A0A077Z936_TRITR Loading...

C2H2-type domain-containing protein

AlphaFold DB , UniProt , Accession A0A077Z936, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 757 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	42.6	Very low	34.9	Very low	207 Å²	207	145.7 Å²	145.7	100%	1.02	74%	0.742	S	S	*	*				0	-62.3	0	-92.4	-177.1	170	0	0	111.6	E3 K4 M5	M1-E3 PolarHBondContact O-N 3.15Å; M1-K4 PolarHBondContact O-N 3.24Å; M1-M5 PolarHBondContact O-N 3.33Å
2	A	31.9	Very low	34.4	Very low	76 Å²	76	143.3 Å²	143.3	63%	0.628	74%	0.743	S	S	*	*	H	α-helix	trans	-51.2	-40.6	-179.8	0	0	0	0	0	113.8	K4 M5 L6	A2-K4 VanDerWaalsContact C-N 3.34Å; A2-K4 PolarHBondContact O-N 3.33Å; A2-M5 PolarHBondContact O-N 3.22Å; A2-L6 PolarHBondContact O-N 3.42Å
3	E	30.9	Very low	33.8	Very low	150 Å²	150	142.4 Å²	142.4	70%	0.701	75%	0.747	S	S	*	*	H	α-helix	trans	-62.7	-33.2	176.7	-66	154.8	126.6	0	0	113.7	M1 L6 Y7	M1-E3 PolarHBondContact O-N 3.15Å; E3-L6 PolarHBondContact O-N 2.95Å; E3-Y7 WeakPolarHBondContact O-CD2 3.43Å
4	K	37.1	Very low	33.3	Very low	157 Å²	157	145.4 Å²	145.4	68%	0.683	76%	0.755	S	S	*	*	H	α-helix	trans	-68.1	-38.9	174.9	-90.1	-160	167.7	-162.2	0	111.9	M1 A2 L6 Y7	M1-K4 PolarHBondContact O-N 3.24Å; A2-K4 VanDerWaalsContact C-N 3.34Å; A2-K4 PolarHBondContact O-N 3.33Å; K4-L6 PolarHBondContact O-N 3.38Å; K4-Y7 PolarHBondContact O-N 3.17Å; K4-Y7 VanDerWaalsContact O-N 3.15Å
5	M	35.5	Very low	32.9	Very low	139 Å²	139	146.9 Å²	146.9	69%	0.685	76%	0.764	S	S	*	*	H	α-helix	trans	-67	-18.1	176.9	-74.5	-177.3	146.6	0	0	113.6	M1 A2	M1-M5 PolarHBondContact O-N 3.33Å; A2-M5 PolarHBondContact O-N 3.22Å
6	L	38.6	Very low	32.5	Very low	125 Å²	125	152.6 Å²	152.6	65%	0.654	77%	0.772	S	S	*	*	H	α-helix	trans	-78.6	-21.4	174.1	-79.8	163.1	0	0	0	113.5	A2 E3 K4	A2-L6 PolarHBondContact O-N 3.42Å; E3-L6 PolarHBondContact O-N 2.95Å; K4-L6 PolarHBondContact O-N 3.38Å
7	Y	35.9	Very low	32.2	Very low	211 Å²	211	154.2 Å²	154.2	83%	0.827	78%	0.776	S	S	*	*	H	α-helix	trans	-93	-10.2	177	-80.5	-84.9	0	0	0	113.9	E3 K4	E3-Y7 WeakPolarHBondContact O-CD2 3.43Å; K4-Y7 PolarHBondContact O-N 3.17Å; K4-Y7 VanDerWaalsContact O-N 3.15Å
8	E	38.6	Very low	32.1	Very low	150 Å²	150	152.7 Å²	152.7	70%	0.701	78%	0.779	S	S	*	*	S	Bend	trans	-103.3	-2.1	-177.3	-70.1	174.2	176.6	0	0	113.8
9	M	30.2	Very low	31.8	Very low	135 Å²	135	148.7 Å²	148.7	67%	0.665	77%	0.767	S	S	*	*	S	Bend	trans	-80	139	173.5	-69.5	-154.8	-58.2	0	0	111.5
10	P	32.8	Very low	31.6	Very low	124 Å²	124	147.7 Å²	147.7	81%	0.805	77%	0.77	S	S	*	*	P	Polyproline II helix	trans	-60.5	140.4	175	26.5	-34.4	0	0	0	110.5
11	T	29.9	Very low	31.5	Very low	129 Å²	129	149.3 Å²	149.3	79%	0.791	77%	0.771	S	S	*	*	P	Polyproline II helix	trans	-55.5	137.4	-176	22.4	0	0	0	0	111.6	V13	T11-V13 PolarHBondContact O-N 2.92Å
12	P	29.3	Very low	30.7	Very low	117 Å²	117	148 Å²	148	76%	0.76	76%	0.763	S	S	*	*	P	Polyproline II helix	trans	-61.1	131.2	174.2	26.6	-33.5	0	0	0	109.1	Q14	P12-Q14 PolarHBondContact O-N 3.05Å
13	V	26.5	Very low	30.6	Very low	131 Å²	131	150 Å²	150	79%	0.794	77%	0.769	S	S	*	*	P	Polyproline II helix	trans	-53.4	116.7	176.2	176.8	0	0	0	0	108.6	T11 L15	T11-V13 PolarHBondContact O-N 2.92Å; V13-L15 PolarHBondContact O-N 3.06Å
14	Q	26.5	Very low	30.4	Very low	184 Å²	184	148.3 Å²	148.3	86%	0.86	77%	0.771	S	S	*	*			trans	-62	110.5	173.4	-71.5	-175.3	-6.4	0	0	108.2	P12 R16	P12-Q14 PolarHBondContact O-N 3.05Å; Q14-R16 VanDerWaalsContact C-N 3.3Å; Q14-R16 PolarHBondContact O-N 3.31Å
15	L	27.5	Very low	29.9	Very low	169 Å²	169	146.6 Å²	146.6	89%	0.885	78%	0.776	S	S	*	*			trans	-69.9	94.9	169.9	-80.9	163.6	0	0	0	107.5	V13 E17	V13-L15 PolarHBondContact O-N 3.06Å; L15-E17 PolarHBondContact O-N 3.37Å
16	R	26	Very low	29.4	Very low	238 Å²	238	148.2 Å²	148.2	90%	0.898	79%	0.786	S	S	*	*			trans	-40	126.8	175.1	-169.8	178.9	-167.9	165.1	3.1	110.3	Q14	Q14-R16 VanDerWaalsContact C-N 3.3Å; Q14-R16 PolarHBondContact O-N 3.31Å
17	E	27.6	Very low	28.9	Very low	179 Å²	179	147.8 Å²	147.8	84%	0.836	79%	0.789	S	S	*	*			trans	-55.9	139.8	179.5	-65.2	-173.4	129.3	0	0	110.8	L15 S19	L15-E17 PolarHBondContact O-N 3.37Å; E17-S19 PolarHBondContact O-N 3.01Å
18	P	30.4	Very low	28.3	Very low	127 Å²	127	148.5 Å²	148.5	83%	0.825	79%	0.792	S	S	*	*			trans	-69	107.9	177.1	28.3	-32.8	0	0	0	109.4
19	S	27.2	Very low	27.9	Very low	78 Å²	78	150 Å²	150	55%	0.545	80%	0.797	S	S	.	*			trans	-52.8	136.1	171.7	-177.5	0	0	0	0	110.4	E17 F21	E17-S19 PolarHBondContact O-N 3.01Å; S19-F21 VanDerWaalsContact C-N 3.3Å; S19-F21 PolarHBondContact O-N 2.84Å
