	-68.5	173.8	-167.7	161.3	0	110.7	C520 C523 F527	C520-K525 WeakPolarHBondContact CB-O 3.36Å; C520-K525 PolarHBondContact N-O 3.34Å; C523-K525 PolarHBondContact O-N 2.99Å; C523-K525 VanDerWaalsContact SG-CD 3.59Å; K525-F527 HydrophobicContact CB-CE2 3.87Å; K525-F527 HydrophobicContact CB-CZ 3.97Å; K525-F527 WeakPolarHBondContact O-CE2 3.46Å
526	S	85.7	Confident	86.1	Confident	59 Å²	59	75.3 Å²	75.3	41%	0.413	42%	0.416	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	139.7	-177.7	60	0	0	0	0	112.8	K516 Y518 G524	K516-S526 WeakPolarHBondContact CB-OG 3.32Å; Y518-S526 WeakPolarHBondContact O-CA 3.28Å; G524-S526 PolarHBondContact O-N 3.17Å
527	F	86.2	Confident	86.7	Confident	47 Å²	47	74.3 Å²	74.3	21%	0.206	41%	0.412	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	145.4	-173.9	-56.9	-90.4	0	0	0	110.9	K516 Y518 K525 V529 L533 H536	K516-F527 CarbonylContact C-O 3.5Å; K516-F527 VanDerWaalsContact C-O 3.29Å; K516-F527 VanDerWaalsContact CA-O 3.27Å; K516-F527 WeakPolarHBondContact CA-O 3.46Å; Y518-F527 PolarHBondContact N-O 3.27Å; Y518-F527 PolarHBondContact O-N 3.29Å; K525-F527 HydrophobicContact CB-CE2 3.87Å; K525-F527 HydrophobicContact CB-CZ 3.97Å; K525-F527 WeakPolarHBondContact O-CE2 3.46Å; F527-V529 VanDerWaalsContact C-N 3.33Å; F527-L533 HydrophobicContact CB-CB 4.47Å; F527-L533 HydrophobicContact CD2-CB 4.04Å; F527-L533 HydrophobicContact CD2-CD1 3.91Å; F527-L533 HydrophobicContact CE2-CD1 4.11Å; F527-L533 HydrophobicContact CG-CB 4.45Å; F527-H536 HydrophobicContact CE1-CB 4.06Å; F527-H536 HydrophobicContact CE2-CB 3.91Å; F527-H536 AromaticContact CE2-CD2 3.26Å; F527-H536 WeakPolarHBondContact CE2-CD2 3.48Å; F527-H536 AromaticContact CE2-CG 3.71Å; F527-H536 HydrophobicContact CZ-CB 3.5Å; F527-H536 AromaticContact CZ-CD2 3.34Å; F527-H536 WeakPolarHBondContact CZ-CD2 3.27Å; F527-H536 AromaticContact CZ-CG 3.33Å
528	G	87.4	Confident	87.2	Confident	47 Å²	47	72.9 Å²	72.9	49%	0.485	40%	0.396	S	S	.	.	S	Bend	trans	-72.3	-22.9	175.9	0	0	0	0	0	114.1
529	V	87.2	Confident	87.3	Confident	82 Å²	82	72.3 Å²	72.3	50%	0.497	40%	0.403	S	S	.	.	S	Bend	trans	-131.7	136	-174.3	-174.2	0	0	0	0	111.1	F527 K531 S532 L533	F527-V529 VanDerWaalsContact C-N 3.33Å; V529-K531 VanDerWaalsContact C-N 3.28Å; V529-K531 HydrophobicContact CG1-CB 4.24Å; V529-K531 PolarHBondContact O-N 2.94Å; V529-S532 WeakPolarHBondContact O-CB 3.34Å; V529-S532 PolarHBondContact O-N 3.08Å; V529-L533 PolarHBondContact O-N 2.7Å
530	R	88.4	Confident	87.4	Confident	160 Å²	160	71.8 Å²	71.8	60%	0.604	39%	0.392	S	S	*	.	H	α-helix	trans	-56.4	-39	-178.1	-163.6	179.6	-177.3	106.3	0.7	113	Y518 S532 L533 I534	Y518-R530 HydrophobicContact CD1-CB 4.01Å; Y518-R530 HydrophobicContact CD1-CG 4.05Å; Y518-R530 HydrophobicContact CD2-CB 4.22Å; Y518-R530 HydrophobicContact CE1-CB 3.79Å; Y518-R530 HydrophobicContact CE1-CG 3.97Å; Y518-R530 HydrophobicContact CE2-CB 3.98Å; Y518-R530 HydrophobicContact CG-CB 4.22Å; R530-S532 VanDerWaalsContact C-N 3.27Å; R530-S532 PolarHBondContact O-N 3.01Å; R530-L533 PolarHBondContact O-N 2.83Å; R530-L533 VanDerWaalsContact O-N 3.16Å; R530-I534 HydrophobicContact CG-CD1 4.24Å; R530-I534 WeakPolarHBondContact O-CG1 3.29Å; R530-I534 PolarHBondContact O-N 3.02Å
531	K	88.3	Confident	87.5	Confident	161 Å²	161	74.6 Å²	74.6	70%	0.7	41%	0.41	S	S	*	.	H	α-helix	trans	-56.3	-39.6	175.4	-67.3	-179	179.1	176.4	0	111.9	V529 I534 I535	V529-K531 VanDerWaalsContact C-N 3.28Å; V529-K531 HydrophobicContact CG1-CB 4.24Å; V529-K531 PolarHBondContact O-N 2.94Å; K531-I534 PolarHBondContact O-N 2.87Å; K531-I535 WeakPolarHBondContact O-CG1 3.48Å; K531-I535 PolarHBondContact O-N 3.31Å
532	S	88.9	Confident	87.4	Confident	54 Å²	54	77.7 Å²	77.7	38%	0.378	41%	0.411	S	S	.	.	H	α-helix	trans	-69.6	-39.2	177.4	-53.3	0	0	0	0	112.3	V529 R530 I535 H536	V529-S532 WeakPolarHBondContact O-CB 3.34Å; V529-S532 PolarHBondContact O-N 3.08Å; R530-S532 VanDerWaalsContact C-N 3.27Å; R530-S532 PolarHBondContact O-N 3.01Å; S532-I535 PolarHBondContact O-N 2.87Å; S532-H536 WeakPolarHBondContact O-CB 3.18Å; S532-H536 PolarHBondContact O-N 3.25Å
533	L	88.8	Confident	87.6	Confident	29 Å²	29	77.4 Å²	77.4	15%	0.152	41%	0.41	C	S	.	.	H	α-helix	trans	-61.6	-43.6	172.6	174.4	62.7	0	0	0	111.3	C520 F527 V529 R530 H536 H537	C520-L533 HydrophobicContact CB-CD1 3.71Å; F527-L533 HydrophobicContact CB-CB 4.47Å; F527-L533 HydrophobicContact CD2-CB 4.04Å; F527-L533 HydrophobicContact CD2-CD1 3.91Å; F527-L533 HydrophobicContact CE2-CD1 4.11Å; F527-L533 HydrophobicContact CG-CB 4.45Å; V529-L533 PolarHBondContact O-N 2.7Å; R530-L533 PolarHBondContact O-N 2.83Å; R530-L533 VanDerWaalsContact O-N 3.16Å; L533-H536 CarbonylContact O-C 3.14Å; L533-H536 PolarHBondContact O-N 2.59Å; L533-H537 WeakPolarHBondContact O-CB 3.22Å; L533-H537 PolarHBondContact O-N 3.11Å
534	I	88.8	Confident	87.7	Confident	80 Å²	80	80.9 Å²	80.9	41%	0.41	42%	0.417	S	S	.	.	H	α-helix	trans	-63.2	-46.6	178.6	-65.4	163.8	0	0	0	111.2	R530 K531 H536 H537 R538	R530-I534 HydrophobicContact CG-CD1 4.24Å; R530-I534 WeakPolarHBondContact O-CG1 3.29Å; R530-I534 PolarHBondContact O-N 3.02Å; K531-I534 PolarHBondContact O-N 2.87Å; I534-H536 PolarHBondContact O-N 2.39Å; I534-H537 WeakPolarHBondContact O-CB 3.48Å; I534-H537 PolarHBondContact O-N 3.11Å; I534-H537 VanDerWaalsContact O-N 3.16Å; I534-R538 PolarHBondContact O-N 3.37Å; I534-R538 VanDerWaalsContact O-N 3.08Å
535	I	89.1	Confident	87.8	Confident	59 Å²	59	81.6 Å²	81.6	30%	0.303	41%	0.411	S	S	.	.	H	α-helix	trans	-61.8	-34.3	176.3	-68	164.2	0	0	0	111.2	K531 S532 C557	K531-I535 WeakPolarHBondContact O-CG1 3.48Å; K531-I535 PolarHBondContact O-N 3.31Å; S532-I535 PolarHBondContact O-N 2.87Å; I535-C557 HydrophobicContact CD1-CB 3.99Å; I535-C557 HydrophobicContact CG1-CB 4.16Å; I535-C557 HydrophobicContact CG2-CB 3.83Å
536	H	88.5	Confident	88	Confident	23 Å²	23	79.5 Å²	79.5	11%	0.106	40%	0.4	C	S	.	.	H	α-helix	trans	-72.9	-38.5	173.5	172.8	50.4	0	0	0	112.9	C520 C523 F527 S532 L533 I534 R538 S539 H540	C520-H536 PolarHBondContact SG-NE2 3.49Å; C523-H536 PolarHBondContact SG-NE2 3.44Å; F527-H536 HydrophobicContact CE1-CB 4.06Å; F527-H536 HydrophobicContact CE2-CB 3.91Å; F527-H536 AromaticContact CE2-CD2 3.26Å; F527-H536 WeakPolarHBondContact CE2-CD2 3.48Å; F527-H536 AromaticContact CE2-CG 3.71Å; F527-H536 HydrophobicContact CZ-CB 3.5Å; F527-H536 AromaticContact CZ-CD2 3.34Å; F527-H536 WeakPolarHBondContact CZ-CD2 3.27Å; F527-H536 AromaticContact CZ-CG 3.33Å; S532-H536 WeakPolarHBondContact O-CB 3.18Å; S532-H536 PolarHBondContact O-N 3.25Å; L533-H536 CarbonylContact O-C 3.14Å; L533-H536 PolarHBondContact O-N 2.59Å; I534-H536 PolarHBondContact O-N 2.39Å; H536-R538 PolarHBondContact O-N 2.78Å; H536-S539 PolarHBondContact ND1-OG 3Å; H536-S539 VanDerWaalsContact ND1-OG 3.14Å; H536-S539 WeakPolarHBondContact O-CA 2.97Å; H536-S539 VanDerWaalsContact O-CB 3.31Å; H536-S539 WeakPolarHBondContact O-CB 3.4Å; H536-S539 PolarHBondContact O-N 2.76Å; H536-S539 PolarHBondContact O-OG 3.46Å; H536-H540 AromaticContact CD2-NE2 3.51Å; H536-H540 AromaticContact CE1-CD2 3.83Å; H536-H540 AromaticContact CE1-NE2 2.79Å; H536-H540 PolarHBondContact CE1-NE2 3.06Å; H536-H540 AromaticContact ND1-NE2 3.92Å; H536-H540 AromaticContact NE2-CD2 3.84Å; H536-H540 AromaticContact NE2-NE2 2.43Å; H536-H540 PolarHBondContact NE2-NE2 2.66Å
537	H	87.3	Confident	88.2	Confident	78 Å²	78	83.7 Å²	83.7	36%	0.361	41%	0.413	S	S	.	.	H	α-helix	trans	-58.8	-38	174.5	-166.5	-32.9	0	0	0	111.3	E522 L533 I534 S539 H540 T541	E522-H537 IonicContact OE1-CE1 3.42Å; E522-H537 IonicContact OE1-ND1 3.76Å; L533-H537 WeakPolarHBondContact O-CB 3.22Å; L533-H537 PolarHBondContact O-N 3.11Å; I534-H537 WeakPolarHBondContact O-CB 3.48Å; I534-H537 PolarHBondContact O-N 3.11Å; I534-H537 VanDerWaalsContact O-N 3.16Å; H537-S539 PolarHBondContact O-N 2.63Å; H537-S539 VanDerWaalsContact O-N 3.14Å; H537-H540 WeakPolarHBondContact O-CB 3.22Å; H537-H540 PolarHBondContact O-N 2.93Å; H537-T541 PolarHBondContact O-N 3.33Å
538	R	89.9	Confident	88.5	Confident	54 Å²	54	81.5 Å²	81.5	20%	0.204	40%	0.404	C	S	.	.	H	α-helix	trans	-60.9	-18.8	171.3	-68.9	175.7	178.5	168.9	-1.9	114.3	I534 H536 K542 E543 N556	I534-R538 PolarHBondContact O-N 3.37Å; I534-R538 VanDerWaalsContact O-N 3.08Å; H536-R538 PolarHBondContact O-N 2.78Å; R538-K542 CarbonylContact O-C 3.52Å; R538-K542 WeakPolarHBondContact O-CA 3.45Å; R538-K542 PolarHBondContact O-N 2.88Å; R538-K542 VanDerWaalsContact O-N 3.13Å; R538-E543 HydrophobicContact CB-CB 4.37Å; R538-E543 HydrophobicContact CG-CB 4.19Å; R538-E543 PolarHBondContact O-N 3.3Å; R538-N556 HydrophobicContact CB-CB 4.02Å; R538-N556 WeakPolarHBondContact CD-O 3.1Å; R538-N556 PolarHBondContact NH1-O 3.22Å; R538-N556 VanDerWaalsContact NH1-O 3.11Å
539	S	87.3	Confident	88.5	Confident	63 Å²	63	84 Å²	84	44%	0.441	42%	0.42	S	S	.	.	H	α-helix	trans	-78.2	-19.4	172	72.8	0	0	0	0	113.7	H536 H537	H536-S539 PolarHBondContact ND1-OG 3Å; H536-S539 VanDerWaalsContact ND1-OG 3.14Å; H536-S539 WeakPolarHBondContact O-CA 2.97Å; H536-S539 VanDerWaalsContact O-CB 3.31Å; H536-S539 WeakPolarHBondContact O-CB 3.4Å; H536-S539 PolarHBondContact O-N 2.76Å; H536-S539 PolarHBondContact O-OG 3.46Å; H537-S539 PolarHBondContact O-N 2.63Å; H537-S539 VanDerWaalsContact O-N 3.14Å