20	P	26.7	Very low	27.6	Very low	128 Å²	128	145.7 Å²	145.7	83%	0.831	79%	0.786	S	S	*	*			trans	-72.1	85.2	176.8	30.7	-34.8	0	0	0	110
21	F	30	Very low	27.3	Very low	182 Å²	182	146.1 Å²	146.1	80%	0.798	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-81.3	126.4	168.9	-90	-89.1	0	0	0	109.8	S19	S19-F21 VanDerWaalsContact C-N 3.3Å; S19-F21 PolarHBondContact O-N 2.84Å
22	E	26.7	Very low	27.3	Very low	180 Å²	180	145.4 Å²	145.4	84%	0.841	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-59.6	143	169.8	-63.9	179.8	115.5	0	0	110.3
23	P	28.9	Very low	27.1	Very low	117 Å²	117	146.6 Å²	146.6	76%	0.76	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-64.6	135.1	172.7	27.9	-33.6	0	0	0	109.6
24	P	26.8	Very low	27.4	Very low	115 Å²	115	147 Å²	147	75%	0.747	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-61.5	143.8	175.6	26.6	-34.2	0	0	0	110.2	L26	P24-L26 PolarHBondContact O-N 3Å
25	P	25.7	Very low	27.4	Very low	121 Å²	121	146.4 Å²	146.4	79%	0.786	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-62.6	132.8	-175.2	25.3	-34.3	0	0	0	111.3	T27	P25-T27 PolarHBondContact O-N 3.1Å; P25-T27 VanDerWaalsContact O-N 3.1Å
26	L	26.8	Very low	27.7	Very low	173 Å²	173	145.3 Å²	145.3	91%	0.906	78%	0.779	S	S	*	*			trans	-63.2	110.5	177.3	-72.2	168.2	0	0	0	110.3	P24 Y28	P24-L26 PolarHBondContact O-N 3Å; L26-Y28 PolarHBondContact O-N 2.92Å; L26-Y28 VanDerWaalsContact O-N 3.12Å
27	T	26.9	Very low	27.8	Very low	115 Å²	115	142.4 Å²	142.4	71%	0.706	78%	0.776	S	S	*	*			trans	-70.2	104.8	171.8	35.8	0	0	0	0	110.1	P25 F29	P25-T27 PolarHBondContact O-N 3.1Å; P25-T27 VanDerWaalsContact O-N 3.1Å; T27-F29 WeakPolarHBondContact O-CD2 3.27Å; T27-F29 PolarHBondContact O-N 3.39Å
28	Y	23.6	Very low	27.9	Very low	226 Å²	226	142.4 Å²	142.4	89%	0.886	78%	0.782	S	S	*	*			trans	-73.4	103.4	-179	-167.1	-85.7	0	0	0	110.6	L26	L26-Y28 PolarHBondContact O-N 2.92Å; L26-Y28 VanDerWaalsContact O-N 3.12Å
29	F	30.8	Very low	27.7	Very low	183 Å²	183	139.7 Å²	139.7	80%	0.803	78%	0.776	S	S	*	*			trans	-103.9	103.7	172.9	-77.3	-80.4	0	0	0	110.1	T27	T27-F29 WeakPolarHBondContact O-CD2 3.27Å; T27-F29 PolarHBondContact O-N 3.39Å
30	G	24.2	Very low	27.7	Very low	44 Å²	44	143.4 Å²	143.4	45%	0.454	79%	0.79	S	S	.	*			trans	-76.2	173.7	170.9	0	0	0	0	0	112.7	S32	G30-S32 PolarHBondContact O-N 3.3Å
31	P	25	Very low	27.7	Very low	133 Å²	133	142.5 Å²	142.5	86%	0.864	78%	0.784	S	S	*	*			trans	-71	124.1	-178.7	29.2	-34.1	0	0	0	111.6
32	S	29.8	Very low	27.6	Very low	114 Å²	114	139.3 Å²	139.3	80%	0.797	78%	0.782	S	S	*	*			trans	-123.2	120.4	171.3	59.3	0	0	0	0	110.1	G30	G30-S32 PolarHBondContact O-N 3.3Å
33	N	26.3	Very low	27.5	Very low	142 Å²	142	138.8 Å²	138.8	76%	0.759	79%	0.785	S	S	*	*			trans	-76.6	178.1	-177.1	-65.2	-22.5	0	0	0	113.1
34	N	31.4	Very low	27.2	Very low	138 Å²	138	139.1 Å²	139.1	74%	0.738	79%	0.788	S	S	*	*			trans	83.7	114.1	173.7	-49.2	-1.6	0	0	0	112.1
35	E	27.6	Very low	27.1	Very low	173 Å²	173	135.6 Å²	135.6	81%	0.808	77%	0.773	S	S	*	*				75	129.5	64.2	-67.6	-178.7	167.5	0	0	112.2
36	N	34.1	Very low	27	Very low	145 Å²	145	141.8 Å²	141.8	78%	0.775	78%	0.783	S	S	*	*			trans	90.9	106.6	-164.4	-55.2	-12.9	0	0	0	112.8
37	E	27.6	Very low	26.8	Very low	178 Å²	178	138.4 Å²	138.4	83%	0.832	77%	0.773	S	S	*	*				89.7	120.8	73.9	-81.7	-173.1	155.9	0	0	112.6	G39	E37-G39 PolarHBondContact O-N 3.12Å
38	D	29.3	Very low	26.7	Very low	179 Å²	179	140.2 Å²	140.2	96%	0.957	77%	0.774	S	S	*	*			trans	28.8	71.2	164.3	-64.4	-10.5	0	0	0	118.8
39	G	26.3	Very low	26.8	Very low	69 Å²	69	135 Å²	135	71%	0.711	77%	0.765	S	S	*	*			trans	-117.8	129.6	156.7	0	0	0	0	0	111.2	E37	E37-G39 PolarHBondContact O-N 3.12Å
40	D	26.6	Very low	26.6	Very low	157 Å²	157	127.8 Å²	127.8	84%	0.84	74%	0.739	S	S	*	*	P	Polyproline II helix	trans	-57.1	137.7	167.9	-98.5	-49.2	0	0	0	109.8
41	P	27.9	Very low	26.8	Very low	108 Å²	108	129.4 Å²	129.4	70%	0.701	74%	0.735	S	S	*	*	P	Polyproline II helix	trans	-61.4	123.9	177.9	25.9	-33.1	0	0	0	108.8	D43	P41-D43 PolarHBondContact O-N 3.15Å
42	P	26.6	Very low	27.1	Very low	115 Å²	115	123.7 Å²	123.7	75%	0.747	70%	0.697	S	S	*	*	P	Polyproline II helix	trans	-58.7	139.7	-167.3	21.6	-33.6	0	0	0	111.4	C44	P42-C44 VanDerWaalsContact C-N 3.35Å; P42-C44 PolarHBondContact O-N 3.05Å
43	D	24.7	Very low	27.6	Very low	170 Å²	170	120.4 Å²	120.4	91%	0.909	67%	0.67	S	S	*	*			trans	-62.6	91.4	-171.2	-165.1	7.6	0	0	0	110.7	P41 G45	P41-D43 PolarHBondContact O-N 3.15Å; D43-G45 PolarHBondContact O-N 3.46Å
44	C	23.7	Very low	28.5	Very low	123 Å²	123	114.2 Å²	114.2	83%	0.831	64%	0.636	S	S	*	*			trans	-82.2	70	-163.4	52.4	0	0	0	0	111.4	P42	P42-C44 VanDerWaalsContact C-N 3.35Å; P42-C44 PolarHBondContact O-N 3.05Å