540	H	89.1	Confident	88.5	Confident	63 Å²	63	85.5 Å²	85.5	29%	0.292	42%	0.422	S	S	.	.	H	α-helix	trans	-85.3	-51.7	172.2	-68.6	-76	0	0	0	111.5	C520 E522 C523 H536 H537 K542	C520-H540 PolarHBondContact SG-NE2 3.42Å; E522-H540 WeakPolarHBondContact OE1-CB 3.47Å; E522-H540 IonicContact OE1-CG 2.66Å; E522-H540 WeakPolarHBondContact OE2-CB 3.42Å; E522-H540 IonicContact OE2-CG 2.92Å; E522-H540 IonicContact OE2-ND1 3.77Å; C523-H540 WeakPolarHBondContact CB-CE1 3.18Å; C523-H540 PolarHBondContact SG-CE1 3.29Å; C523-H540 PolarHBondContact SG-NE2 2.95Å; H536-H540 AromaticContact CD2-NE2 3.51Å; H536-H540 AromaticContact CE1-CD2 3.83Å; H536-H540 AromaticContact CE1-NE2 2.79Å; H536-H540 PolarHBondContact CE1-NE2 3.06Å; H536-H540 AromaticContact ND1-NE2 3.92Å; H536-H540 AromaticContact NE2-CD2 3.84Å; H536-H540 AromaticContact NE2-NE2 2.43Å; H536-H540 PolarHBondContact NE2-NE2 2.66Å; H537-H540 WeakPolarHBondContact O-CB 3.22Å; H537-H540 PolarHBondContact O-N 2.93Å; H540-K542 PolarHBondContact O-N 3.06Å; H540-K542 VanDerWaalsContact O-N 3.14Å
541	T	88.4	Confident	88.5	Confident	62 Å²	62	79.7 Å²	79.7	38%	0.38	41%	0.405	S	S	.	.	S	Bend	trans	-68.7	-10.4	176.6	58.9	0	0	0	0	113.6	H537 E543	H537-T541 PolarHBondContact O-N 3.33Å; T541-E543 PolarHBondContact O-N 3.49Å; T541-E543 VanDerWaalsContact O-N 3.16Å; T541-E543 VanDerWaalsContact OG1-CD 3.3Å; T541-E543 WeakPolarHBondContact OG1-CG 3.5Å; T541-E543 PolarHBondContact OG1-OE1 3.16Å
542	K	84.3	Confident	88.4	Confident	178 Å²	178	80.3 Å²	80.3	77%	0.774	41%	0.411	S	S	*	.			trans	58.3	16.6	-172.8	-55.9	174.4	-174.7	168.3	0	113.9	R538 H540 R544	R538-K542 CarbonylContact O-C 3.52Å; R538-K542 WeakPolarHBondContact O-CA 3.45Å; R538-K542 PolarHBondContact O-N 2.88Å; R538-K542 VanDerWaalsContact O-N 3.13Å; H540-K542 PolarHBondContact O-N 3.06Å; H540-K542 VanDerWaalsContact O-N 3.14Å; K542-R544 WeakPolarHBondContact O-CG 3.32Å
543	E	85.8	Confident	88.4	Confident	103 Å²	103	82.7 Å²	82.7	48%	0.481	41%	0.414	S	S	.	.			trans	-64.9	137.2	175.9	-76.8	168.4	-159.8	0	0	112.2	R538 T541	R538-E543 HydrophobicContact CB-CB 4.37Å; R538-E543 HydrophobicContact CG-CB 4.19Å; R538-E543 PolarHBondContact O-N 3.3Å; T541-E543 PolarHBondContact O-N 3.49Å; T541-E543 VanDerWaalsContact O-N 3.16Å; T541-E543 VanDerWaalsContact OG1-CD 3.3Å; T541-E543 WeakPolarHBondContact OG1-CG 3.5Å; T541-E543 PolarHBondContact OG1-OE1 3.16Å
544	R	89.7	Confident	88.5	Confident	119 Å²	119	83.2 Å²	83.2	45%	0.449	42%	0.42	S	S	.	.			trans	-137.7	74.7	-176.9	-61.2	174.9	80.4	89.4	0.8	110.5	K542 Y546 S554 F555	K542-R544 WeakPolarHBondContact O-CG 3.32Å; R544-Y546 PolarHBondContact O-N 3.06Å; R544-Y546 VanDerWaalsContact O-N 3.15Å; R544-S554 VanDerWaalsContact CB-CB 3.5Å; R544-S554 VanDerWaalsContact CB-OG 3.26Å; R544-S554 WeakPolarHBondContact CB-OG 3.35Å; R544-S554 WeakPolarHBondContact CD-OG 3.46Å; R544-S554 PolarHBondContact NE-O 3.38Å; R544-S554 PolarHBondContact NE-OG 2.87Å; R544-S554 PolarHBondContact NH2-O 3.35Å; R544-S554 WeakPolarHBondContact O-CB 3.26Å; R544-F555 CarbonylContact C-O 3.58Å; R544-F555 VanDerWaalsContact CA-O 3.23Å; R544-F555 WeakPolarHBondContact CA-O 3.44Å
545	P	87.9	Confident	88.6	Confident	74 Å²	74	81.1 Å²	81.1	48%	0.481	41%	0.408	S	S	.	.			trans	-71.2	-8	-170.8	-21	35.3	0	0	0	115.8
546	Y	90.7	Very high	88.7	Confident	74 Å²	74	80.3 Å²	80.3	29%	0.29	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	93.9	-175.5	-56.3	-76.4	0	0	0	110.2	R544 S554 F555 H558	R544-Y546 PolarHBondContact O-N 3.06Å; R544-Y546 VanDerWaalsContact O-N 3.15Å; Y546-S554 CarbonylContact O-C 3.5Å; Y546-S554 WeakPolarHBondContact O-CA 3Å; Y546-F555 WeakPolarHBondContact CD2-O 3.33Å; Y546-F555 PolarHBondContact N-O 3.47Å; Y546-F555 VanDerWaalsContact N-O 3.11Å; Y546-F555 PolarHBondContact O-N 3.01Å; Y546-H558 HydrophobicContact CD1-CB 4.14Å; Y546-H558 HydrophobicContact CE1-CB 3.88Å; Y546-H558 HydrophobicContact CE2-CB 4.45Å
547	E	90.2	Very high	88.7	Confident	147 Å²	147	80.2 Å²	80.2	69%	0.687	41%	0.406	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87.1	149.8	178.3	65.1	-167.4	-178.7	0	0	113.6	L561	E547-L561 WeakPolarHBondContact O-CD1 3.35Å; E547-L561 WeakPolarHBondContact O-CD2 3.4Å
548	C	91.7	Very high	88.9	Confident	1 Å²	1	81.5 Å²	81.5	1%	0.007	41%	0.412	C	S	.	.			trans	-98.3	114.3	173.4	-179.4	0	0	0	0	109.4	E550 C551 E552 K553 L561 H564 H568	C548-E550 PolarHBondContact O-N 3.1Å; C548-E550 VanDerWaalsContact O-N 3.09Å; C548-C551 PolarHBondContact O-N 2.91Å; C548-E552 VanDerWaalsContact O-CA 3.31Å; C548-E552 WeakPolarHBondContact O-CA 3.31Å; C548-E552 PolarHBondContact O-N 3.49Å; C548-K553 WeakPolarHBondContact CB-O 3.44Å; C548-K553 PolarHBondContact N-O 2.93Å; C548-L561 HydrophobicContact CB-CD1 3.63Å; C548-H564 PolarHBondContact SG-NE2 2.94Å; C548-H568 PolarHBondContact SG-NE2 3.16Å
549	A	88.3	Confident	88.8	Confident	100 Å²	100	83 Å²	83	83%	0.826	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.6	-23.5	179.2	0	0	0	0	0	114.3
550	E	86.4	Confident	88.9	Confident	113 Å²	113	80.2 Å²	80.2	53%	0.528	41%	0.412	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.8	-17	-174.6	-63.3	175.7	-111.7	0	0	114.4	C548 H568	C548-E550 PolarHBondContact O-N 3.1Å; C548-E550 VanDerWaalsContact O-N 3.09Å; E550-H568 VanDerWaalsContact C-CE1 3.44Å; E550-H568 PolarHBondContact O-CE1 3.11Å; E550-H568 WeakPolarHBondContact OE2-CB 3.39Å; E550-H568 IonicContact OE2-CG 2.71Å; E550-H568 IonicContact OE2-ND1 3.49Å
551	C	89.4	Confident	89	Confident	39 Å²	39	77.9 Å²	77.9	26%	0.264	40%	0.401	S	S	.	.	T	Hydrogen-bonded Turn	trans	-154.7	21.2	175.9	68.1	0	0	0	0	114.8	C548 K553 H564 H568	C548-C551 PolarHBondContact O-N 2.91Å; C551-K553 PolarHBondContact O-N 3.1Å; C551-K553 VanDerWaalsContact SG-CD 3.55Å; C551-H564 PolarHBondContact SG-NE2 3.14Å; C551-H568 WeakPolarHBondContact CB-CE1 3.42Å; C551-H568 PolarHBondContact SG-CE1 3.26Å; C551-H568 PolarHBondContact SG-NE2 3.13Å
552	E	86.1	Confident	89	Confident	174 Å²	174	78.3 Å²	78.3	81%	0.813	40%	0.401	S	S	*	.			trans	58.9	7	175.1	-59.1	170.7	-170.4	0	0	115	C548 S554	C548-E552 VanDerWaalsContact O-CA 3.31Å; C548-E552 WeakPolarHBondContact O-CA 3.31Å; C548-E552 PolarHBondContact O-N 3.49Å; E552-S554 PolarHBondContact O-N 3.2Å
553	K	89	Confident	89.2	Confident	104 Å²	104	75.6 Å²	75.6	45%	0.452	39%	0.386	S	S	.	.			trans	-71.3	115.3	178.6	-71.9	174.4	-162.8	164	0	109.9	C548 C551 F555	C548-K553 WeakPolarHBondContact CB-O 3.44Å; C548-K553 PolarHBondContact N-O 2.93Å; C551-K553 PolarHBondContact O-N 3.1Å; C551-K553 VanDerWaalsContact SG-CD 3.55Å; K553-F555 HydrophobicContact CB-CE2 3.98Å; K553-F555 HydrophobicContact CB-CZ 4.23Å; K553-F555 WeakPolarHBondContact O-CD2 3.49Å; K553-F555 WeakPolarHBondContact O-CE2 3.35Å
554	S	90.5	Very high	89.4	Confident	39 Å²	39	71.8 Å²	71.8	27%	0.273	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	156.3	175.7	62.1	0	0	0	0	112.9	R544 Y546 E552	R544-S554 VanDerWaalsContact CB-CB 3.5Å; R544-S554 VanDerWaalsContact CB-OG 3.26Å; R544-S554 WeakPolarHBondContact CB-OG 3.35Å; R544-S554 WeakPolarHBondContact CD-OG 3.46Å; R544-S554 PolarHBondContact NE-O 3.38Å; R544-S554 PolarHBondContact NE-OG 2.87Å; R544-S554 PolarHBondContact NH2-O 3.35Å; R544-S554 WeakPolarHBondContact O-CB 3.26Å; Y546-S554 CarbonylContact O-C 3.5Å; Y546-S554 WeakPolarHBondContact O-CA 3Å; E552-S554 PolarHBondContact O-N 3.2Å
555	F	90.9	Very high	89.3	Confident	37 Å²	37	68.8 Å²	68.8	16%	0.162	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	152.4	179.9	-62.4	-91.9	0	0	0	111.4	R544 Y546 K553 L561 H564	R544-F555 CarbonylContact C-O 3.58Å; R544-F555 VanDerWaalsContact CA-O 3.23Å; R544-F555 WeakPolarHBondContact CA-O 3.44Å; Y546-F555 WeakPolarHBondContact CD2-O 3.33Å; Y546-F555 PolarHBondContact N-O 3.47Å; Y546-F555 VanDerWaalsContact N-O 3.11Å; Y546-F555 PolarHBondContact O-N 3.01Å; K553-F555 HydrophobicContact CB-CE2 3.98Å; K553-F555 HydrophobicContact CB-CZ 4.23Å; K553-F555 WeakPolarHBondContact O-CD2 3.49Å; K553-F555 WeakPolarHBondContact O-CE2 3.35Å; F555-L561 HydrophobicContact CB-CB 4.41Å; F555-L561 HydrophobicContact CD2-CB 4.03Å; F555-L561 HydrophobicContact CD2-CD1 4.01Å; F555-L561 HydrophobicContact CE2-CD1 4.25Å; F555-L561 HydrophobicContact CG-CB 4.39Å; F555-H564 HydrophobicContact CE1-CB 4.04Å; F555-H564 HydrophobicContact CE2-CB 3.84Å; F555-H564 AromaticContact CE2-CD2 3.25Å; F555-H564 WeakPolarHBondContact CE2-CD2 2.85Å; F555-H564 AromaticContact CE2-CG 3.7Å; F555-H564 HydrophobicContact CZ-CB 3.42Å; F555-H564 VanDerWaalsContact CZ-CB 3.42Å; F555-H564 AromaticContact CZ-CD2 3.4Å; F555-H564 VanDerWaalsContact CZ-CD2 3.4Å; F555-H564 WeakPolarHBondContact CZ-CD2 3.16Å; F555-H564 AromaticContact CZ-CG 3.37Å
556	N	90.6	Very high	89.2	Confident	41 Å²	41	67.9 Å²	67.9	22%	0.219	35%	0.349	C	S	.	.	S	Bend	trans	-82.7	-13.9	179	62.9	-5.7	0	0	0	114.2	R538	R538-N556 HydrophobicContact CB-CB 4.02Å; R538-N556 WeakPolarHBondContact CD-O 3.1Å; R538-N556 PolarHBondContact NH1-O 3.22Å; R538-N556 VanDerWaalsContact NH1-O 3.11Å
557	C	89.5	Confident	89.1	Confident	21 Å²	21	68.2 Å²	68.2	14%	0.142	36%	0.359	C	S	.	.	S	Bend	trans	-141.3	144.5	179.8	55	0	0	0	0	111.8	I535 S559 G560 L561	I535-C557 HydrophobicContact CD1-CB 3.99Å; I535-C557 HydrophobicContact CG1-CB 4.16Å; I535-C557 HydrophobicContact CG2-CB 3.83Å; C557-S559 PolarHBondContact O-N 2.98Å; C557-G560 WeakPolarHBondContact O-CA 3.43Å; C557-G560 PolarHBondContact O-N 3.42Å; C557-L561 PolarHBondContact O-N 2.77Å
558	H	90.4	Very high	89	Confident	106 Å²	106	64.7 Å²	64.7	49%	0.491	34%	0.342	S	S	.	.	H	α-helix	trans	-58.6	-44.2	-178.5	-175.6	-105	0	0	0	112.8	Y546 G560 L561 I562	Y546-H558 HydrophobicContact CD1-CB 4.14Å; Y546-H558 HydrophobicContact CE1-CB 3.88Å; Y546-H558 HydrophobicContact CE2-CB 4.45Å; H558-G560 PolarHBondContact O-N 2.91Å; H558-L561 WeakPolarHBondContact O-CA 3.47Å; H558-L561 WeakPolarHBondContact O-CB 3.34Å; H558-L561 PolarHBondContact O-N 3.3Å; H558-I562 PolarHBondContact O-N 3.33Å
559	S	88.5	Confident	88.7	Confident	86 Å²	86	73 Å²	73	60%	0.601	37%	0.373	S	S	*	.	H	α-helix	trans	-64.2	-19.2	174.6	55.6	0	0	0	0	113.6	C557 R563	C557-S559 PolarHBondContact O-N 2.98Å; S559-R563 WeakPolarHBondContact O-CB 3.25Å; S559-R563 PolarHBondContact O-N 2.9Å