45	G	24.4	Very low	29.2	Very low	41 Å²	41	109.4 Å²	109.4	42%	0.423	61%	0.61	S	S	.	*			trans	-53.2	152.5	-177.9	0	0	0	0	0	114.3	D43 S47	D43-G45 PolarHBondContact O-N 3.46Å; G45-S47 WeakPolarHBondContact O-CB 3.49Å; G45-S47 PolarHBondContact O-N 3.02Å; G45-S47 PolarHBondContact O-OG 3.34Å
46	Y	22.9	Very low	30.1	Very low	252 Å²	252	101.2 Å²	101.2	99%	0.988	57%	0.572	S	S	*	*	S	Bend	trans	-50.6	87.4	-176.5	-65.1	-100.5	0	0	0	113.8
47	S	23.5	Very low	30.9	Very low	101 Å²	101	98.1 Å²	98.1	71%	0.706	56%	0.556	S	S	*	*			trans	-137	-6.9	-170.3	53.3	0	0	0	0	115.7	G45	G45-S47 WeakPolarHBondContact O-CB 3.49Å; G45-S47 PolarHBondContact O-N 3.02Å; G45-S47 PolarHBondContact O-OG 3.34Å
48	Q	25.3	Very low	31.7	Very low	153 Å²	153	96.4 Å²	96.4	72%	0.715	55%	0.545	S	S	*	.			trans	-128.2	92.9	-180	-66.3	-173.3	-0.1	0	0	112.2	A50 Q84	Q48-A50 PolarHBondContact O-N 3.13Å; Q48-Q84 PolarHBondContact O-NE2 3.13Å
49	V	25.6	Very low	32.4	Very low	116 Å²	116	88.2 Å²	88.2	70%	0.703	50%	0.502	S	S	*	.			trans	-86.5	88.9	168.4	-177.4	0	0	0	0	108.2
50	A	26.6	Very low	33.4	Very low	32 Å²	32	87.8 Å²	87.8	26%	0.264	48%	0.481	S	S	.	.			trans	-67.8	140.2	-178.7	0	0	0	0	0	112.4	Q48 F52	Q48-A50 PolarHBondContact O-N 3.13Å; A50-F52 HydrophobicContact CB-CD2 4.25Å; A50-F52 HydrophobicContact CB-CE2 3.43Å; A50-F52 VanDerWaalsContact CB-CE2 3.43Å; A50-F52 HydrophobicContact CB-CZ 3.68Å
51	Q	26.9	Very low	34.1	Very low	79 Å²	79	81.4 Å²	81.4	37%	0.369	45%	0.448	S	S	.	.			trans	-92.6	115.9	-167.6	-91.1	-150.9	28	0	0	111.4	T65 E66	Q51-T65 HydrophobicContact CB-CG2 4.25Å; Q51-T65 HydrophobicContact CG-CG2 3.69Å; Q51-E66 PolarHBondContact OE1-OE2 2.78Å
52	F	32.4	Very low	34.9	Very low	12 Å²	12	78.1 Å²	78.1	5%	0.053	43%	0.427	C	S	.	.			trans	-147	146.5	-173.9	-61.9	-53	0	0	0	114.6	A50 Y54 T65 Y69 W76 Y86	A50-F52 HydrophobicContact CB-CD2 4.25Å; A50-F52 HydrophobicContact CB-CE2 3.43Å; A50-F52 VanDerWaalsContact CB-CE2 3.43Å; A50-F52 HydrophobicContact CB-CZ 3.68Å; F52-Y54 WeakPolarHBondContact O-CD1 3.5Å; F52-Y54 PolarHBondContact O-N 3.07Å; F52-T65 PolarHBondContact N-OG1 2.82Å; F52-Y69 HydrophobicContact CD1-CD2 4.1Å; F52-Y69 HydrophobicContact CD1-CE2 4.31Å; F52-W76 HydrophobicContact CD1-CZ2 4.05Å; F52-W76 AromaticContact CE1-CE2 3.72Å; F52-W76 AromaticContact CE1-CZ2 3.5Å; F52-W76 HydrophobicContact CE1-CZ2 3.5Å; F52-W76 VanDerWaalsContact CE1-CZ2 3.5Å; F52-W76 AromaticContact CE1-NE1 3.38Å; F52-W76 HydrophobicContact CE2-CZ2 4.13Å; F52-W76 AromaticContact CZ-CE2 3.88Å; F52-W76 AromaticContact CZ-CZ2 3.55Å; F52-W76 HydrophobicContact CZ-CZ2 3.55Å; F52-W76 AromaticContact CZ-NE1 3.6Å; F52-Y86 AromaticContact CD2-CD1 3.94Å; F52-Y86 HydrophobicContact CD2-CD1 3.94Å; F52-Y86 AromaticContact CD2-CE1 3.53Å; F52-Y86 HydrophobicContact CD2-CE1 3.53Å; F52-Y86 HydrophobicContact CE2-CD1 4.48Å; F52-Y86 AromaticContact CE2-CE1 3.7Å; F52-Y86 HydrophobicContact CE2-CE1 3.7Å
53	D	39.4	Very low	35.6	Very low	46 Å²	46	72.8 Å²	72.8	25%	0.246	39%	0.392	C	S	.	.			trans	-67.2	115.1	164.1	-85.2	-29.9	0	0	0	111.2	H64 R144	D53-H64 IonicContact OD1-CE1 3.55Å; D53-H64 IonicContact OD1-CG 3.82Å; D53-H64 IonicContact OD1-ND1 2.74Å; D53-H64 PolarHBondContact OD1-ND1 3.46Å; D53-R144 IonicContact OD1-CZ 3.75Å; D53-R144 IonicContact OD1-NE 3.68Å; D53-R144 IonicContact OD1-NH2 3.26Å; D53-R144 PolarHBondContact OD1-NH2 2.88Å; D53-R144 IonicContact OD2-CZ 3.21Å; D53-R144 IonicContact OD2-NE 2.82Å; D53-R144 PolarHBondContact OD2-NE 3.41Å; D53-R144 IonicContact OD2-NH2 2.75Å; D53-R144 PolarHBondContact OD2-NH2 3.24Å
54	Y	45.2	Very low	36.3	Very low	12 Å²	12	68.9 Å²	68.9	5%	0.047	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.1	144.7	167	71.5	-77.8	0	0	0	113.9	F52 C56 C63 Y86 M87 C88 S95	F52-Y54 WeakPolarHBondContact O-CD1 3.5Å; F52-Y54 PolarHBondContact O-N 3.07Å; Y54-C56 HydrophobicContact CE2-CB 4.23Å; Y54-C56 PolarHBondContact O-N 2.85Å; Y54-C63 HydrophobicContact CD1-CB 4.37Å; Y54-C63 HydrophobicContact CE1-CB 4.12Å; Y54-C63 PolarHBondContact N-O 3.43Å; Y54-C63 PolarHBondContact O-N 2.96Å; Y54-Y86 PolarHBondContact OH-O 3.13Å; Y54-M87 PolarHBondContact OH-O 2.88Å; Y54-C88 HydrophobicContact CE2-CB 4.27Å; Y54-C88 WeakPolarHBondContact OH-CA 3.35Å; Y54-C88 WeakPolarHBondContact OH-CB 3.07Å; Y54-C88 PolarHBondContact OH-N 3.15Å; Y54-S95 WeakPolarHBondContact CE2-OG 3.29Å
55	I	47.6	Very low	37	Very low	37 Å²	37	64.5 Å²	64.5	19%	0.19	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73	123.6	167.5	-53.9	174.4	0	0	0	107.5	V61 I99 V120	I55-V61 WeakPolarHBondContact CA-O 3.49Å; I55-I99 HydrophobicContact CB-CB 4.42Å; I55-I99 HydrophobicContact CB-CD1 4.06Å; I55-I99 HydrophobicContact CG2-CD1 3.92Å; I55-I99 WeakPolarHBondContact O-CD1 3.5Å; I55-I99 WeakPolarHBondContact O-CG1 3.45Å; I55-V120 HydrophobicContact CD1-CG2 4.47Å
56	C	46.1	Very low	37.2	Very low	0 Å²	0	68.6 Å²	68.6	0%	0	35%	0.346	C	S	.	.			trans	-84.1	131.1	-176.4	131.2	0	0	0	0	112.1	Y54 K58 C59 Q60 V61 C63 C88 C91	Y54-C56 HydrophobicContact CE2-CB 4.23Å; Y54-C56 PolarHBondContact O-N 2.85Å; C56-K58 VanDerWaalsContact C-N 3.31Å; C56-K58 PolarHBondContact O-N 2.94Å; C56-C59 WeakPolarHBondContact CB-SG 3.39Å; C56-C59 PolarHBondContact O-N 3.31Å; C56-C59 WeakPolarHBondContact SG-CB 3.47Å; C56-C59 PolarHBondContact SG-N 2.56Å; C56-C59 CovalentContact SG-SG 2.05Å; C56-C59 PolarHBondContact SG-SG 3.12Å; C56-Q60 VanDerWaalsContact O-CA 3.31Å; C56-Q60 WeakPolarHBondContact O-CA 3.3Å; C56-Q60 PolarHBondContact O-N 3.2Å; C56-V61 PolarHBondContact N-O 3.37Å; C56-C63 WeakPolarHBondContact CB-SG 3.19Å; C56-C88 HydrophobicContact CB-CB 3.84Å; C56-C88 VanDerWaalsContact CB-SG 3.54Å; C56-C91 PolarHBondContact SG-SG 3.25Å
57	N	50.2	Low	37.5	Very low	81 Å²	81	63 Å²	63	43%	0.433	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.3	-33.5	-175.5	-78.2	-73.2	0	0	0	114.2	Q60 I99	N57-Q60 PolarHBondContact O-NE2 2.79Å; N57-I99 HydrophobicContact CB-CD1 4.49Å; N57-I99 WeakPolarHBondContact ND2-CG1 3.35Å; N57-I99 WeakPolarHBondContact OD1-CD1 3.34Å; N57-I99 WeakPolarHBondContact OD1-CG1 3.49Å
58	K	44.2	Very low	37.8	Very low	142 Å²	142	61.5 Å²	61.5	62%	0.617	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.4	-35.7	-177.8	-178.5	-175.3	175.3	-168.1	0	113.5	C56 C91 H93	C56-K58 VanDerWaalsContact C-N 3.31Å; C56-K58 PolarHBondContact O-N 2.94Å; K58-C91 HydrophobicContact CD-CB 4.42Å; K58-C91 PolarHBondContact NZ-O 2.93Å; K58-C91 VanDerWaalsContact NZ-O 3.13Å; K58-H93 HydrophobicContact CB-CB 3.95Å; K58-H93 HydrophobicContact CD-CB 3.94Å
59	C	44.4	Very low	38.2	Very low	6 Å²	6	59.2 Å²	59.2	4%	0.041	30%	0.298	C	S	.	.	T	Hydrogen-bonded Turn	trans	-113.2	-19.7	-167.8	64.4	0	0	0	0	113.9	C56 V61 C91 P131	C56-C59 WeakPolarHBondContact CB-SG 3.39Å; C56-C59 PolarHBondContact O-N 3.31Å; C56-C59 WeakPolarHBondContact SG-CB 3.47Å; C56-C59 PolarHBondContact SG-N 2.56Å; C56-C59 CovalentContact SG-SG 2.05Å; C56-C59 PolarHBondContact SG-SG 3.12Å; C59-V61 HydrophobicContact CB-CG2 4.28Å; C59-V61 PolarHBondContact O-N 2.97Å; C59-V61 VanDerWaalsContact O-N 3.12Å; C59-C91 HydrophobicContact CB-CB 4.02Å; C59-C91 VanDerWaalsContact SG-SG 3.6Å; C59-P131 WeakPolarHBondContact O-CD 3.47Å
60	Q	48	Very low	38.4	Very low	61 Å²	61	55.7 Å²	55.7	29%	0.285	28%	0.275	S	S	.	.			trans	57	19.6	-177.3	-55.1	-64	-39	0	0	114.4	C56 N57	C56-Q60 VanDerWaalsContact O-CA 3.31Å; C56-Q60 WeakPolarHBondContact O-CA 3.3Å; C56-Q60 PolarHBondContact O-N 3.2Å; N57-Q60 PolarHBondContact O-NE2 2.79Å
61	V	39.9	Very low	38.6	Very low	23 Å²	23	59.2 Å²	59.2	14%	0.139	29%	0.286	C	S	.	.	S	Bend	trans	-89.1	147.5	169.9	-174.3	0	0	0	0	108.7	I55 C56 C59 C63 T90 V132	I55-V61 WeakPolarHBondContact CA-O 3.49Å; C56-V61 PolarHBondContact N-O 3.37Å; C59-V61 HydrophobicContact CB-CG2 4.28Å; C59-V61 PolarHBondContact O-N 2.97Å; C59-V61 VanDerWaalsContact O-N 3.12Å; V61-C63 PolarHBondContact O-N 3.04Å; V61-T90 HydrophobicContact CB-CG2 4.32Å; V61-T90 HydrophobicContact CG1-CG2 4.22Å; V61-T90 HydrophobicContact CG2-CG2 4.18Å; V61-V132 HydrophobicContact CG2-CB 4.28Å; V61-V132 HydrophobicContact CG2-CG2 3.57Å
62	C	45.7	Very low	39	Very low	38 Å²	38	59.5 Å²	59.5	26%	0.257	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	99.6	164.9	-167.9	0	0	0	0	108	H64 I141	C62-H64 PolarHBondContact O-N 3.33Å; C62-I141 HydrophobicContact CB-CD1 4.4Å
63	C	40.9	Very low	39.1	Very low	3 Å²	3	61.5 Å²	61.5	2%	0.02	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.9	114.7	173.4	-33.2	0	0	0	0	106.2	Y54 C56 V61 C88	Y54-C63 HydrophobicContact CD1-CB 4.37Å; Y54-C63 HydrophobicContact CE1-CB 4.12Å; Y54-C63 PolarHBondContact N-O 3.43Å; Y54-C63 PolarHBondContact O-N 2.96Å; C56-C63 WeakPolarHBondContact CB-SG 3.19Å; V61-C63 PolarHBondContact O-N 3.04Å; C63-C88 HydrophobicContact CB-CB 4.12Å; C63-C88 WeakPolarHBondContact CB-SG 3.38Å; C63-C88 WeakPolarHBondContact SG-CB 3.42Å; C63-C88 CovalentContact SG-SG 2.05Å; C63-C88 PolarHBondContact SG-SG 2.05Å
64	H	40.5	Very low	38.5	Very low	88 Å²	88	67.3 Å²	67.3	41%	0.407	33%	0.326	S	S	.	.			trans	-70	153.4	174.7	-94.8	-17.2	0	0	0	111.2	D53 C62 R144	D53-H64 IonicContact OD1-CE1 3.55Å; D53-H64 IonicContact OD1-CG 3.82Å; D53-H64 IonicContact OD1-ND1 2.74Å; D53-H64 PolarHBondContact OD1-ND1 3.46Å; C62-H64 PolarHBondContact O-N 3.33Å; H64-R144 VanDerWaalsContact CE1-CD 3.41Å; H64-R144 WeakPolarHBondContact CE1-CD 3.47Å; H64-R144 PolarHBondContact CE1-NE 2.75Å