560	G	89.2	Confident	88.4	Confident	3 Å²	3	70.6 Å²	70.6	3%	0.031	36%	0.359	C	S	.	.	H	α-helix	trans	-70.2	-44.8	168.1	0	0	0	0	0	112.3	C557 H558 H564	C557-G560 WeakPolarHBondContact O-CA 3.43Å; C557-G560 PolarHBondContact O-N 3.42Å; H558-G560 PolarHBondContact O-N 2.91Å; G560-H564 PolarHBondContact O-N 3.21Å
561	L	91	Very high	88.3	Confident	15 Å²	15	68.8 Å²	68.8	8%	0.079	35%	0.35	C	S	.	.	H	α-helix	trans	-66.4	-53.5	177.1	172.7	61.9	0	0	0	112	E547 C548 F555 C557 H558 R563 H564 Q565	E547-L561 WeakPolarHBondContact O-CD1 3.35Å; E547-L561 WeakPolarHBondContact O-CD2 3.4Å; C548-L561 HydrophobicContact CB-CD1 3.63Å; F555-L561 HydrophobicContact CB-CB 4.41Å; F555-L561 HydrophobicContact CD2-CB 4.03Å; F555-L561 HydrophobicContact CD2-CD1 4.01Å; F555-L561 HydrophobicContact CE2-CD1 4.25Å; F555-L561 HydrophobicContact CG-CB 4.39Å; C557-L561 PolarHBondContact O-N 2.77Å; H558-L561 WeakPolarHBondContact O-CA 3.47Å; H558-L561 WeakPolarHBondContact O-CB 3.34Å; H558-L561 PolarHBondContact O-N 3.3Å; L561-R563 VanDerWaalsContact C-N 3.3Å; L561-R563 PolarHBondContact O-N 3.31Å; L561-H564 CarbonylContact O-C 3.14Å; L561-H564 WeakPolarHBondContact O-CA 3.14Å; L561-H564 WeakPolarHBondContact O-CB 3.35Å; L561-H564 PolarHBondContact O-N 2.93Å; L561-Q565 HydrophobicContact CD1-CG 4.19Å; L561-Q565 PolarHBondContact O-N 3.18Å
562	I	89.8	Confident	88.2	Confident	71 Å²	71	72.6 Å²	72.6	36%	0.364	36%	0.359	S	S	.	.	H	α-helix	trans	-53.8	-49.4	179.8	-61.3	-55.3	0	0	0	110.5	H558 H564 Q565 M566	H558-I562 PolarHBondContact O-N 3.33Å; I562-H564 PolarHBondContact O-N 3.33Å; I562-H564 VanDerWaalsContact O-N 3.11Å; I562-Q565 WeakPolarHBondContact O-CB 3.43Å; I562-Q565 PolarHBondContact O-N 2.89Å; I562-M566 WeakPolarHBondContact O-CG 3.28Å; I562-M566 PolarHBondContact O-N 2.99Å; I562-M566 VanDerWaalsContact O-N 3.08Å
563	R	88	Confident	88.1	Confident	121 Å²	121	68.4 Å²	68.4	46%	0.457	35%	0.347	S	S	.	.	H	α-helix	trans	-62.9	-18.9	177.8	-173.9	178	63.1	177	-6.2	114	S559 L561	S559-R563 WeakPolarHBondContact O-CB 3.25Å; S559-R563 PolarHBondContact O-N 2.9Å; L561-R563 VanDerWaalsContact C-N 3.3Å; L561-R563 PolarHBondContact O-N 3.31Å
564	H	88.8	Confident	88.2	Confident	23 Å²	23	67.9 Å²	67.9	11%	0.106	34%	0.343	C	S	.	.	H	α-helix	trans	-88.2	-36.1	170.9	166.5	52.5	0	0	0	112.1	C548 C551 F555 G560 L561 I562 M566 T567 H568	C548-H564 PolarHBondContact SG-NE2 2.94Å; C551-H564 PolarHBondContact SG-NE2 3.14Å; F555-H564 HydrophobicContact CE1-CB 4.04Å; F555-H564 HydrophobicContact CE2-CB 3.84Å; F555-H564 AromaticContact CE2-CD2 3.25Å; F555-H564 WeakPolarHBondContact CE2-CD2 2.85Å; F555-H564 AromaticContact CE2-CG 3.7Å; F555-H564 HydrophobicContact CZ-CB 3.42Å; F555-H564 VanDerWaalsContact CZ-CB 3.42Å; F555-H564 AromaticContact CZ-CD2 3.4Å; F555-H564 VanDerWaalsContact CZ-CD2 3.4Å; F555-H564 WeakPolarHBondContact CZ-CD2 3.16Å; F555-H564 AromaticContact CZ-CG 3.37Å; G560-H564 PolarHBondContact O-N 3.21Å; L561-H564 CarbonylContact O-C 3.14Å; L561-H564 WeakPolarHBondContact O-CA 3.14Å; L561-H564 WeakPolarHBondContact O-CB 3.35Å; L561-H564 PolarHBondContact O-N 2.93Å; I562-H564 PolarHBondContact O-N 3.33Å; I562-H564 VanDerWaalsContact O-N 3.11Å; H564-M566 PolarHBondContact O-N 3.3Å; H564-T567 PolarHBondContact ND1-OG1 3.16Å; H564-T567 VanDerWaalsContact ND1-OG1 3.11Å; H564-T567 WeakPolarHBondContact O-CA 3.38Å; H564-T567 WeakPolarHBondContact O-CB 3.17Å; H564-T567 PolarHBondContact O-N 3Å; H564-T567 PolarHBondContact O-OG1 3.04Å; H564-H568 AromaticContact CD2-NE2 3.37Å; H564-H568 PolarHBondContact CD2-NE2 3.08Å; H564-H568 AromaticContact CE1-CD2 3.78Å; H564-H568 AromaticContact CE1-NE2 2.78Å; H564-H568 PolarHBondContact CE1-NE2 3.14Å; H564-H568 AromaticContact ND1-NE2 3.84Å; H564-H568 AromaticContact NE2-CD2 3.87Å; H564-H568 AromaticContact NE2-NE2 2.39Å; H564-H568 PolarHBondContact NE2-NE2 3.5Å
565	Q	88	Confident	88.2	Confident	56 Å²	56	71.3 Å²	71.3	26%	0.262	35%	0.353	S	S	.	.	H	α-helix	trans	-58.2	-35.3	170.8	-72.2	168.6	-42	0	0	112	L561 I562 T567 H568 R569	L561-Q565 HydrophobicContact CD1-CG 4.19Å; L561-Q565 PolarHBondContact O-N 3.18Å; I562-Q565 WeakPolarHBondContact O-CB 3.43Å; I562-Q565 PolarHBondContact O-N 2.89Å; Q565-T567 PolarHBondContact O-N 3.28Å; Q565-H568 PolarHBondContact O-N 3.36Å; Q565-R569 PolarHBondContact O-N 3.03Å
566	M	87.2	Confident	88.2	Confident	54 Å²	54	69.6 Å²	69.6	27%	0.266	35%	0.345	S	S	.	.	H	α-helix	trans	-53.5	-28.1	168.6	-53.5	-58.8	-77	0	0	113.5	I562 H564 G570 E571 P573	I562-M566 WeakPolarHBondContact O-CG 3.28Å; I562-M566 PolarHBondContact O-N 2.99Å; I562-M566 VanDerWaalsContact O-N 3.08Å; H564-M566 PolarHBondContact O-N 3.3Å; M566-G570 PolarHBondContact O-N 2.75Å; M566-E571 HydrophobicContact CE-CB 3.9Å; M566-E571 WeakPolarHBondContact CE-OE2 3.37Å; M566-E571 PolarHBondContact O-N 3.15Å; M566-P573 HydrophobicContact CE-CG 4.46Å
567	T	87.5	Confident	88.1	Confident	82 Å²	82	72.3 Å²	72.3	50%	0.503	37%	0.368	S	S	.	.	H	α-helix	trans	-79	-23.7	179.6	67.6	0	0	0	0	113.6	H564 Q565	H564-T567 PolarHBondContact ND1-OG1 3.16Å; H564-T567 VanDerWaalsContact ND1-OG1 3.11Å; H564-T567 WeakPolarHBondContact O-CA 3.38Å; H564-T567 WeakPolarHBondContact O-CB 3.17Å; H564-T567 PolarHBondContact O-N 3Å; H564-T567 PolarHBondContact O-OG1 3.04Å; Q565-T567 PolarHBondContact O-N 3.28Å
568	H	87.3	Confident	88	Confident	73 Å²	73	76.6 Å²	76.6	34%	0.338	39%	0.385	S	S	.	.	H	α-helix	trans	-76.1	-44.2	171.8	-69.8	-79.6	0	0	0	111.2	C548 E550 C551 H564 Q565 G570	C548-H568 PolarHBondContact SG-NE2 3.16Å; E550-H568 VanDerWaalsContact C-CE1 3.44Å; E550-H568 PolarHBondContact O-CE1 3.11Å; E550-H568 WeakPolarHBondContact OE2-CB 3.39Å; E550-H568 IonicContact OE2-CG 2.71Å; E550-H568 IonicContact OE2-ND1 3.49Å; C551-H568 WeakPolarHBondContact CB-CE1 3.42Å; C551-H568 PolarHBondContact SG-CE1 3.26Å; C551-H568 PolarHBondContact SG-NE2 3.13Å; H564-H568 AromaticContact CD2-NE2 3.37Å; H564-H568 PolarHBondContact CD2-NE2 3.08Å; H564-H568 AromaticContact CE1-CD2 3.78Å; H564-H568 AromaticContact CE1-NE2 2.78Å; H564-H568 PolarHBondContact CE1-NE2 3.14Å; H564-H568 AromaticContact ND1-NE2 3.84Å; H564-H568 AromaticContact NE2-CD2 3.87Å; H564-H568 AromaticContact NE2-NE2 2.39Å; H564-H568 PolarHBondContact NE2-NE2 3.5Å; Q565-H568 PolarHBondContact O-N 3.36Å; H568-G570 PolarHBondContact O-N 3.11Å; H568-G570 VanDerWaalsContact O-N 3.1Å
569	R	85.7	Confident	87.9	Confident	174 Å²	174	73.3 Å²	73.3	66%	0.657	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.8	-9.8	174.1	-60.4	177.3	173.8	-109.4	-6.4	113.9	Q565 E571	Q565-R569 PolarHBondContact O-N 3.03Å; R569-E571 HydrophobicContact CB-CB 4.43Å; R569-E571 HydrophobicContact CB-CG 3.8Å; R569-E571 WeakPolarHBondContact CB-OE1 3.16Å; R569-E571 WeakPolarHBondContact CD-OE1 3.08Å; R569-E571 PolarHBondContact O-N 3.37Å
570	G	83.4	Confident	87.9	Confident	51 Å²	51	75.2 Å²	75.2	53%	0.526	37%	0.373	S	S	.	.	T	Hydrogen-bonded Turn	trans	66.8	12	-175.4	0	0	0	0	0	114.2	M566 H568 R572	M566-G570 PolarHBondContact O-N 2.75Å; H568-G570 PolarHBondContact O-N 3.11Å; H568-G570 VanDerWaalsContact O-N 3.1Å; G570-R572 WeakPolarHBondContact O-CG 3.32Å; G570-R572 PolarHBondContact O-N 2.79Å
571	E	83.5	Confident	87.8	Confident	74 Å²	74	80.7 Å²	80.7	35%	0.346	40%	0.396	S	S	.	.			trans	-71	127.5	-170	-76.8	173.3	-152.9	0	0	112.2	M566 R569	M566-E571 HydrophobicContact CE-CB 3.9Å; M566-E571 WeakPolarHBondContact CE-OE2 3.37Å; M566-E571 PolarHBondContact O-N 3.15Å; R569-E571 HydrophobicContact CB-CB 4.43Å; R569-E571 HydrophobicContact CB-CG 3.8Å; R569-E571 WeakPolarHBondContact CB-OE1 3.16Å; R569-E571 WeakPolarHBondContact CD-OE1 3.08Å; R569-E571 PolarHBondContact O-N 3.37Å
572	R	87.1	Confident	87.8	Confident	120 Å²	120	82.6 Å²	82.6	45%	0.453	41%	0.409	S	S	.	.			trans	-135.4	70.6	-176.8	-61.8	173.2	78.5	91.1	-0.5	110.6	G570 Y574 T582 Y583	G570-R572 WeakPolarHBondContact O-CG 3.32Å; G570-R572 PolarHBondContact O-N 2.79Å; R572-Y574 PolarHBondContact O-N 3.18Å; R572-Y574 VanDerWaalsContact O-N 3.08Å; R572-T582 WeakPolarHBondContact CB-OG1 3.47Å; R572-T582 WeakPolarHBondContact CD-OG1 3.46Å; R572-T582 PolarHBondContact NE-O 3.28Å; R572-T582 PolarHBondContact NE-OG1 3.24Å; R572-T582 PolarHBondContact NH2-O 3.34Å; R572-T582 WeakPolarHBondContact O-CB 3.49Å; R572-Y583 CarbonylContact C-O 3.5Å; R572-Y583 WeakPolarHBondContact CA-O 3.39Å
573	P	85.2	Confident	87.8	Confident	86 Å²	86	81.2 Å²	81.2	56%	0.558	40%	0.399	S	S	*	.			trans	-62.4	-22.4	-170.6	-23.6	35	0	0	0	114.6	M566 K575	M566-P573 HydrophobicContact CE-CG 4.46Å; P573-K575 PolarHBondContact O-N 2.97Å
574	Y	89.7	Confident	87.8	Confident	92 Å²	92	77.3 Å²	77.3	36%	0.361	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	86.4	-171.6	-56.2	-81.9	0	0	0	110.9	R572 T582 Y583 R585 K586	R572-Y574 PolarHBondContact O-N 3.18Å; R572-Y574 VanDerWaalsContact O-N 3.08Å; Y574-T582 CarbonylContact O-C 3.52Å; Y574-T582 WeakPolarHBondContact O-CA 3.41Å; Y574-Y583 WeakPolarHBondContact CB-O 3.43Å; Y574-Y583 WeakPolarHBondContact CD2-O 3.49Å; Y574-Y583 PolarHBondContact N-O 3.03Å; Y574-Y583 VanDerWaalsContact N-O 3.09Å; Y574-Y583 PolarHBondContact O-N 3.41Å; Y574-R585 VanDerWaalsContact CD2-C 3.48Å; Y574-K586 HydrophobicContact CD1-CB 3.87Å; Y574-K586 HydrophobicContact CD1-CG 4.23Å; Y574-K586 HydrophobicContact CE1-CB 3.58Å; Y574-K586 HydrophobicContact CE1-CD 4.34Å; Y574-K586 HydrophobicContact CE1-CG 4.09Å; Y574-K586 HydrophobicContact CG-CB 4.5Å