65	T	38.5	Very low	37.9	Very low	31 Å²	31	72 Å²	72	19%	0.19	35%	0.348	C	S	.	.			trans	-165.6	-175.5	136.9	17.1	0	0	0	0	108.3	Q51 F52 R144	Q51-T65 HydrophobicContact CB-CG2 4.25Å; Q51-T65 HydrophobicContact CG-CG2 3.69Å; F52-T65 PolarHBondContact N-OG1 2.82Å; T65-R144 PolarHBondContact O-NH2 2.86Å
66	E	28.2	Very low	37.3	Very low	128 Å²	128	72.2 Å²	72.2	60%	0.598	35%	0.346	S	S	*	.			trans	-88.3	153.5	-140.6	-73.4	156.5	170.2	0	0	118.7	Q51 I68	Q51-E66 PolarHBondContact OE1-OE2 2.78Å; E66-I68 VanDerWaalsContact C-N 3.3Å; E66-I68 PolarHBondContact O-N 2.81Å
67	E	28.6	Very low	36.8	Very low	133 Å²	133	77.4 Å²	77.4	62%	0.621	37%	0.37	S	S	*	.	S	Bend	trans	22.8	-30.1	169.2	-57.8	-147.7	85.7	0	0	124.7	Y69 K151	E67-Y69 VanDerWaalsContact C-N 3.33Å; E67-Y69 PolarHBondContact O-N 2.76Å; E67-Y69 VanDerWaalsContact O-N 3.1Å; E67-K151 IonicContact OE1-NZ 3.26Å; E67-K151 PolarHBondContact OE1-NZ 2.77Å
68	I	30.1	Very low	36.1	Very low	70 Å²	70	81.2 Å²	81.2	36%	0.359	39%	0.385	S	S	.	.	G	3₁₀ helix	trans	-63.4	-29.8	-155	-63.5	164.3	0	0	0	114.7	E66 L70 H72	E66-I68 VanDerWaalsContact C-N 3.3Å; E66-I68 PolarHBondContact O-N 2.81Å; I68-L70 VanDerWaalsContact C-N 3.29Å; I68-L70 PolarHBondContact O-N 3.43Å; I68-H72 HydrophobicContact CG2-CB 4.48Å
69	Y	32.4	Very low	35.7	Very low	106 Å²	106	80.2 Å²	80.2	42%	0.416	39%	0.387	S	S	.	.	G	3₁₀ helix	trans	-71.7	-3.8	-156.3	-138.3	-83.5	0	0	0	117	F52 E67 V73 W76	F52-Y69 HydrophobicContact CD1-CD2 4.1Å; F52-Y69 HydrophobicContact CD1-CE2 4.31Å; E67-Y69 VanDerWaalsContact C-N 3.33Å; E67-Y69 PolarHBondContact O-N 2.76Å; E67-Y69 VanDerWaalsContact O-N 3.1Å; Y69-V73 WeakPolarHBondContact O-CG2 3.19Å; Y69-W76 HydrophobicContact CD2-CZ2 4.34Å; Y69-W76 AromaticContact CE2-CH2 3.61Å; Y69-W76 HydrophobicContact CE2-CH2 3.61Å; Y69-W76 AromaticContact CE2-CZ2 3.69Å; Y69-W76 HydrophobicContact CE2-CZ2 3.69Å; Y69-W76 HydrophobicContact CE2-CZ3 4.24Å; Y69-W76 AromaticContact CZ-CH2 3.8Å; Y69-W76 WeakPolarHBondContact OH-CH2 3.47Å
70	L	31.8	Very low	35.4	Very low	41 Å²	41	82 Å²	82	22%	0.215	40%	0.398	C	S	.	.	G	3₁₀ helix	trans	-131.6	-6.2	-173.6	-89.1	156.3	0	0	0	116.4	I68 L148 I154 W157	I68-L70 VanDerWaalsContact C-N 3.29Å; I68-L70 PolarHBondContact O-N 3.43Å; L70-L148 HydrophobicContact CD1-CD1 3.99Å; L70-L148 HydrophobicContact CD1-CD2 3.67Å; L70-L148 HydrophobicContact CD1-CG 4.41Å; L70-I154 HydrophobicContact CB-CD1 3.64Å; L70-I154 HydrophobicContact CB-CG1 4.23Å; L70-I154 HydrophobicContact CD1-CD1 3.97Å; L70-I154 HydrophobicContact CD1-CG2 4.43Å; L70-I154 HydrophobicContact CG-CD1 4.27Å; L70-W157 HydrophobicContact CD2-CH2 4.42Å
71	E	29.8	Very low	34.8	Very low	106 Å²	106	83.1 Å²	83.1	50%	0.495	41%	0.409	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.7	-46.5	164.2	-85.9	114.7	-146.5	0	0	111.1	V73 K151	E71-V73 PolarHBondContact O-N 3.33Å; E71-K151 VanDerWaalsContact CD-NZ 3.31Å; E71-K151 WeakPolarHBondContact OE1-CD 3.23Å; E71-K151 IonicContact OE1-NZ 2.87Å; E71-K151 PolarHBondContact OE1-NZ 3.18Å; E71-K151 IonicContact OE2-NZ 2.93Å; E71-K151 PolarHBondContact OE2-NZ 3.42Å
72	H	34.3	Very low	34.8	Very low	86 Å²	86	88.1 Å²	88.1	40%	0.398	44%	0.441	S	S	.	.	S	Bend	trans	-89.5	16.3	-168.5	-61.6	79.8	0	0	0	115.2	I68 E74 E75 W76	I68-H72 HydrophobicContact CG2-CB 4.48Å; H72-E74 PolarHBondContact O-N 3.22Å; H72-E75 IonicContact CD2-OE2 2.75Å; H72-E75 PolarHBondContact CD2-OE2 2.98Å; H72-E75 VanDerWaalsContact CD2-OE2 3.24Å; H72-E75 PolarHBondContact O-N 3.24Å; H72-W76 HydrophobicContact CB-CB 4.24Å; H72-W76 WeakPolarHBondContact O-CB 3.1Å; H72-W76 PolarHBondContact O-N 3.09Å
73	V	35.4	Very low	34.6	Very low	53 Å²	53	94.5 Å²	94.5	32%	0.321	47%	0.465	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57	-26.8	-165.8	177.6	0	0	0	0	114.6	Y69 E71 H77	Y69-V73 WeakPolarHBondContact O-CG2 3.19Å; E71-V73 PolarHBondContact O-N 3.33Å; V73-H77 PolarHBondContact O-CD2 3.06Å; V73-H77 VanDerWaalsContact O-CD2 3.28Å
74	E	27.8	Very low	34.5	Very low	169 Å²	169	96.8 Å²	96.8	79%	0.79	48%	0.475	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.6	-41.6	-178.9	-74.6	163.9	169.8	0	0	112.1	H72	H72-E74 PolarHBondContact O-N 3.22Å
75	E	31.4	Very low	34.4	Very low	109 Å²	109	94.9 Å²	94.9	51%	0.509	47%	0.47	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.9	-40.7	172	-61.8	174.2	119.5	0	0	112.9	H72 H77 Q78 N79	H72-E75 IonicContact CD2-OE2 2.75Å; H72-E75 PolarHBondContact CD2-OE2 2.98Å; H72-E75 VanDerWaalsContact CD2-OE2 3.24Å; H72-E75 PolarHBondContact O-N 3.24Å; E75-H77 PolarHBondContact O-N 2.74Å; E75-Q78 WeakPolarHBondContact O-CA 3.23Å; E75-Q78 WeakPolarHBondContact O-CB 3.38Å; E75-Q78 PolarHBondContact O-N 3.16Å; E75-N79 PolarHBondContact O-N 3.34Å
76	W	34.7	Very low	34.6	Very low	43 Å²	43	94.5 Å²	94.5	16%	0.163	47%	0.465	C	S	.	.	H	α-helix	trans	-63.7	-24.5	179.9	-166.4	93.4	0	0	0	111.6	F52 Y69 H72 Q78 V80	F52-W76 HydrophobicContact CD1-CZ2 4.05Å; F52-W76 AromaticContact CE1-CE2 3.72Å; F52-W76 AromaticContact CE1-CZ2 3.5Å; F52-W76 HydrophobicContact CE1-CZ2 3.5Å; F52-W76 VanDerWaalsContact CE1-CZ2 3.5Å; F52-W76 AromaticContact CE1-NE1 3.38Å; F52-W76 HydrophobicContact CE2-CZ2 4.13Å; F52-W76 AromaticContact CZ-CE2 3.88Å; F52-W76 AromaticContact CZ-CZ2 3.55Å; F52-W76 HydrophobicContact CZ-CZ2 3.55Å; F52-W76 AromaticContact CZ-NE1 3.6Å; Y69-W76 HydrophobicContact CD2-CZ2 4.34Å; Y69-W76 AromaticContact CE2-CH2 3.61Å; Y69-W76 HydrophobicContact CE2-CH2 3.61Å; Y69-W76 AromaticContact CE2-CZ2 3.69Å; Y69-W76 HydrophobicContact CE2-CZ2 3.69Å; Y69-W76 HydrophobicContact CE2-CZ3 4.24Å; Y69-W76 AromaticContact CZ-CH2 3.8Å; Y69-W76 WeakPolarHBondContact OH-CH2 3.47Å; H72-W76 HydrophobicContact CB-CB 4.24Å; H72-W76 WeakPolarHBondContact O-CB 3.1Å; H72-W76 PolarHBondContact O-N 3.09Å; W76-Q78 VanDerWaalsContact C-N 3.33Å; W76-V80 HydrophobicContact CD2-CG2 3.45Å; W76-V80 VanDerWaalsContact CD2-CG2 3.45Å; W76-V80 HydrophobicContact CE3-CG2 3.98Å; W76-V80 HydrophobicContact CG-CG2 3.69Å; W76-V80 HydrophobicContact CH2-CG2 4.34Å; W76-V80 HydrophobicContact CZ2-CG2 3.87Å; W76-V80 HydrophobicContact CZ3-CG2 4.39Å; W76-V80 WeakPolarHBondContact O-CB 3.46Å; W76-V80 WeakPolarHBondContact O-CG2 3.41Å; W76-V80 PolarHBondContact O-N 3.38Å
77	H	35.9	Very low	35.1	Very low	108 Å²	108	93.1 Å²	93.1	50%	0.5	46%	0.46	S	S	.	.	H	α-helix	trans	-77.5	-14.3	170.5	-89	-33	0	0	0	114.5	V73 E75 H108	V73-H77 PolarHBondContact O-CD2 3.06Å; V73-H77 VanDerWaalsContact O-CD2 3.28Å; E75-H77 PolarHBondContact O-N 2.74Å; H77-H108 AromaticContact NE2-ND1 3.92Å
78	Q	36	Very low	36	Very low	161 Å²	161	86.8 Å²	86.8	75%	0.752	43%	0.43	S	S	*	.	H	α-helix	trans	-94.7	-42.4	171.8	-56.6	-179	7.4	0	0	111	E75 W76	E75-Q78 WeakPolarHBondContact O-CA 3.23Å; E75-Q78 WeakPolarHBondContact O-CB 3.38Å; E75-Q78 PolarHBondContact O-N 3.16Å; W76-Q78 VanDerWaalsContact C-N 3.33Å
79	N	36.6	Very low	36.6	Very low	121 Å²	121	89 Å²	89	65%	0.647	44%	0.443	S	S	*	.	H	α-helix	trans	-92.9	-13.5	-167.6	-65.8	-20	0	0	0	115.6	E75 V81	E75-N79 PolarHBondContact O-N 3.34Å; N79-V81 PolarHBondContact O-N 2.87Å
80	V	37.4	Very low	37	Very low	44 Å²	44	87.6 Å²	87.6	27%	0.267	45%	0.445	S	S	.	.			trans	-78.3	109.5	179.6	170.6	0	0	0	0	112.6	W76 P82	W76-V80 HydrophobicContact CD2-CG2 3.45Å; W76-V80 VanDerWaalsContact CD2-CG2 3.45Å; W76-V80 HydrophobicContact CE3-CG2 3.98Å; W76-V80 HydrophobicContact CG-CG2 3.69Å; W76-V80 HydrophobicContact CH2-CG2 4.34Å; W76-V80 HydrophobicContact CZ2-CG2 3.87Å; W76-V80 HydrophobicContact CZ3-CG2 4.39Å; W76-V80 WeakPolarHBondContact O-CB 3.46Å; W76-V80 WeakPolarHBondContact O-CG2 3.41Å; W76-V80 PolarHBondContact O-N 3.38Å; V80-P82 VanDerWaalsContact O-CD 3.23Å; V80-P82 WeakPolarHBondContact O-CD 3.47Å
81	V	35.7	Very low	37.7	Very low	85 Å²	85	87.2 Å²	87.2	52%	0.515	45%	0.446	S	S	.	.			trans	-59.8	118.3	166.9	-174.7	0	0	0	0	109.7	N79 K83	N79-V81 PolarHBondContact O-N 2.87Å; V81-K83 HydrophobicContact CG1-CB 4.01Å; V81-K83 HydrophobicContact CG1-CD 3.99Å; V81-K83 HydrophobicContact CG1-CG 3.93Å; V81-K83 PolarHBondContact O-N 2.88Å
82	P	38.5	Very low	38	Very low	127 Å²	127	84.5 Å²	84.5	83%	0.825	45%	0.446	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.9	28.2	-174.1	-22.1	35.5	0	0	0	116.5	V80	V80-P82 VanDerWaalsContact O-CD 3.23Å; V80-P82 WeakPolarHBondContact O-CD 3.47Å
83	K	41.5	Very low	38.5	Very low	173 Å²	173	83 Å²	83	75%	0.752	44%	0.439	S	S	*	.	T	Hydrogen-bonded Turn	trans	-120.6	-8.9	-167	-61.7	-178.8	-179.3	177	0	115.4	V81	V81-K83 HydrophobicContact CG1-CB 4.01Å; V81-K83 HydrophobicContact CG1-CD 3.99Å; V81-K83 HydrophobicContact CG1-CG 3.93Å; V81-K83 PolarHBondContact O-N 2.88Å
84	Q	39.6	Very low	38.7	Very low	51 Å²	51	85.7 Å²	85.7	24%	0.238	45%	0.451	C	S	.	.			trans	-69.1	153.1	-173.9	-78.4	177.2	-15.1	0	0	113.6	Q48 Y86	Q48-Q84 PolarHBondContact O-NE2 3.13Å; Q84-Y86 HydrophobicContact CB-CE1 3.81Å