575	K	90.2	Very high	87.7	Confident	112 Å²	112	80.4 Å²	80.4	49%	0.487	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	138.9	174.6	-168.3	177.7	177.5	-175.8	0	111.6	P573 E580 T582 L589	P573-K575 PolarHBondContact O-N 2.97Å; K575-E580 WeakPolarHBondContact CE-OE1 3.32Å; K575-E580 IonicContact NZ-OE1 3.48Å; K575-E580 PolarHBondContact NZ-OE1 3.21Å; K575-T582 HydrophobicContact CB-CG2 4.19Å; K575-T582 HydrophobicContact CG-CG2 4.14Å; K575-L589 WeakPolarHBondContact O-CD2 3.23Å
576	C	91.3	Very high	87.8	Confident	0 Å²	0	83.7 Å²	83.7	0%	0	41%	0.414	C	S	.	.			trans	-81.2	128.3	165.4	-174.2	0	0	0	0	110.2	E578 E580 K581 L589 H592	C576-E578 VanDerWaalsContact C-N 3.34Å; C576-E578 PolarHBondContact O-N 3.09Å; C576-E580 WeakPolarHBondContact O-CA 3.5Å; C576-E580 PolarHBondContact O-N 2.83Å; C576-K581 WeakPolarHBondContact CB-O 3.49Å; C576-K581 PolarHBondContact N-O 3.26Å; C576-L589 HydrophobicContact CB-CD1 3.68Å; C576-H592 PolarHBondContact SG-NE2 3.32Å
577	S	88.9	Confident	87.9	Confident	99 Å²	99	86.5 Å²	86.5	69%	0.692	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.3	-37.1	176.2	42	0	0	0	0	113
578	E	87.2	Confident	88	Confident	110 Å²	110	85.5 Å²	85.5	51%	0.514	42%	0.416	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.5	-24.6	-167.9	-62.4	177.3	-112.6	0	0	115	C576 H596	C576-E578 VanDerWaalsContact C-N 3.34Å; C576-E578 PolarHBondContact O-N 3.09Å; E578-H596 WeakPolarHBondContact OE1-CB 3.31Å; E578-H596 IonicContact OE1-CD2 3.85Å; E578-H596 IonicContact OE1-CG 2.62Å; E578-H596 WeakPolarHBondContact OE2-CB 3.44Å; E578-H596 IonicContact OE2-CD2 3.97Å; E578-H596 IonicContact OE2-CE1 2.68Å; E578-H596 IonicContact OE2-CG 2.75Å; E578-H596 IonicContact OE2-ND1 3.27Å
579	C	89.4	Confident	88.2	Confident	37 Å²	37	82.9 Å²	82.9	25%	0.25	41%	0.405	C	S	.	.	T	Hydrogen-bonded Turn	trans	-142	18.5	177.6	73.5	0	0	0	0	114.2	K581 H592 H596	C579-K581 PolarHBondContact O-N 3.18Å; C579-H592 PolarHBondContact SG-CE1 2.94Å; C579-H592 PolarHBondContact SG-NE2 3.15Å; C579-H596 WeakPolarHBondContact CB-NE2 3.21Å; C579-H596 PolarHBondContact SG-NE2 3.07Å
580	E	86.5	Confident	88.4	Confident	127 Å²	127	79.3 Å²	79.3	59%	0.593	40%	0.395	S	S	*	.			trans	59.8	-2.3	173.9	-53.8	-151.7	108.6	0	0	117.2	K575 C576 T582	K575-E580 WeakPolarHBondContact CE-OE1 3.32Å; K575-E580 IonicContact NZ-OE1 3.48Å; K575-E580 PolarHBondContact NZ-OE1 3.21Å; C576-E580 WeakPolarHBondContact O-CA 3.5Å; C576-E580 PolarHBondContact O-N 2.83Å; E580-T582 PolarHBondContact O-N 2.85Å
581	K	88.5	Confident	88.8	Confident	117 Å²	117	77.7 Å²	77.7	51%	0.509	38%	0.375	S	S	.	.			trans	-60.9	121.3	178.8	-70.8	173.4	-167.5	163.9	0	110.4	C576 C579 Y583	C576-K581 WeakPolarHBondContact CB-O 3.49Å; C576-K581 PolarHBondContact N-O 3.26Å; C579-K581 PolarHBondContact O-N 3.18Å; K581-Y583 HydrophobicContact CB-CE2 3.78Å; K581-Y583 WeakPolarHBondContact O-CD2 3.44Å; K581-Y583 VanDerWaalsContact O-CE2 3.25Å; K581-Y583 WeakPolarHBondContact O-CE2 3.32Å
582	T	90.1	Very high	89.1	Confident	55 Å²	55	74.6 Å²	74.6	34%	0.337	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87	151.8	176.4	60.1	0	0	0	0	111.2	R572 Y574 K575 E580	R572-T582 WeakPolarHBondContact CB-OG1 3.47Å; R572-T582 WeakPolarHBondContact CD-OG1 3.46Å; R572-T582 PolarHBondContact NE-O 3.28Å; R572-T582 PolarHBondContact NE-OG1 3.24Å; R572-T582 PolarHBondContact NH2-O 3.34Å; R572-T582 WeakPolarHBondContact O-CB 3.49Å; Y574-T582 CarbonylContact O-C 3.52Å; Y574-T582 WeakPolarHBondContact O-CA 3.41Å; K575-T582 HydrophobicContact CB-CG2 4.19Å; K575-T582 HydrophobicContact CG-CG2 4.14Å; E580-T582 PolarHBondContact O-N 2.85Å
583	Y	89.9	Confident	89.3	Confident	43 Å²	43	71.9 Å²	71.9	17%	0.169	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	148.8	178.8	-65	-88	0	0	0	110.7	R572 Y574 K581 R585 H588 L589 H592	R572-Y583 CarbonylContact C-O 3.5Å; R572-Y583 WeakPolarHBondContact CA-O 3.39Å; Y574-Y583 WeakPolarHBondContact CB-O 3.43Å; Y574-Y583 WeakPolarHBondContact CD2-O 3.49Å; Y574-Y583 PolarHBondContact N-O 3.03Å; Y574-Y583 VanDerWaalsContact N-O 3.09Å; Y574-Y583 PolarHBondContact O-N 3.41Å; K581-Y583 HydrophobicContact CB-CE2 3.78Å; K581-Y583 WeakPolarHBondContact O-CD2 3.44Å; K581-Y583 VanDerWaalsContact O-CE2 3.25Å; K581-Y583 WeakPolarHBondContact O-CE2 3.32Å; Y583-R585 VanDerWaalsContact C-N 3.31Å; Y583-H588 HydrophobicContact CD1-CB 3.82Å; Y583-H588 HydrophobicContact CG-CB 4.29Å; Y583-L589 HydrophobicContact CD2-CB 4.12Å; Y583-L589 HydrophobicContact CD2-CD1 4.03Å; Y583-L589 HydrophobicContact CE2-CD1 4.36Å; Y583-L589 HydrophobicContact CG-CB 4.41Å; Y583-H592 HydrophobicContact CE1-CB 4.32Å; Y583-H592 HydrophobicContact CE2-CB 4Å; Y583-H592 AromaticContact CE2-CD2 3.24Å; Y583-H592 WeakPolarHBondContact CE2-CD2 3.26Å; Y583-H592 AromaticContact CE2-CG 3.73Å; Y583-H592 AromaticContact CZ-CD2 3.56Å; Y583-H592 AromaticContact CZ-CG 3.57Å; Y583-H592 PolarHBondContact OH-CD2 3.46Å; Y583-H592 VanDerWaalsContact OH-CD2 3.3Å; Y583-H592 PolarHBondContact OH-ND1 3.23Å
584	S	87.9	Confident	89.5	Confident	38 Å²	38	71.1 Å²	71.1	27%	0.266	34%	0.339	S	S	.	.	S	Bend	trans	-83.4	-2.3	175.3	55.9	0	0	0	0	114
585	R	88.1	Confident	89.5	Confident	89 Å²	89	72 Å²	72	34%	0.336	35%	0.349	S	S	.	.	S	Bend	trans	-145.2	136.7	178.5	-55.9	-173.3	-171.4	171.2	1	111.9	Y574 Y583 E587 H588 L589	Y574-R585 VanDerWaalsContact CD2-C 3.48Å; Y583-R585 VanDerWaalsContact C-N 3.31Å; R585-E587 VanDerWaalsContact C-N 3.27Å; R585-E587 PolarHBondContact O-N 2.9Å; R585-H588 HydrophobicContact CB-CB 4.4Å; R585-H588 WeakPolarHBondContact O-CB 3.34Å; R585-H588 PolarHBondContact O-N 2.88Å; R585-L589 PolarHBondContact O-N 3.45Å; R585-L589 VanDerWaalsContact O-N 3.17Å
586	K	90	Very high	89.5	Confident	125 Å²	125	70.9 Å²	70.9	54%	0.543	35%	0.346	S	S	.	.	H	α-helix	trans	-52.2	-42.6	173.2	-164.8	169.6	-177.8	171.2	0	112.9	Y574 H588 L589 Q590	Y574-K586 HydrophobicContact CD1-CB 3.87Å; Y574-K586 HydrophobicContact CD1-CG 4.23Å; Y574-K586 HydrophobicContact CE1-CB 3.58Å; Y574-K586 HydrophobicContact CE1-CD 4.34Å; Y574-K586 HydrophobicContact CE1-CG 4.09Å; Y574-K586 HydrophobicContact CG-CB 4.5Å; K586-H588 VanDerWaalsContact C-N 3.26Å; K586-H588 PolarHBondContact O-N 3.36Å; K586-L589 PolarHBondContact O-N 2.89Å; K586-Q590 WeakPolarHBondContact O-CG 3.46Å; K586-Q590 PolarHBondContact O-N 3.08Å
587	E	88.1	Confident	89.4	Confident	113 Å²	113	74.9 Å²	74.9	53%	0.528	37%	0.37	S	S	.	.	H	α-helix	trans	-60.4	-34	177	-163.8	-149.6	150.3	0	0	112.6	R585 N591	R585-E587 VanDerWaalsContact C-N 3.27Å; R585-E587 PolarHBondContact O-N 2.9Å; E587-N591 WeakPolarHBondContact O-CB 3.38Å; E587-N591 PolarHBondContact O-N 3.15Å; E587-N591 PolarHBondContact O-ND2 3.01Å
588	H	90	Very high	89.4	Confident	61 Å²	61	72.3 Å²	72.3	28%	0.282	36%	0.359	S	S	.	.	H	α-helix	trans	-76.3	-36.4	178.2	-64.1	-18.1	0	0	0	111.6	Y583 R585 K586 H592	Y583-H588 HydrophobicContact CD1-CB 3.82Å; Y583-H588 HydrophobicContact CG-CB 4.29Å; R585-H588 HydrophobicContact CB-CB 4.4Å; R585-H588 WeakPolarHBondContact O-CB 3.34Å; R585-H588 PolarHBondContact O-N 2.88Å; K586-H588 VanDerWaalsContact C-N 3.26Å; K586-H588 PolarHBondContact O-N 3.36Å; H588-H592 WeakPolarHBondContact O-CB 3.36Å; H588-H592 PolarHBondContact O-N 3.12Å; H588-H592 VanDerWaalsContact O-N 3.08Å
589	L	91	Very high	89.5	Confident	18 Å²	18	72 Å²	72	9%	0.094	36%	0.357	C	S	.	.	H	α-helix	trans	-62.3	-50.3	169.9	174.2	60.8	0	0	0	111.3	K575 C576 Y583 R585 K586 N591 H592 Q593	K575-L589 WeakPolarHBondContact O-CD2 3.23Å; C576-L589 HydrophobicContact CB-CD1 3.68Å; Y583-L589 HydrophobicContact CD2-CB 4.12Å; Y583-L589 HydrophobicContact CD2-CD1 4.03Å; Y583-L589 HydrophobicContact CE2-CD1 4.36Å; Y583-L589 HydrophobicContact CG-CB 4.41Å; R585-L589 PolarHBondContact O-N 3.45Å; R585-L589 VanDerWaalsContact O-N 3.17Å; K586-L589 PolarHBondContact O-N 2.89Å; L589-N591 PolarHBondContact O-N 3.42Å; L589-H592 CarbonylContact O-C 3.54Å; L589-H592 WeakPolarHBondContact O-CA 3.34Å; L589-H592 WeakPolarHBondContact O-CB 3.34Å; L589-H592 PolarHBondContact O-N 3.03Å; L589-Q593 HydrophobicContact CD1-CG 4.03Å; L589-Q593 HydrophobicContact CG-CG 4.36Å; L589-Q593 PolarHBondContact O-N 3.25Å
590	Q	91.2	Very high	89.5	Confident	98 Å²	98	76.8 Å²	76.8	46%	0.458	37%	0.37	S	S	.	.	H	α-helix	trans	-59	-45	178.3	-73.1	176.5	-35	0	0	112.5	K586 H592 Q593 R594	K586-Q590 WeakPolarHBondContact O-CG 3.46Å; K586-Q590 PolarHBondContact O-N 3.08Å; Q590-H592 PolarHBondContact O-N 2.88Å; Q590-Q593 PolarHBondContact O-N 2.97Å; Q590-R594 PolarHBondContact O-N 3.46Å
591	N	90.1	Very high	89.6	Confident	18 Å²	18	74.1 Å²	74.1	10%	0.096	36%	0.364	C	S	.	.	H	α-helix	trans	-66.8	-15.6	174.2	-80.9	-65.1	0	0	0	113.6	E587 L589	E587-N591 WeakPolarHBondContact O-CB 3.38Å; E587-N591 PolarHBondContact O-N 3.15Å; E587-N591 PolarHBondContact O-ND2 3.01Å; L589-N591 PolarHBondContact O-N 3.42Å
592	H	90.7	Very high	89.8	Confident	8 Å²	8	70.2 Å²	70.2	4%	0.037	35%	0.347	C	S	.	.	H	α-helix	trans	-90.6	-40.4	173.7	163.3	51.8	0	0	0	111.9	C576 C579 Y583 H588 L589 Q590 R594 L595 H596	C576-H592 PolarHBondContact SG-NE2 3.32Å; C579-H592 PolarHBondContact SG-CE1 2.94Å; C579-H592 PolarHBondContact SG-NE2 3.15Å; Y583-H592 HydrophobicContact CE1-CB 4.32Å; Y583-H592 HydrophobicContact CE2-CB 4Å; Y583-H592 AromaticContact CE2-CD2 3.24Å; Y583-H592 WeakPolarHBondContact CE2-CD2 3.26Å; Y583-H592 AromaticContact CE2-CG 3.73Å; Y583-H592 AromaticContact CZ-CD2 3.56Å; Y583-H592 AromaticContact CZ-CG 3.57Å; Y583-H592 PolarHBondContact OH-CD2 3.46Å; Y583-H592 VanDerWaalsContact OH-CD2 3.3Å; Y583-H592 PolarHBondContact OH-ND1 3.23Å; H588-H592 WeakPolarHBondContact O-CB 3.36Å; H588-H592 PolarHBondContact O-N 3.12Å; H588-H592 VanDerWaalsContact O-N 3.08Å; L589-H592 CarbonylContact O-C 3.54Å; L589-H592 WeakPolarHBondContact O-CA 3.34Å; L589-H592 WeakPolarHBondContact O-CB 3.34Å; L589-H592 PolarHBondContact O-N 3.03Å; Q590-H592 PolarHBondContact O-N 2.88Å; H592-R594 PolarHBondContact O-N 2.91Å; H592-L595 WeakPolarHBondContact O-CA 3.35Å; H592-L595 WeakPolarHBondContact O-CB 3.37Å; H592-L595 PolarHBondContact O-N 3.27Å; H592-H596 AromaticContact CE1-CD2 3.98Å