85	T	37.7	Very low	39.4	Very low	48 Å²	48	77.9 Å²	77.9	29%	0.294	42%	0.415	S	S	.	.			trans	-116.1	114.1	-175.4	-53.5	0	0	0	0	109.8	L94 H96	T85-L94 HydrophobicContact CG2-CB 4.06Å; T85-L94 HydrophobicContact CG2-CD2 3.84Å; T85-L94 HydrophobicContact CG2-CG 4.49Å; T85-H96 VanDerWaalsContact CG2-CE1 3.41Å; T85-H96 WeakPolarHBondContact CG2-CE1 3.15Å; T85-H96 WeakPolarHBondContact CG2-ND1 2.99Å; T85-H96 PolarHBondContact OG1-CE1 3.09Å; T85-H96 PolarHBondContact OG1-ND1 2.05Å
86	Y	43.4	Very low	39.9	Very low	23 Å²	23	79.1 Å²	79.1	9%	0.09	42%	0.421	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	115.7	-172	-45.6	-68.5	0	0	0	110.4	F52 Y54 Q84 L94 S95 I98	F52-Y86 AromaticContact CD2-CD1 3.94Å; F52-Y86 HydrophobicContact CD2-CD1 3.94Å; F52-Y86 AromaticContact CD2-CE1 3.53Å; F52-Y86 HydrophobicContact CD2-CE1 3.53Å; F52-Y86 HydrophobicContact CE2-CD1 4.48Å; F52-Y86 AromaticContact CE2-CE1 3.7Å; F52-Y86 HydrophobicContact CE2-CE1 3.7Å; Y54-Y86 PolarHBondContact OH-O 3.13Å; Q84-Y86 HydrophobicContact CB-CE1 3.81Å; Y86-L94 CarbonylContact O-C 3.44Å; Y86-S95 VanDerWaalsContact CD2-O 3.23Å; Y86-S95 WeakPolarHBondContact CD2-O 3.31Å; Y86-S95 PolarHBondContact N-O 3Å; Y86-S95 PolarHBondContact O-N 3.35Å; Y86-S95 PolarHBondContact O-OG 3.18Å; Y86-S95 VanDerWaalsContact O-OG 3.1Å; Y86-I98 HydrophobicContact CD2-CD1 4.27Å; Y86-I98 HydrophobicContact CD2-CG1 3.66Å; Y86-I98 HydrophobicContact CE2-CD1 3.85Å; Y86-I98 HydrophobicContact CE2-CG1 3.69Å; Y86-I98 HydrophobicContact CG-CG1 4.35Å
87	M	38.6	Very low	40.1	Very low	98 Å²	98	79.9 Å²	79.9	48%	0.483	43%	0.428	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	124.8	173.7	-174	175.6	65.5	0	0	110	Y54 N89 L94	Y54-M87 PolarHBondContact OH-O 2.88Å; M87-N89 PolarHBondContact O-N 2.87Å; M87-L94 HydrophobicContact CB-CD2 3.8Å; M87-L94 HydrophobicContact CG-CD2 4.21Å
88	C	46.8	Very low	40.1	Very low	0 Å²	0	76.6 Å²	76.6	0%	0	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	116.1	-178.6	176.1	0	0	0	0	110.8	Y54 C56 C63 T90 C91 G92 H93	Y54-C88 HydrophobicContact CE2-CB 4.27Å; Y54-C88 WeakPolarHBondContact OH-CA 3.35Å; Y54-C88 WeakPolarHBondContact OH-CB 3.07Å; Y54-C88 PolarHBondContact OH-N 3.15Å; C56-C88 HydrophobicContact CB-CB 3.84Å; C56-C88 VanDerWaalsContact CB-SG 3.54Å; C63-C88 HydrophobicContact CB-CB 4.12Å; C63-C88 WeakPolarHBondContact CB-SG 3.38Å; C63-C88 WeakPolarHBondContact SG-CB 3.42Å; C63-C88 CovalentContact SG-SG 2.05Å; C63-C88 PolarHBondContact SG-SG 2.05Å; C88-T90 PolarHBondContact O-N 3.25Å; C88-T90 PolarHBondContact SG-N 2.97Å; C88-C91 PolarHBondContact O-N 2.86Å; C88-G92 PolarHBondContact O-N 3.2Å; C88-H93 PolarHBondContact N-O 3.34Å; C88-H93 VanDerWaalsContact N-O 3.15Å
89	N	43.8	Very low	40	Very low	118 Å²	118	70.4 Å²	70.4	63%	0.631	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-48.4	-32.6	176.9	-58.9	-6	0	0	0	113	M87	M87-N89 PolarHBondContact O-N 2.87Å
90	T	41.1	Very low	39.8	Very low	75 Å²	75	70 Å²	70	46%	0.46	38%	0.382	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.7	-11.6	-179.8	-27.8	0	0	0	0	115.3	V61 C88	V61-T90 HydrophobicContact CB-CG2 4.32Å; V61-T90 HydrophobicContact CG1-CG2 4.22Å; V61-T90 HydrophobicContact CG2-CG2 4.18Å; C88-T90 PolarHBondContact O-N 3.25Å; C88-T90 PolarHBondContact SG-N 2.97Å
91	C	45	Very low	39.5	Very low	34 Å²	34	70.9 Å²	70.9	23%	0.23	38%	0.384	C	S	.	.	T	Hydrogen-bonded Turn	trans	-160.7	11	-177.4	72.2	0	0	0	0	117.6	C56 K58 C59 C88 H93	C56-C91 PolarHBondContact SG-SG 3.25Å; K58-C91 HydrophobicContact CD-CB 4.42Å; K58-C91 PolarHBondContact NZ-O 2.93Å; K58-C91 VanDerWaalsContact NZ-O 3.13Å; C59-C91 HydrophobicContact CB-CB 4.02Å; C59-C91 VanDerWaalsContact SG-SG 3.6Å; C88-C91 PolarHBondContact O-N 2.86Å; C91-H93 PolarHBondContact O-N 2.76Å; C91-H93 VanDerWaalsContact O-N 3.13Å; C91-H93 WeakPolarHBondContact SG-CB 3.37Å
92	G	36.4	Very low	39.2	Very low	48 Å²	48	75.3 Å²	75.3	50%	0.495	40%	0.396	S	S	.	.	T	Hydrogen-bonded Turn	trans	66.2	7.8	-178.9	0	0	0	0	0	115.3	C88 L94	C88-G92 PolarHBondContact O-N 3.2Å; G92-L94 PolarHBondContact O-N 3.34Å; G92-L94 VanDerWaalsContact O-N 3.07Å
93	H	46	Very low	38.8	Very low	56 Å²	56	77 Å²	77	26%	0.259	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	104.3	-174.9	179.8	-74.8	0	0	0	111.5	K58 C88 C91 S95	K58-H93 HydrophobicContact CB-CB 3.95Å; K58-H93 HydrophobicContact CD-CB 3.94Å; C88-H93 PolarHBondContact N-O 3.34Å; C88-H93 VanDerWaalsContact N-O 3.15Å; C91-H93 PolarHBondContact O-N 2.76Å; C91-H93 VanDerWaalsContact O-N 3.13Å; C91-H93 WeakPolarHBondContact SG-CB 3.37Å; H93-S95 PolarHBondContact O-N 2.77Å