593	Q	90.3	Very high	89.9	Confident	63 Å²	63	73.6 Å²	73.6	29%	0.294	36%	0.359	S	S	.	.	H	α-helix	trans	-56.1	-36	173.9	-72.4	169.2	-52.4	0	0	111.7	L589 Q590 L595 H596 T597	L589-Q593 HydrophobicContact CD1-CG 4.03Å; L589-Q593 HydrophobicContact CG-CG 4.36Å; L589-Q593 PolarHBondContact O-N 3.25Å; Q590-Q593 PolarHBondContact O-N 2.97Å; Q593-L595 PolarHBondContact O-N 3.29Å; Q593-L595 VanDerWaalsContact O-N 3.09Å; Q593-H596 WeakPolarHBondContact O-CA 3.36Å; Q593-H596 WeakPolarHBondContact O-CB 3.45Å; Q593-H596 PolarHBondContact O-N 3.47Å; Q593-T597 PolarHBondContact O-N 2.61Å
594	R	91.2	Very high	90	Very high	71 Å²	71	71.6 Å²	71.6	27%	0.268	35%	0.351	S	S	.	.	H	α-helix	trans	-59.7	-15.3	170.3	-70.4	-175.4	178.5	151.6	6	115.9	Q590 H592 G598 E599 I612	Q590-R594 PolarHBondContact O-N 3.46Å; H592-R594 PolarHBondContact O-N 2.91Å; R594-G598 CarbonylContact O-C 3.29Å; R594-G598 PolarHBondContact O-N 2.87Å; R594-E599 HydrophobicContact CB-CB 4.32Å; R594-E599 HydrophobicContact CG-CB 4.04Å; R594-E599 IonicContact NE-OE2 3.51Å; R594-E599 PolarHBondContact O-N 3.04Å; R594-I612 HydrophobicContact CB-CG2 3.59Å; R594-I612 HydrophobicContact CG-CG2 4.38Å
595	L	89.5	Confident	90.2	Very high	111 Å²	111	74.7 Å²	74.7	58%	0.581	38%	0.379	S	S	*	.	H	α-helix	trans	-76.5	-29.1	170.3	-67.8	159.9	0	0	0	111.5	H592 Q593 I612	H592-L595 WeakPolarHBondContact O-CA 3.35Å; H592-L595 WeakPolarHBondContact O-CB 3.37Å; H592-L595 PolarHBondContact O-N 3.27Å; Q593-L595 PolarHBondContact O-N 3.29Å; Q593-L595 VanDerWaalsContact O-N 3.09Å; L595-I612 HydrophobicContact CD2-CD1 3.34Å; L595-I612 HydrophobicContact CG-CD1 3.77Å
596	H	89.7	Confident	90.1	Very high	88 Å²	88	76.6 Å²	76.6	41%	0.407	40%	0.395	S	S	.	.	H	α-helix	trans	-83.4	-50.2	177.6	-59.7	-62.7	0	0	0	111.5	E578 C579 H592 Q593 G598	E578-H596 WeakPolarHBondContact OE1-CB 3.31Å; E578-H596 IonicContact OE1-CD2 3.85Å; E578-H596 IonicContact OE1-CG 2.62Å; E578-H596 WeakPolarHBondContact OE2-CB 3.44Å; E578-H596 IonicContact OE2-CD2 3.97Å; E578-H596 IonicContact OE2-CE1 2.68Å; E578-H596 IonicContact OE2-CG 2.75Å; E578-H596 IonicContact OE2-ND1 3.27Å; C579-H596 WeakPolarHBondContact CB-NE2 3.21Å; C579-H596 PolarHBondContact SG-NE2 3.07Å; H592-H596 AromaticContact CE1-CD2 3.98Å; Q593-H596 WeakPolarHBondContact O-CA 3.36Å; Q593-H596 WeakPolarHBondContact O-CB 3.45Å; Q593-H596 PolarHBondContact O-N 3.47Å; H596-G598 PolarHBondContact O-N 2.85Å; H596-G598 VanDerWaalsContact O-N 3.15Å
597	T	89.1	Confident	90.2	Very high	84 Å²	84	73 Å²	73	52%	0.515	39%	0.386	S	S	.	.	S	Bend	trans	-67.8	-12.9	176.2	66.8	0	0	0	0	113.4	Q593 E599	Q593-T597 PolarHBondContact O-N 2.61Å; T597-E599 PolarHBondContact O-N 3.42Å; T597-E599 WeakPolarHBondContact OG1-CG 3.45Å; T597-E599 PolarHBondContact OG1-N 3.08Å
598	G	88.1	Confident	90.3	Very high	44 Å²	44	69.5 Å²	69.5	45%	0.454	38%	0.379	S	S	.	.			trans	72.8	-0.6	-176.8	0	0	0	0	0	114.6	R594 H596 R600	R594-G598 CarbonylContact O-C 3.29Å; R594-G598 PolarHBondContact O-N 2.87Å; H596-G598 PolarHBondContact O-N 2.85Å; H596-G598 VanDerWaalsContact O-N 3.15Å; G598-R600 WeakPolarHBondContact O-CG 3.47Å; G598-R600 PolarHBondContact O-N 3.41Å
599	E	89.3	Confident	90.3	Very high	104 Å²	104	72.7 Å²	72.7	49%	0.486	39%	0.392	S	S	.	.			trans	-56.6	124.2	-177.9	-81.4	-176.6	-171.1	0	0	113.1	R594 T597	R594-E599 HydrophobicContact CB-CB 4.32Å; R594-E599 HydrophobicContact CG-CB 4.04Å; R594-E599 IonicContact NE-OE2 3.51Å; R594-E599 PolarHBondContact O-N 3.04Å; T597-E599 PolarHBondContact O-N 3.42Å; T597-E599 WeakPolarHBondContact OG1-CG 3.45Å; T597-E599 PolarHBondContact OG1-N 3.08Å
600	R	90.6	Very high	90.3	Very high	137 Å²	137	73.8 Å²	73.8	52%	0.517	40%	0.401	S	S	.	.			trans	-128.8	74.9	178.8	-71.6	166.6	174.8	-123.6	9	111.6	G598 F602 S610 F611 I612	G598-R600 WeakPolarHBondContact O-CG 3.47Å; G598-R600 PolarHBondContact O-N 3.41Å; R600-F602 PolarHBondContact O-N 3.38Å; R600-F602 VanDerWaalsContact O-N 3.08Å; R600-S610 WeakPolarHBondContact CB-OG 3.5Å; R600-S610 WeakPolarHBondContact CD-O 3.42Å; R600-S610 WeakPolarHBondContact CD-OG 3.15Å; R600-S610 PolarHBondContact NH1-O 3.3Å; R600-F611 CarbonylContact C-O 3.58Å; R600-I612 HydrophobicContact CG-CG1 3.85Å
601	P	89.3	Confident	90.4	Very high	72 Å²	72	71 Å²	71	47%	0.468	39%	0.388	S	S	.	.			trans	-63.7	-19.1	-171.7	-23.5	34.9	0	0	0	115.1
602	F	91.8	Very high	90.4	Very high	34 Å²	34	71.2 Å²	71.2	15%	0.149	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	88.7	-173.2	-56.8	-74.8	0	0	0	111.1	P501 R600 F611 I612 R613 K614 L617	P501-F602 HydrophobicContact CB-CD1 4.48Å; P501-F602 HydrophobicContact CB-CE1 4.1Å; P501-F602 HydrophobicContact CG-CE1 4.18Å; R600-F602 PolarHBondContact O-N 3.38Å; R600-F602 VanDerWaalsContact O-N 3.08Å; F602-F611 HydrophobicContact CB-CB 4.41Å; F602-F611 WeakPolarHBondContact CB-O 3.49Å; F602-F611 PolarHBondContact N-O 3.2Å; F602-F611 PolarHBondContact O-N 3.33Å; F602-I612 WeakPolarHBondContact CD2-O 3.41Å; F602-I612 WeakPolarHBondContact CE2-O 3.25Å; F602-R613 VanDerWaalsContact CD2-C 3.48Å; F602-K614 HydrophobicContact CD1-CB 3.83Å; F602-K614 HydrophobicContact CD1-CG 4.19Å; F602-K614 HydrophobicContact CD2-CB 4.41Å; F602-K614 VanDerWaalsContact CD2-N 3.29Å; F602-K614 HydrophobicContact CE1-CB 3.7Å; F602-K614 HydrophobicContact CE1-CD 4.23Å; F602-K614 HydrophobicContact CE1-CG 4.19Å; F602-K614 HydrophobicContact CE2-CB 4.29Å; F602-K614 HydrophobicContact CG-CB 4.19Å; F602-K614 HydrophobicContact CZ-CB 3.94Å; F602-L617 HydrophobicContact CB-CB 4.04Å; F602-L617 HydrophobicContact CB-CD2 3.87Å
603	Q	92.7	Very high	90.4	Very high	127 Å²	127	75.9 Å²	75.9	59%	0.593	41%	0.406	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86	141.6	177.7	-159.9	175.9	21.9	0	0	112.9	G608	Q603-G608 VanDerWaalsContact CG-O 3.28Å; Q603-G608 WeakPolarHBondContact CG-O 3.37Å; Q603-G608 PolarHBondContact NE2-O 3.22Å
604	C	92	Very high	90.4	Very high	1 Å²	1	76 Å²	76	1%	0.007	41%	0.405	C	S	.	.			trans	-85.3	114.6	170	-171.9	0	0	0	0	110.9	L606 C607 G608 K609 L617 H624	C604-L606 PolarHBondContact O-N 2.86Å; C604-L606 VanDerWaalsContact O-N 3.15Å; C604-C607 PolarHBondContact O-N 3.06Å; C604-G608 WeakPolarHBondContact O-CA 3.48Å; C604-G608 PolarHBondContact O-N 2.87Å; C604-K609 WeakPolarHBondContact CB-O 3.43Å; C604-K609 PolarHBondContact N-O 2.88Å; C604-L617 HydrophobicContact CB-CD1 3.55Å; C604-H624 PolarHBondContact SG-NE2 2.95Å; C604-H624 VanDerWaalsContact SG-NE2 3.4Å
605	A	90.5	Very high	90.3	Very high	102 Å²	102	79.4 Å²	79.4	84%	0.843	42%	0.424	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.6	-27.1	179.3	0	0	0	0	0	114.4
606	L	87.2	Confident	90.4	Very high	130 Å²	130	77.4 Å²	77.4	68%	0.681	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.7	-15.7	-175	-62.4	176.5	0	0	0	114.4	C604 H624	C604-L606 PolarHBondContact O-N 2.86Å; C604-L606 VanDerWaalsContact O-N 3.15Å; L606-H624 HydrophobicContact CD1-CB 3.51Å
607	C	91.2	Very high	90.5	Very high	50 Å²	50	74.1 Å²	74.1	34%	0.338	40%	0.4	S	S	.	.	T	Hydrogen-bonded Turn	trans	-147.7	7.2	-175.9	71.3	0	0	0	0	114.9	C604 K609 H620	C604-C607 PolarHBondContact O-N 3.06Å; C607-K609 PolarHBondContact O-N 3.4Å; C607-H620 PolarHBondContact SG-NE2 3.36Å
608	G	90	Very high	90.5	Very high	38 Å²	38	74.6 Å²	74.6	39%	0.392	40%	0.399	S	S	.	.			trans	68.5	-8.5	-179.4	0	0	0	0	0	116	Q603 C604 S610	Q603-G608 VanDerWaalsContact CG-O 3.28Å; Q603-G608 WeakPolarHBondContact CG-O 3.37Å; Q603-G608 PolarHBondContact NE2-O 3.22Å; C604-G608 WeakPolarHBondContact O-CA 3.48Å; C604-G608 PolarHBondContact O-N 2.87Å; G608-S610 PolarHBondContact O-N 3.29Å
609	K	91	Very high	90.6	Very high	129 Å²	129	76.3 Å²	76.3	56%	0.561	39%	0.393	S	S	*	.			trans	-65.3	126.4	-176.5	-67.6	-177	-179.6	-175.6	0	111.4	C604 C607 F611	C604-K609 WeakPolarHBondContact CB-O 3.43Å; C604-K609 PolarHBondContact N-O 2.88Å; C607-K609 PolarHBondContact O-N 3.4Å; K609-F611 HydrophobicContact CB-CE2 3.98Å; K609-F611 HydrophobicContact CB-CZ 4.1Å; K609-F611 WeakPolarHBondContact O-CE2 3.22Å
610	S	91.8	Very high	90.7	Very high	40 Å²	40	72.2 Å²	72.2	28%	0.28	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	142.2	-177	61.5	0	0	0	0	112.7	R600 G608	R600-S610 WeakPolarHBondContact CB-OG 3.5Å; R600-S610 WeakPolarHBondContact CD-O 3.42Å; R600-S610 WeakPolarHBondContact CD-OG 3.15Å; R600-S610 PolarHBondContact NH1-O 3.3Å; G608-S610 PolarHBondContact O-N 3.29Å
611	F	91.4	Very high	90.7	Very high	40 Å²	40	69.1 Å²	69.1	18%	0.175	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	148.4	-174.7	-59.1	-86.8	0	0	0	111.8	R600 F602 K609 N616 L617 H620	R600-F611 CarbonylContact C-O 3.58Å; F602-F611 HydrophobicContact CB-CB 4.41Å; F602-F611 WeakPolarHBondContact CB-O 3.49Å; F602-F611 PolarHBondContact N-O 3.2Å; F602-F611 PolarHBondContact O-N 3.33Å; K609-F611 HydrophobicContact CB-CE2 3.98Å; K609-F611 HydrophobicContact CB-CZ 4.1Å; K609-F611 WeakPolarHBondContact O-CE2 3.22Å; F611-N616 HydrophobicContact CB-CB 4.18Å; F611-N616 HydrophobicContact CD1-CB 3.92Å; F611-N616 HydrophobicContact CG-CB 4.25Å; F611-L617 HydrophobicContact CB-CB 4.49Å; F611-L617 HydrophobicContact CD2-CB 4.02Å; F611-L617 HydrophobicContact CD2-CD1 4.04Å; F611-L617 HydrophobicContact CE2-CD1 4.23Å; F611-L617 HydrophobicContact CG-CB 4.49Å; F611-H620 HydrophobicContact CE1-CB 4.17Å; F611-H620 HydrophobicContact CE2-CB 3.78Å; F611-H620 AromaticContact CE2-CD2 3.61Å; F611-H620 AromaticContact CE2-CG 3.59Å; F611-H620 HydrophobicContact CZ-CB 3.49Å; F611-H620 VanDerWaalsContact CZ-CB 3.49Å; F611-H620 AromaticContact CZ-CD2 3.79Å; F611-H620 AromaticContact CZ-CG 3.31Å; F611-H620 AromaticContact CZ-ND1 3.69Å
612	I	90.7	Very high	90.7	Very high	22 Å²	22	67.2 Å²	67.2	11%	0.113	35%	0.349	C	S	.	.	S	Bend	trans	-73.4	-31.4	178.6	-60.5	178.7	0	0	0	112.2	R594 L595 R600 F602	R594-I612 HydrophobicContact CB-CG2 3.59Å; R594-I612 HydrophobicContact CG-CG2 4.38Å; L595-I612 HydrophobicContact CD2-CD1 3.34Å; L595-I612 HydrophobicContact CG-CD1 3.77Å; R600-I612 HydrophobicContact CG-CG1 3.85Å; F602-I612 WeakPolarHBondContact CD2-O 3.41Å; F602-I612 WeakPolarHBondContact CE2-O 3.25Å
613	R	91.1	Very high	90.7	Very high	106 Å²	106	69.1 Å²	69.1	40%	0.4	36%	0.36	S	S	.	.	S	Bend	trans	-123.2	134.3	-175.7	-59.8	-177.1	-171.7	169.2	1.8	111.2	F602 Q615 N616 L617	F602-R613 VanDerWaalsContact CD2-C 3.48Å; R613-Q615 PolarHBondContact O-N 3Å; R613-N616 WeakPolarHBondContact O-CB 3.43Å; R613-N616 PolarHBondContact O-N 2.89Å; R613-L617 PolarHBondContact O-N 3.48Å
614	K	90	Very high	90.5	Very high	66 Å²	66	66.5 Å²	66.5	29%	0.287	35%	0.348	S	S	.	.	H	α-helix	trans	-53.9	-37.8	176.2	-172.2	169.7	175.9	172.1	0	113.4	G497 F602 N616 L617 L618	G497-K614 PolarHBondContact O-NZ 2.78Å; F602-K614 HydrophobicContact CD1-CB 3.83Å; F602-K614 HydrophobicContact CD1-CG 4.19Å; F602-K614 HydrophobicContact CD2-CB 4.41Å; F602-K614 VanDerWaalsContact CD2-N 3.29Å; F602-K614 HydrophobicContact CE1-CB 3.7Å; F602-K614 HydrophobicContact CE1-CD 4.23Å; F602-K614 HydrophobicContact CE1-CG 4.19Å; F602-K614 HydrophobicContact CE2-CB 4.29Å; F602-K614 HydrophobicContact CG-CB 4.19Å; F602-K614 HydrophobicContact CZ-CB 3.94Å; K614-N616 VanDerWaalsContact C-N 3.27Å; K614-N616 PolarHBondContact O-N 3.01Å; K614-L617 WeakPolarHBondContact O-CB 3.49Å; K614-L617 PolarHBondContact O-N 3.3Å; K614-L618 WeakPolarHBondContact O-CG 3.41Å; K614-L618 PolarHBondContact O-N 3.25Å
615	Q	88.8	Confident	90.3	Very high	142 Å²	142	70.3 Å²	70.3	66%	0.664	37%	0.371	S	S	*	.	H	α-helix	trans	-60.9	-34.6	176.4	-65.8	176.1	-1	0	0	112.7	R613 L618 K619	R613-Q615 PolarHBondContact O-N 3Å; Q615-L618 PolarHBondContact O-N 3.06Å; Q615-K619 WeakPolarHBondContact O-CB 3.48Å; Q615-K619 WeakPolarHBondContact O-CG 3.3Å; Q615-K619 PolarHBondContact O-N 3.09Å
616	N	91.1	Very high	90.2	Very high	70 Å²	70	67.2 Å²	67.2	37%	0.374	35%	0.349	S	S	.	.	H	α-helix	trans	-72.7	-37.1	177.2	-66.5	-2.1	0	0	0	111	F611 R613 K614 K619 H620	F611-N616 HydrophobicContact CB-CB 4.18Å; F611-N616 HydrophobicContact CD1-CB 3.92Å; F611-N616 HydrophobicContact CG-CB 4.25Å; R613-N616 WeakPolarHBondContact O-CB 3.43Å; R613-N616 PolarHBondContact O-N 2.89Å; K614-N616 VanDerWaalsContact C-N 3.27Å; K614-N616 PolarHBondContact O-N 3.01Å; N616-K619 PolarHBondContact O-N 3.04Å; N616-H620 VanDerWaalsContact O-CB 3.22Å; N616-H620 WeakPolarHBondContact O-CB 3.43Å; N616-H620 PolarHBondContact O-N 3.49Å
617	L	91.9	Very high	90.3	Very high	19 Å²	19	65.7 Å²	65.7	10%	0.099	34%	0.338	C	S	.	.	H	α-helix	trans	-61.2	-46.5	171.1	172.9	61.1	0	0	0	111.5	F602 C604 F611 R613 K614 H620 Q621	F602-L617 HydrophobicContact CB-CB 4.04Å; F602-L617 HydrophobicContact CB-CD2 3.87Å; C604-L617 HydrophobicContact CB-CD1 3.55Å; F611-L617 HydrophobicContact CB-CB 4.49Å; F611-L617 HydrophobicContact CD2-CB 4.02Å; F611-L617 HydrophobicContact CD2-CD1 4.04Å; F611-L617 HydrophobicContact CE2-CD1 4.23Å; F611-L617 HydrophobicContact CG-CB 4.49Å; R613-L617 PolarHBondContact O-N 3.48Å; K614-L617 WeakPolarHBondContact O-CB 3.49Å; K614-L617 PolarHBondContact O-N 3.3Å; L617-H620 CarbonylContact O-C 3.56Å; L617-H620 WeakPolarHBondContact O-CA 3.42Å; L617-H620 WeakPolarHBondContact O-CB 3.47Å; L617-H620 PolarHBondContact O-N 2.93Å; L617-H620 VanDerWaalsContact O-N 3.13Å; L617-Q621 HydrophobicContact CD1-CG 4.15Å; L617-Q621 WeakPolarHBondContact O-CG 3.18Å; L617-Q621 PolarHBondContact O-N 3.49Å
618	L	90.8	Very high	90.3	Very high	94 Å²	94	69.5 Å²	69.5	49%	0.492	35%	0.346	S	S	.	.	H	α-helix	trans	-62.4	-46.8	176.5	-66.7	172	0	0	0	111.7	K614 Q615 H620 Q621	K614-L618 WeakPolarHBondContact O-CG 3.41Å; K614-L618 PolarHBondContact O-N 3.25Å; Q615-L618 PolarHBondContact O-N 3.06Å; L618-H620 PolarHBondContact O-N 3.39Å; L618-Q621 PolarHBondContact O-N 3.21Å
619	K	89.3	Confident	90.2	Very high	79 Å²	79	71.2 Å²	71.2	34%	0.343	35%	0.35	S	S	.	.	H	α-helix	trans	-57.5	-34.1	173.1	-78.3	-167.5	178.1	-166.5	0	112	Q615 N616 Y641 E643	Q615-K619 WeakPolarHBondContact O-CB 3.48Å; Q615-K619 WeakPolarHBondContact O-CG 3.3Å; Q615-K619 PolarHBondContact O-N 3.09Å; N616-K619 PolarHBondContact O-N 3.04Å; K619-Y641 HydrophobicContact CB-CE1 4.31Å; K619-Y641 PolarHBondContact O-OH 3.34Å; K619-E643 IonicContact NZ-OE1 3.87Å; K619-E643 PolarHBondContact NZ-OE1 3.23Å
620	H	90.7	Very high	90.2	Very high	18 Å²	18	68.5 Å²	68.5	8%	0.083	34%	0.337	C	S	.	.	H	α-helix	trans	-75.7	-38.9	177.2	173	71.9	0	0	0	113	C607 F611 N616 L617 L618 R622 I623 H624	C607-H620 PolarHBondContact SG-NE2 3.36Å; F611-H620 HydrophobicContact CE1-CB 4.17Å; F611-H620 HydrophobicContact CE2-CB 3.78Å; F611-H620 AromaticContact CE2-CD2 3.61Å; F611-H620 AromaticContact CE2-CG 3.59Å; F611-H620 HydrophobicContact CZ-CB 3.49Å; F611-H620 VanDerWaalsContact CZ-CB 3.49Å; F611-H620 AromaticContact CZ-CD2 3.79Å; F611-H620 AromaticContact CZ-CG 3.31Å; F611-H620 AromaticContact CZ-ND1 3.69Å; N616-H620 VanDerWaalsContact O-CB 3.22Å; N616-H620 WeakPolarHBondContact O-CB 3.43Å; N616-H620 PolarHBondContact O-N 3.49Å; L617-H620 CarbonylContact O-C 3.56Å; L617-H620 WeakPolarHBondContact O-CA 3.42Å; L617-H620 WeakPolarHBondContact O-CB 3.47Å; L617-H620 PolarHBondContact O-N 2.93Å; L617-H620 VanDerWaalsContact O-N 3.13Å; L618-H620 PolarHBondContact O-N 3.39Å; H620-R622 PolarHBondContact O-N 3.11Å; H620-I623 WeakPolarHBondContact O-CB 3.46Å; H620-I623 VanDerWaalsContact O-CG1 3.29Å; H620-I623 WeakPolarHBondContact O-CG1 3.36Å; H620-I623 PolarHBondContact O-N 2.84Å; H620-H624 AromaticContact CD2-NE2 3.92Å; H620-H624 AromaticContact CE1-NE2 3.88Å; H620-H624 AromaticContact NE2-CD2 3.97Å; H620-H624 AromaticContact NE2-CE1 3.97Å; H620-H624 AromaticContact NE2-NE2 3.13Å; H620-H624 PolarHBondContact NE2-NE2 2.86Å; H620-H624 VanDerWaalsContact NE2-NE2 3.13Å
621	Q	90.6	Very high	90.2	Very high	72 Å²	72	71 Å²	71	34%	0.336	35%	0.351	S	S	.	.	H	α-helix	trans	-59.3	-29.9	179.5	-80.4	172.8	-37.5	0	0	112.9	L617 L618 I623 H624 T625	L617-Q621 HydrophobicContact CD1-CG 4.15Å; L617-Q621 WeakPolarHBondContact O-CG 3.18Å; L617-Q621 PolarHBondContact O-N 3.49Å; L618-Q621 PolarHBondContact O-N 3.21Å; Q621-I623 PolarHBondContact O-N 3.36Å; Q621-H624 WeakPolarHBondContact O-CB 3.48Å; Q621-H624 PolarHBondContact O-N 3.42Å; Q621-T625 PolarHBondContact O-N 3.5Å
622	R	90.7	Very high	90.2	Very high	32 Å²	32	69.2 Å²	69.2	12%	0.121	34%	0.343	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.5	-15.9	170.9	-60.5	-168.6	-62.9	-158.3	5.4	114.5	H620 H624 T625 G626 E627 R640	H620-R622 PolarHBondContact O-N 3.11Å; R622-H624 VanDerWaalsContact C-N 3.35Å; R622-T625 WeakPolarHBondContact CA-OG1 3.37Å; R622-G626 PolarHBondContact O-N 3.11Å; R622-E627 HydrophobicContact CB-CB 4.27Å; R622-E627 HydrophobicContact CG-CB 4.17Å; R622-R640 HydrophobicContact CB-CG 3.91Å; R622-R640 PolarHBondContact NE-O 2.83Å; R622-R640 PolarHBondContact NH2-O 3.5Å; R622-R640 PolarHBondContact O-NE 3.01Å; R622-R640 PolarHBondContact O-NH2 3.19Å; R622-R640 VanDerWaalsContact O-NH2 3.11Å
623	I	90.2	Very high	90.1	Very high	74 Å²	74	72.3 Å²	72.3	38%	0.379	38%	0.38	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.5	-39.3	170	-59.6	-179.9	0	0	0	110.7	H620 Q621 R640	H620-I623 WeakPolarHBondContact O-CB 3.46Å; H620-I623 VanDerWaalsContact O-CG1 3.29Å; H620-I623 WeakPolarHBondContact O-CG1 3.36Å; H620-I623 PolarHBondContact O-N 2.84Å; Q621-I623 PolarHBondContact O-N 3.36Å; I623-R640 PolarHBondContact O-NH2 2.92Å
624	H	89.7	Confident	89.9	Confident	72 Å²	72	73.2 Å²	73.2	33%	0.333	39%	0.389	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.6	-42.1	-178.9	-54	-57	0	0	0	112.6	C604 L606 H620 Q621 R622 G626	C604-H624 PolarHBondContact SG-NE2 2.95Å; C604-H624 VanDerWaalsContact SG-NE2 3.4Å; L606-H624 HydrophobicContact CD1-CB 3.51Å; H620-H624 AromaticContact CD2-NE2 3.92Å; H620-H624 AromaticContact CE1-NE2 3.88Å; H620-H624 AromaticContact NE2-CD2 3.97Å; H620-H624 AromaticContact NE2-CE1 3.97Å; H620-H624 AromaticContact NE2-NE2 3.13Å; H620-H624 PolarHBondContact NE2-NE2 2.86Å; H620-H624 VanDerWaalsContact NE2-NE2 3.13Å; Q621-H624 WeakPolarHBondContact O-CB 3.48Å; Q621-H624 PolarHBondContact O-N 3.42Å; R622-H624 VanDerWaalsContact C-N 3.35Å; H624-G626 PolarHBondContact O-N 2.99Å
625	T	88.6	Confident	89.8	Confident	81 Å²	81	72.5 Å²	72.5	50%	0.497	39%	0.392	S	S	.	.	S	Bend	trans	-73.7	-10	177.4	65.8	0	0	0	0	113.3	Q621 R622 E627	Q621-T625 PolarHBondContact O-N 3.5Å; R622-T625 WeakPolarHBondContact CA-OG1 3.37Å; T625-E627 VanDerWaalsContact CB-OE1 3.25Å; T625-E627 WeakPolarHBondContact CB-OE1 3.43Å; T625-E627 PolarHBondContact O-N 2.92Å; T625-E627 VanDerWaalsContact O-N 3.15Å; T625-E627 WeakPolarHBondContact OG1-CG 3.42Å; T625-E627 PolarHBondContact OG1-OE1 3.4Å
626	G	87.5	Confident	89.8	Confident	37 Å²	37	68.4 Å²	68.4	38%	0.381	39%	0.387	S	S	.	.			trans	77.9	-13.6	-178.9	0	0	0	0	0	114.6	R622 H624 R628	R622-G626 PolarHBondContact O-N 3.11Å; H624-G626 PolarHBondContact O-N 2.99Å; G626-R628 WeakPolarHBondContact O-CG 3.45Å
627	E	89.4	Confident	89.8	Confident	98 Å²	98	71 Å²	71	46%	0.458	40%	0.395	S	S	.	.			trans	-46.9	137.1	-173.3	-76.8	162	-128.1	0	0	115	R622 T625 P629	R622-E627 HydrophobicContact CB-CB 4.27Å; R622-E627 HydrophobicContact CG-CB 4.17Å; T625-E627 VanDerWaalsContact CB-OE1 3.25Å; T625-E627 WeakPolarHBondContact CB-OE1 3.43Å; T625-E627 PolarHBondContact O-N 2.92Å; T625-E627 VanDerWaalsContact O-N 3.15Å; T625-E627 WeakPolarHBondContact OG1-CG 3.42Å; T625-E627 PolarHBondContact OG1-OE1 3.4Å; E627-P629 HydrophobicContact CB-CG 4.46Å
628	R	90.2	Very high	89.7	Confident	130 Å²	130	71.9 Å²	71.9	49%	0.491	40%	0.403	S	S	.	.			trans	-133.2	70.1	178.7	-58.4	174.9	77	111.2	-0.2	110.8	G626 Y630 S638 F639	G626-R628 WeakPolarHBondContact O-CG 3.45Å; R628-Y630 PolarHBondContact O-N 3.07Å; R628-Y630 VanDerWaalsContact O-N 3.11Å; R628-S638 WeakPolarHBondContact CB-OG 3.4Å; R628-S638 WeakPolarHBondContact CD-OG 3.47Å; R628-S638 PolarHBondContact NE-O 3.36Å; R628-S638 PolarHBondContact NE-OG 3.23Å; R628-S638 PolarHBondContact NH2-O 3.36Å; R628-F639 CarbonylContact C-O 3.4Å; R628-F639 VanDerWaalsContact CA-O 3.27Å; R628-F639 WeakPolarHBondContact CA-O 3.27Å
629	P	88.3	Confident	89.7	Confident	74 Å²	74	69 Å²	69	48%	0.481	39%	0.387	S	S	.	.			trans	-70.2	-9.5	-168.2	-20.1	34.6	0	0	0	115.4	E627	E627-P629 HydrophobicContact CB-CG 4.46Å
630	Y	91.2	Very high	89.7	Confident	72 Å²	72	68.2 Å²	68.2	28%	0.282	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	94.4	-174.5	-54.1	-75.9	0	0	0	110.1	R628 S638 F639 K642	R628-Y630 PolarHBondContact O-N 3.07Å; R628-Y630 VanDerWaalsContact O-N 3.11Å; Y630-S638 CarbonylContact O-C 3.54Å; Y630-S638 WeakPolarHBondContact O-CA 3.44Å; Y630-F639 WeakPolarHBondContact CD2-O 3.47Å; Y630-F639 PolarHBondContact N-O 2.8Å; Y630-F639 VanDerWaalsContact N-O 3.13Å; Y630-F639 PolarHBondContact O-N 2.64Å; Y630-K642 HydrophobicContact CD1-CB 4.17Å; Y630-K642 HydrophobicContact CE1-CB 3.91Å; Y630-K642 HydrophobicContact CE1-CG 4.48Å; Y630-K642 HydrophobicContact CE2-CB 4.44Å
631	T	92	Very high	89.6	Confident	93 Å²	93	70.4 Å²	70.4	57%	0.571	39%	0.39	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84	141.6	174.1	42.8	0	0	0	0	111.6
632	C	91.5	Very high	89.6	Confident	3 Å²	3	72.4 Å²	72.4	2%	0.02	40%	0.397	C	S	.	.			trans	-79.7	123.8	166	-176.7	0	0	0	0	109.4	E634 G636 K637 F639 L645 H648	C632-E634 VanDerWaalsContact C-N 3.25Å; C632-E634 PolarHBondContact O-N 3.22Å; C632-G636 VanDerWaalsContact O-CA 3.26Å; C632-G636 WeakPolarHBondContact O-CA 3.46Å; C632-G636 PolarHBondContact O-N 3.29Å; C632-K637 PolarHBondContact N-O 3.06Å; C632-F639 HydrophobicContact CB-CE2 4.45Å; C632-L645 HydrophobicContact CB-CD1 3.78Å; C632-H648 PolarHBondContact SG-NE2 3Å; C632-H648 VanDerWaalsContact SG-NE2 3.37Å
633	G	89.5	Confident	89.5	Confident	86 Å²	86	75.4 Å²	75.4	89%	0.887	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.9	-26.9	176.8	0	0	0	0	0	113.6
634	E	85.7	Confident	89.5	Confident	126 Å²	126	74.1 Å²	74.1	59%	0.589	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.3	-24.4	-174.3	-64.2	-179.2	-126	0	0	114.3	C632 H652	C632-E634 VanDerWaalsContact C-N 3.25Å; C632-E634 PolarHBondContact O-N 3.22Å; E634-H652 WeakPolarHBondContact CB-CE1 3.32Å; E634-H652 WeakPolarHBondContact CB-ND1 3.4Å; E634-H652 IonicContact OE1-CG 2.66Å; E634-H652 VanDerWaalsContact OE2-CB 3.32Å; E634-H652 WeakPolarHBondContact OE2-CB 3.31Å; E634-H652 IonicContact OE2-CE1 3.38Å; E634-H652 IonicContact OE2-CG 3.67Å; E634-H652 VanDerWaalsContact OE2-CG 3.27Å; E634-H652 IonicContact OE2-ND1 3.9Å; E634-H652 PolarHBondContact OE2-ND1 3.49Å
635	C	89.2	Confident	89.5	Confident	51 Å²	51	72 Å²	72	35%	0.345	40%	0.401	S	S	.	.	T	Hydrogen-bonded Turn	trans	-139.2	10.3	178.9	71.6	0	0	0	0	115.4	K637 H648 H652	C635-K637 PolarHBondContact O-N 3.47Å; C635-K637 VanDerWaalsContact SG-CG 3.6Å; C635-H648 VanDerWaalsContact SG-CE1 3.52Å; C635-H648 PolarHBondContact SG-NE2 2.69Å; C635-H652 PolarHBondContact SG-NE2 2.76Å; C635-H652 VanDerWaalsContact SG-NE2 3.39Å
636	G	88.6	Confident	89.6	Confident	55 Å²	55	74.6 Å²	74.6	57%	0.567	41%	0.405	S	S	*	.			trans	68.6	-8.1	177.7	0	0	0	0	0	115.9	C632 S638	C632-G636 VanDerWaalsContact O-CA 3.26Å; C632-G636 WeakPolarHBondContact O-CA 3.46Å; C632-G636 PolarHBondContact O-N 3.29Å; G636-S638 PolarHBondContact O-N 3.38Å
637	K	89.4	Confident	89.7	Confident	124 Å²	124	76 Å²	76	54%	0.539	40%	0.404	S	S	.	.			trans	-60.3	123.1	-178.4	-70.6	176.3	-172	168.6	0	110.6	C632 C635 F639	C632-K637 PolarHBondContact N-O 3.06Å; C635-K637 PolarHBondContact O-N 3.47Å; C635-K637 VanDerWaalsContact SG-CG 3.6Å; K637-F639 HydrophobicContact CB-CE2 3.68Å; K637-F639 HydrophobicContact CB-CZ 3.92Å; K637-F639 WeakPolarHBondContact O-CD2 3.41Å; K637-F639 WeakPolarHBondContact O-CE2 3.35Å
638	S	91	Very high	89.6	Confident	39 Å²	39	72.2 Å²	72.2	27%	0.273	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	146.1	176.8	65.8	0	0	0	0	111.7	R628 Y630 G636	R628-S638 WeakPolarHBondContact CB-OG 3.4Å; R628-S638 WeakPolarHBondContact CD-OG 3.47Å; R628-S638 PolarHBondContact NE-O 3.36Å; R628-S638 PolarHBondContact NE-OG 3.23Å; R628-S638 PolarHBondContact NH2-O 3.36Å; Y630-S638 CarbonylContact O-C 3.54Å; Y630-S638 WeakPolarHBondContact O-CA 3.44Å; G636-S638 PolarHBondContact O-N 3.38Å
639	F	90	Very high	89.5	Confident	34 Å²	34	69 Å²	69	15%	0.149	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	148.8	-178.9	-62.1	-90.4	0	0	0	111.3	R628 Y630 C632 K637 L645 H648	R628-F639 CarbonylContact C-O 3.4Å; R628-F639 VanDerWaalsContact CA-O 3.27Å; R628-F639 WeakPolarHBondContact CA-O 3.27Å; Y630-F639 WeakPolarHBondContact CD2-O 3.47Å; Y630-F639 PolarHBondContact N-O 2.8Å; Y630-F639 VanDerWaalsContact N-O 3.13Å; Y630-F639 PolarHBondContact O-N 2.64Å; C632-F639 HydrophobicContact CB-CE2 4.45Å; K637-F639 HydrophobicContact CB-CE2 3.68Å; K637-F639 HydrophobicContact CB-CZ 3.92Å; K637-F639 WeakPolarHBondContact O-CD2 3.41Å; K637-F639 WeakPolarHBondContact O-CE2 3.35Å; F639-L645 HydrophobicContact CB-CB 4.38Å; F639-L645 HydrophobicContact CD2-CB 4.16Å; F639-L645 HydrophobicContact CD2-CD1 3.94Å; F639-L645 HydrophobicContact CE2-CD1 4.16Å; F639-L645 HydrophobicContact CG-CB 4.42Å; F639-H648 HydrophobicContact CE1-CB 4Å; F639-H648 HydrophobicContact CE2-CB 3.99Å; F639-H648 AromaticContact CE2-CD2 3.22Å; F639-H648 WeakPolarHBondContact CE2-CD2 3.33Å; F639-H648 AromaticContact CE2-CG 3.69Å; F639-H648 AromaticContact CE2-NE2 3.99Å; F639-H648 HydrophobicContact CZ-CB 3.51Å; F639-H648 AromaticContact CZ-CD2 3.35Å; F639-H648 WeakPolarHBondContact CZ-CD2 3.3Å; F639-H648 AromaticContact CZ-CG 3.32Å
640	R	89	Confident	89.5	Confident	62 Å²	62	70.5 Å²	70.5	23%	0.234	38%	0.375	C	S	.	.	S	Bend	trans	-78.3	-19.4	179	-174.6	173.5	-71.2	154.6	-10.5	113.6	R622 I623	R622-R640 HydrophobicContact CB-CG 3.91Å; R622-R640 PolarHBondContact NE-O 2.83Å; R622-R640 PolarHBondContact NH2-O 3.5Å; R622-R640 PolarHBondContact O-NE 3.01Å; R622-R640 PolarHBondContact O-NH2 3.19Å; R622-R640 VanDerWaalsContact O-NH2 3.11Å; I623-R640 PolarHBondContact O-NH2 2.92Å
641	Y	90.2	Very high	89.1	Confident	64 Å²	64	70.8 Å²	70.8	25%	0.251	38%	0.384	S	S	.	.	S	Bend	trans	-135.6	142.5	-173.5	-55.8	-57.7	0	0	0	110.3	K619 E643 S644 L645	K619-Y641 HydrophobicContact CB-CE1 4.31Å; K619-Y641 PolarHBondContact O-OH 3.34Å; Y641-E643 WeakPolarHBondContact CB-OE2 3.44Å; Y641-E643 PolarHBondContact O-N 3.44Å; Y641-S644 PolarHBondContact O-N 3.32Å; Y641-L645 PolarHBondContact O-N 3.47Å
642	K	89.5	Confident	88.8	Confident	113 Å²	113	69.5 Å²	69.5	49%	0.491	37%	0.371	S	S	.	.	H	α-helix	trans	-63.8	-34.5	178.6	-175.4	-174.1	178.3	-170.3	0	110.2	D478 Y630 L645 K646	D478-K642 IonicContact OD1-NZ 3.89Å; Y630-K642 HydrophobicContact CD1-CB 4.17Å; Y630-K642 HydrophobicContact CE1-CB 3.91Å; Y630-K642 HydrophobicContact CE1-CG 4.48Å; Y630-K642 HydrophobicContact CE2-CB 4.44Å; K642-L645 PolarHBondContact O-N 2.8Å; K642-K646 WeakPolarHBondContact O-CB 3.45Å; K642-K646 PolarHBondContact O-N 3.21Å
643	E	89	Confident	88.3	Confident	96 Å²	96	74.1 Å²	74.1	45%	0.449	40%	0.404	S	S	.	.	H	α-helix	trans	-60.1	-47.4	176.8	-56.6	86.1	161.4	0	0	110.5	K619 Y641 L645 K646 D647	K619-E643 IonicContact NZ-OE1 3.87Å; K619-E643 PolarHBondContact NZ-OE1 3.23Å; Y641-E643 WeakPolarHBondContact CB-OE2 3.44Å; Y641-E643 PolarHBondContact O-N 3.44Å; E643-L645 PolarHBondContact O-N 3.23Å; E643-K646 PolarHBondContact O-N 3.11Å; E643-D647 PolarHBondContact O-N 3.29Å
644	S	90	Very high	87.3	Confident	47 Å²	47	73.4 Å²	73.4	33%	0.329	40%	0.396	S	S	.	.	H	α-helix	trans	-66.3	-34.3	175.5	-52.9	0	0	0	0	113.5	Y641 H648	Y641-S644 PolarHBondContact O-N 3.32Å; S644-H648 VanDerWaalsContact O-CB 3.31Å; S644-H648 WeakPolarHBondContact O-CB 3.37Å; S644-H648 PolarHBondContact O-N 3.1Å
645	L	90.6	Very high	85.8	Confident	27 Å²	27	68.6 Å²	68.6	14%	0.141	38%	0.38	C	S	.	.	H	α-helix	trans	-65.7	-44.8	170.5	175	61.6	0	0	0	110.7	C632 F639 Y641 K642 E643 D647 H648 L649	C632-L645 HydrophobicContact CB-CD1 3.78Å; F639-L645 HydrophobicContact CB-CB 4.38Å; F639-L645 HydrophobicContact CD2-CB 4.16Å; F639-L645 HydrophobicContact CD2-CD1 3.94Å; F639-L645 HydrophobicContact CE2-CD1 4.16Å; F639-L645 HydrophobicContact CG-CB 4.42Å; Y641-L645 PolarHBondContact O-N 3.47Å; K642-L645 PolarHBondContact O-N 2.8Å; E643-L645 PolarHBondContact O-N 3.23Å; L645-D647 VanDerWaalsContact C-N 3.34Å; L645-D647 PolarHBondContact O-N 2.9Å; L645-H648 CarbonylContact O-C 3.55Å; L645-H648 WeakPolarHBondContact O-CB 3.47Å; L645-H648 PolarHBondContact O-N 3.44Å; L645-H648 VanDerWaalsContact O-N 3.1Å; L645-L649 HydrophobicContact CD1-CD1 4.44Å; L645-L649 HydrophobicContact CD1-CD2 4.41Å; L645-L649 HydrophobicContact CD1-CG 4.12Å; L645-L649 HydrophobicContact CG-CD1 4.21Å; L645-L649 HydrophobicContact CG-CG 4.34Å; L645-L649 WeakPolarHBondContact O-CG 3.37Å; L645-L649 PolarHBondContact O-N 3.46Å
646	K	90	Very high	84.2	Confident	135 Å²	135	70.6 Å²	70.6	59%	0.587	39%	0.393	S	S	*	.	H	α-helix	trans	-61.3	-41.4	179	-160.3	176.6	-167	177.2	0	111.8	K642 E643 H648 L649 R650	K642-K646 WeakPolarHBondContact O-CB 3.45Å; K642-K646 PolarHBondContact O-N 3.21Å; E643-K646 PolarHBondContact O-N 3.11Å; K646-H648 VanDerWaalsContact C-N 3.33Å; K646-L649 PolarHBondContact O-N 3.48Å; K646-R650 PolarHBondContact O-N 2.81Å
647	D	88.7	Confident	82.2	Confident	66 Å²	66	69.4 Å²	69.4	35%	0.353	38%	0.381	S	S	.	.	H	α-helix	trans	-66.4	-34	174	-73.6	-27.6	0	0	0	112.9	E643 L645 R650	E643-D647 PolarHBondContact O-N 3.29Å; L645-D647 VanDerWaalsContact C-N 3.34Å; L645-D647 PolarHBondContact O-N 2.9Å; D647-R650 IonicContact OD1-CZ 3.85Å; D647-R650 IonicContact OD1-NE 3.64Å; D647-R650 PolarHBondContact OD1-NE 3.24Å; D647-R650 IonicContact OD1-NH2 3.49Å; D647-R650 PolarHBondContact OD1-NH2 3.41Å
648	H	88.8	Confident	80.5	Confident	20 Å²	20	67.9 Å²	67.9	9%	0.093	38%	0.384	C	S	.	.	H	α-helix	trans	-72.9	-38.8	174.7	167.7	51.5	0	0	0	112.9	C632 C635 F639 S644 L645 K646 R650 V651 H652	C632-H648 PolarHBondContact SG-NE2 3Å; C632-H648 VanDerWaalsContact SG-NE2 3.37Å; C635-H648 VanDerWaalsContact SG-CE1 3.52Å; C635-H648 PolarHBondContact SG-NE2 2.69Å; F639-H648 HydrophobicContact CE1-CB 4Å; F639-H648 HydrophobicContact CE2-CB 3.99Å; F639-H648 AromaticContact CE2-CD2 3.22Å; F639-H648 WeakPolarHBondContact CE2-CD2 3.33Å; F639-H648 AromaticContact CE2-CG 3.69Å; F639-H648 AromaticContact CE2-NE2 3.99Å; F639-H648 HydrophobicContact CZ-CB 3.51Å; F639-H648 AromaticContact CZ-CD2 3.35Å; F639-H648 WeakPolarHBondContact CZ-CD2 3.3Å; F639-H648 AromaticContact CZ-CG 3.32Å; S644-H648 VanDerWaalsContact O-CB 3.31Å; S644-H648 WeakPolarHBondContact O-CB 3.37Å; S644-H648 PolarHBondContact O-N 3.1Å; L645-H648 CarbonylContact O-C 3.55Å; L645-H648 WeakPolarHBondContact O-CB 3.47Å; L645-H648 PolarHBondContact O-N 3.44Å; L645-H648 VanDerWaalsContact O-N 3.1Å; K646-H648 VanDerWaalsContact C-N 3.33Å; H648-R650 PolarHBondContact O-N 2.82Å; H648-V651 VanDerWaalsContact O-CB 3.23Å; H648-V651 WeakPolarHBondContact O-CB 3.32Å; H648-V651 WeakPolarHBondContact O-CG2 3.32Å; H648-V651 PolarHBondContact O-N 2.89Å; H648-H652 AromaticContact CE1-CD2 3.46Å; H648-H652 PolarHBondContact CE1-CD2 2.82Å; H648-H652 VanDerWaalsContact CE1-CD2 3.46Å; H648-H652 AromaticContact CE1-NE2 3.27Å; H648-H652 PolarHBondContact CE1-NE2 3.38Å; H648-H652 VanDerWaalsContact CE1-NE2 3.27Å; H648-H652 AromaticContact NE2-CD2 3.64Å; H648-H652 AromaticContact NE2-NE2 3.37Å; H648-H652 PolarHBondContact NE2-NE2 3.48Å
649	L	88	Confident	78.6	Confident	61 Å²	61	69.5 Å²	69.5	32%	0.319	41%	0.406	S	S	.	.	H	α-helix	trans	-60.4	-28.4	175	-70.5	173.1	0	0	0	112	L645 K646 V651 H652 S653	L645-L649 HydrophobicContact CD1-CD1 4.44Å; L645-L649 HydrophobicContact CD1-CD2 4.41Å; L645-L649 HydrophobicContact CD1-CG 4.12Å; L645-L649 HydrophobicContact CG-CD1 4.21Å; L645-L649 HydrophobicContact CG-CG 4.34Å; L645-L649 WeakPolarHBondContact O-CG 3.37Å; L645-L649 PolarHBondContact O-N 3.46Å; K646-L649 PolarHBondContact O-N 3.48Å; L649-V651 PolarHBondContact O-N 3.37Å; L649-H652 WeakPolarHBondContact O-CB 3.21Å; L649-H652 PolarHBondContact O-N 2.81Å; L649-S653 PolarHBondContact O-N 2.96Å; L649-S653 PolarHBondContact O-OG 3.32Å
650	R	87.8	Confident	76.7	Confident	106 Å²	106	70.5 Å²	70.5	40%	0.4	42%	0.421	S	S	.	.	H	α-helix	trans	-59.2	-31	171.6	-66.3	-168	-77.1	136.4	-11.1	113	K646 D647 H648 H652 G655 P656	K646-R650 PolarHBondContact O-N 2.81Å; D647-R650 IonicContact OD1-CZ 3.85Å; D647-R650 IonicContact OD1-NE 3.64Å; D647-R650 PolarHBondContact OD1-NE 3.24Å; D647-R650 IonicContact OD1-NH2 3.49Å; D647-R650 PolarHBondContact OD1-NH2 3.41Å; H648-R650 PolarHBondContact O-N 2.82Å; R650-H652 VanDerWaalsContact C-N 3.32Å; R650-G655 WeakPolarHBondContact O-CA 3.41Å; R650-G655 PolarHBondContact O-N 3.37Å; R650-P656 PolarHBondContact NH1-O 3.09Å
651	V	83.8	Confident	74.5	Confident	79 Å²	79	73.2 Å²	73.2	48%	0.479	45%	0.446	S	S	.	.	H	α-helix	trans	-68.4	-33.4	175.5	-172.7	0	0	0	0	111.3	H648 L649 P658	H648-V651 VanDerWaalsContact O-CB 3.23Å; H648-V651 WeakPolarHBondContact O-CB 3.32Å; H648-V651 WeakPolarHBondContact O-CG2 3.32Å; H648-V651 PolarHBondContact O-N 2.89Å; L649-V651 PolarHBondContact O-N 3.37Å; V651-P658 HydrophobicContact CG2-CG 4.46Å
652	H	83.8	Confident	72.5	Confident	65 Å²	65	81.3 Å²	81.3	30%	0.301	48%	0.476	S	S	.	.	H	α-helix	trans	-72.8	-43.5	175.4	-80	-90.3	0	0	0	112	E634 C635 H648 L649 R650 G654	E634-H652 WeakPolarHBondContact CB-CE1 3.32Å; E634-H652 WeakPolarHBondContact CB-ND1 3.4Å; E634-H652 IonicContact OE1-CG 2.66Å; E634-H652 VanDerWaalsContact OE2-CB 3.32Å; E634-H652 WeakPolarHBondContact OE2-CB 3.31Å; E634-H652 IonicContact OE2-CE1 3.38Å; E634-H652 IonicContact OE2-CG 3.67Å; E634-H652 VanDerWaalsContact OE2-CG 3.27Å; E634-H652 IonicContact OE2-ND1 3.9Å; E634-H652 PolarHBondContact OE2-ND1 3.49Å; C635-H652 PolarHBondContact SG-NE2 2.76Å; C635-H652 VanDerWaalsContact SG-NE2 3.39Å; H648-H652 AromaticContact CE1-CD2 3.46Å; H648-H652 PolarHBondContact CE1-CD2 2.82Å; H648-H652 VanDerWaalsContact CE1-CD2 3.46Å; H648-H652 AromaticContact CE1-NE2 3.27Å; H648-H652 PolarHBondContact CE1-NE2 3.38Å; H648-H652 VanDerWaalsContact CE1-NE2 3.27Å; H648-H652 AromaticContact NE2-CD2 3.64Å; H648-H652 AromaticContact NE2-NE2 3.37Å; H648-H652 PolarHBondContact NE2-NE2 3.48Å; L649-H652 WeakPolarHBondContact O-CB 3.21Å; L649-H652 PolarHBondContact O-N 2.81Å; R650-H652 VanDerWaalsContact C-N 3.32Å; H652-G654 PolarHBondContact O-N 3.22Å
653	S	81.6	Confident	70.2	Confident	101 Å²	101	84.9 Å²	84.9	71%	0.706	50%	0.495	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.3	13.5	178	-44.5	0	0	0	0	114.9	L649 G655	L649-S653 PolarHBondContact O-N 2.96Å; L649-S653 PolarHBondContact O-OG 3.32Å; S653-G655 PolarHBondContact O-N 2.73Å
654	G	69.3	Low	68.1	Low	71 Å²	71	87.6 Å²	87.6	73%	0.732	51%	0.512	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.9	9	-174.7	0	0	0	0	0	114.8	H652	H652-G654 PolarHBondContact O-N 3.22Å
655	G	54.1	Low	65.9	Low	24 Å²	24	90.4 Å²	90.4	25%	0.247	53%	0.529	C	S	.	.	P	Polyproline II helix	trans	-72.6	150.6	179.5	0	0	0	0	0	111.5	R650 S653 G657	R650-G655 WeakPolarHBondContact O-CA 3.41Å; R650-G655 PolarHBondContact O-N 3.37Å; S653-G655 PolarHBondContact O-N 2.73Å; G655-G657 PolarHBondContact O-N 2.88Å; G655-G657 VanDerWaalsContact O-N 3.07Å
656	P	54.5	Low	63.7	Low	93 Å²	93	94.6 Å²	94.6	60%	0.604	56%	0.558	S	S	*	*	P	Polyproline II helix	trans	-56	121.1	180	22.3	-32.8	0	0	0	110.1	R650 A660	R650-P656 PolarHBondContact NH1-O 3.09Å; P656-A660 HydrophobicContact CB-CB 3.66Å
657	G	47.4	Very low	61.5	Low	31 Å²	31	93.4 Å²	93.4	32%	0.32	56%	0.563	S	S	.	*	P	Polyproline II helix	trans	-62.1	172.1	-168	0	0	0	0	0	114.1	G655 G659 A660	G655-G657 PolarHBondContact O-N 2.88Å; G655-G657 VanDerWaalsContact O-N 3.07Å; G657-G659 VanDerWaalsContact C-N 3.28Å; G657-G659 PolarHBondContact O-N 3.29Å; G657-A660 PolarHBondContact O-N 3.46Å; G657-A660 VanDerWaalsContact O-N 3.13Å
658	P	53.3	Low	59.7	Low	92 Å²	92	96 Å²	96	60%	0.597	58%	0.584	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.3	84.3	-178.8	28.8	-35.6	0	0	0	111.1	V651	V651-P658 HydrophobicContact CG2-CG 4.46Å
659	G	50.9	Low	57.9	Low	72 Å²	72	104.4 Å²	104.4	74%	0.742	62%	0.623	S	S	*	*	T	Hydrogen-bonded Turn	trans	160.9	-20.7	-171.9	0	0	0	0	0	114.2	G657	G657-G659 VanDerWaalsContact C-N 3.28Å; G657-G659 PolarHBondContact O-N 3.29Å
660	A	49.6	Very low	56.2	Low	56 Å²	56	112.6 Å²	112.6	46%	0.463	65%	0.65	S	S	.	*	S	Bend	trans	-63.4	129.4	170.3	0	0	0	0	0	110.2	P656 G657 R662	P656-A660 HydrophobicContact CB-CB 3.66Å; G657-A660 PolarHBondContact O-N 3.46Å; G657-A660 VanDerWaalsContact O-N 3.13Å; A660-R662 PolarHBondContact O-N 3.04Å
661	P	42.7	Very low	54.2	Low	118 Å²	118	118.4 Å²	118.4	77%	0.766	69%	0.689	S	S	*	*			trans	-54.4	136.9	174.8	-25	34	0	0	0	110.3	Q663	P661-Q663 PolarHBondContact O-N 3.46Å
662	R	50.1	Low	52.7	Low	234 Å²	234	120.4 Å²	120.4	88%	0.883	70%	0.699	S	S	*	*			trans	-56	115.3	161.8	-93.9	179.9	165.3	-97.4	2.1	106.4	A660 L664	A660-R662 PolarHBondContact O-N 3.04Å; R662-L664 PolarHBondContact O-N 3.19Å
663	Q	41.3	Very low	51	Low	189 Å²	189	123.3 Å²	123.3	88%	0.883	72%	0.72	S	S	*	*			trans	-57.7	113.7	160.1	-61.9	-154.7	67.6	0	0	105.7	P661	P661-Q663 PolarHBondContact O-N 3.46Å
664	L	43.1	Very low	49.3	Very low	153 Å²	153	124.5 Å²	124.5	80%	0.801	72%	0.721	S	S	*	*	P	Polyproline II helix	trans	-59.4	140.2	167.2	-88.2	120.1	0	0	0	106.7	R662	R662-L664 PolarHBondContact O-N 3.19Å
665	P	43.8	Very low	48.2	Very low	105 Å²	105	127.6 Å²	127.6	68%	0.682	72%	0.721	S	S	*	*	P	Polyproline II helix	trans	-54.5	141.4	168.4	26.5	-33.5	0	0	0	108
666	P	45	Very low	47.8	Very low	116 Å²	116	134.1 Å²	134.1	75%	0.753	75%	0.75	S	S	*	*	P	Polyproline II helix	trans	-54.8	142.4	176.8	24.5	-33.4	0	0	0	109
667	P	44	Very low	47.4	Very low	109 Å²	109	136.9 Å²	136.9	71%	0.708	76%	0.76	S	S	*	*	P	Polyproline II helix	trans	-57	146.2	173	26.9	-33.9	0	0	0	108.9	E669	P667-E669 PolarHBondContact O-N 2.71Å
668	P	50.9	Low	47.4	Very low	120 Å²	120	144.4 Å²	144.4	78%	0.779	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-56.6	133.6	175.2	25.8	-33.9	0	0	0	109	R670	P668-R670 PolarHBondContact O-N 2.94Å
669	E	51.5	Low	46.9	Very low	198 Å²	198	148.5 Å²	148.5	93%	0.925	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-56.8	130.8	174.6	-67.6	-177.5	117.4	0	0	108.7	P667	P667-E669 PolarHBondContact O-N 2.71Å
670	R	52.1	Low	46.6	Very low	232 Å²	232	154.8 Å²	154.8	88%	0.875	81%	0.812	S	S	*	*			trans	-95.4	107.6	178.3	-108.2	-177.2	175.2	-113.8	3.2	107.8	P668	P668-R670 PolarHBondContact O-N 2.94Å
671	D	44.7	Very low	46.3	Very low	228 Å²	228	163.8 Å²	163.8	100%	1.219	84%	0.843	S	S	*	*			trans	61.9	0	171	-60.9	-78.9	0	0	0	116

Retrieved 671 of 671 residues in 127.1 ms (Link to these results)

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