94	L	38.5	Very low	38.3	Very low	108 Å²	108	70.8 Å²	70.8	57%	0.565	36%	0.359	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-61.7	120.1	165	-68	168.3	0	0	0	110.4	T85 Y86 M87 G92	T85-L94 HydrophobicContact CG2-CB 4.06Å; T85-L94 HydrophobicContact CG2-CD2 3.84Å; T85-L94 HydrophobicContact CG2-CG 4.49Å; Y86-L94 CarbonylContact O-C 3.44Å; M87-L94 HydrophobicContact CB-CD2 3.8Å; M87-L94 HydrophobicContact CG-CD2 4.21Å; G92-L94 PolarHBondContact O-N 3.34Å; G92-L94 VanDerWaalsContact O-N 3.07Å
95	S	42.1	Very low	37.8	Very low	5 Å²	5	74.6 Å²	74.6	4%	0.035	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	112.4	174.7	48.5	0	0	0	0	110.9	Y54 Y86 H93 N97	Y54-S95 WeakPolarHBondContact CE2-OG 3.29Å; Y86-S95 VanDerWaalsContact CD2-O 3.23Å; Y86-S95 WeakPolarHBondContact CD2-O 3.31Å; Y86-S95 PolarHBondContact N-O 3Å; Y86-S95 PolarHBondContact O-N 3.35Å; Y86-S95 PolarHBondContact O-OG 3.18Å; Y86-S95 VanDerWaalsContact O-OG 3.1Å; H93-S95 PolarHBondContact O-N 2.77Å; S95-N97 WeakPolarHBondContact CB-O 3.44Å; S95-N97 PolarHBondContact O-N 3.1Å
96	H	41.9	Very low	37.5	Very low	136 Å²	136	78.1 Å²	78.1	63%	0.63	39%	0.39	S	S	*	.	S	Bend	trans	-67.4	6.5	159.6	-42.1	-79.5	0	0	0	112.7	T85	T85-H96 VanDerWaalsContact CG2-CE1 3.41Å; T85-H96 WeakPolarHBondContact CG2-CE1 3.15Å; T85-H96 WeakPolarHBondContact CG2-ND1 2.99Å; T85-H96 PolarHBondContact OG1-CE1 3.09Å; T85-H96 PolarHBondContact OG1-ND1 2.05Å
97	N	40	Very low	36.8	Very low	59 Å²	59	79.4 Å²	79.4	32%	0.316	40%	0.4	S	S	.	.			trans	-135.7	99.8	174.9	-74.9	-97.9	0	0	0	108.2	S95	S95-N97 WeakPolarHBondContact CB-O 3.44Å; S95-N97 PolarHBondContact O-N 3.1Å
98	I	35.8	Very low	36.5	Very low	38 Å²	38	81 Å²	81	20%	0.195	41%	0.406	C	S	.	.			trans	-38.6	141.7	140.2	-67	168.1	0	0	0	106.9	Y86 L100	Y86-I98 HydrophobicContact CD2-CD1 4.27Å; Y86-I98 HydrophobicContact CD2-CG1 3.66Å; Y86-I98 HydrophobicContact CE2-CD1 3.85Å; Y86-I98 HydrophobicContact CE2-CG1 3.69Å; Y86-I98 HydrophobicContact CG-CG1 4.35Å; I98-L100 PolarHBondContact O-N 3.12Å
99	I	33.9	Very low	36	Very low	31 Å²	31	90 Å²	90	16%	0.159	44%	0.439	C	S	.	.			trans	-64.1	91.8	173.1	-73.8	179.6	0	0	0	109.2	I55 N57 H101	I55-I99 HydrophobicContact CB-CB 4.42Å; I55-I99 HydrophobicContact CB-CD1 4.06Å; I55-I99 HydrophobicContact CG2-CD1 3.92Å; I55-I99 WeakPolarHBondContact O-CD1 3.5Å; I55-I99 WeakPolarHBondContact O-CG1 3.45Å; N57-I99 HydrophobicContact CB-CD1 4.49Å; N57-I99 WeakPolarHBondContact ND2-CG1 3.35Å; N57-I99 WeakPolarHBondContact OD1-CD1 3.34Å; N57-I99 WeakPolarHBondContact OD1-CG1 3.49Å; I99-H101 HydrophobicContact CG2-CB 4.06Å; I99-H101 PolarHBondContact O-N 2.8Å
100	L	33.1	Very low	35.8	Very low	113 Å²	113	85.1 Å²	85.1	59%	0.592	42%	0.415	S	S	*	.			trans	-65.4	68.2	157.5	-78.2	167.2	0	0	0	107.1	I98 K102 H104	I98-L100 PolarHBondContact O-N 3.12Å; L100-K102 PolarHBondContact O-N 3.37Å; L100-K102 VanDerWaalsContact O-N 3.15Å; L100-H104 HydrophobicContact CD2-CB 4.33Å
101	H	29.4	Very low	35.9	Very low	63 Å²	63	83.5 Å²	83.5	29%	0.292	40%	0.403	S	S	.	.			trans	-47.2	126.2	169.6	-149.8	-70	0	0	0	105.5	I99 R103 H104	I99-H101 HydrophobicContact CG2-CB 4.06Å; I99-H101 PolarHBondContact O-N 2.8Å; H101-R103 CarbonylContact O-C 3.21Å; H101-R103 PolarHBondContact O-N 3.38Å; H101-H104 PolarHBondContact O-CD2 2.79Å; H101-H104 VanDerWaalsContact O-CD2 3.3Å; H101-H104 PolarHBondContact O-N 3.18Å
102	K	31.3	Very low	35.8	Very low	177 Å²	177	83.7 Å²	83.7	77%	0.77	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.9	25.6	-156.9	-70.7	165.5	178.1	159.6	0	115.6	L100	L100-K102 PolarHBondContact O-N 3.37Å; L100-K102 VanDerWaalsContact O-N 3.15Å
103	R	28.7	Very low	36.3	Very low	164 Å²	164	82.7 Å²	82.7	62%	0.619	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	-132.2	20.4	173.9	-60.9	177	173.8	160.8	-3.7	112.5	H101	H101-R103 CarbonylContact O-C 3.21Å; H101-R103 PolarHBondContact O-N 3.38Å
104	H	31.3	Very low	36.4	Very low	42 Å²	42	80.2 Å²	80.2	19%	0.194	38%	0.375	C	S	.	.			trans	-94.4	-4.5	173.6	-80.8	-125	0	0	0	113.7	L100 H101 M106 V107 F116	L100-H104 HydrophobicContact CD2-CB 4.33Å; H101-H104 PolarHBondContact O-CD2 2.79Å; H101-H104 VanDerWaalsContact O-CD2 3.3Å; H101-H104 PolarHBondContact O-N 3.18Å; H104-M106 CarbonylContact O-C 3.57Å; H104-M106 PolarHBondContact O-N 3.48Å; H104-M106 VanDerWaalsContact O-N 3.1Å; H104-V107 HydrophobicContact CB-CG2 4.21Å; H104-V107 PolarHBondContact O-N 3.05Å; H104-F116 AromaticContact CE1-CD2 3.33Å; H104-F116 WeakPolarHBondContact CE1-CD2 3.47Å; H104-F116 AromaticContact CE1-CE2 3.55Å; H104-F116 AromaticContact CE1-CG 3.86Å; H104-F116 AromaticContact NE2-CD2 3.11Å; H104-F116 WeakPolarHBondContact NE2-CD2 3.45Å; H104-F116 AromaticContact NE2-CE2 3.54Å; H104-F116 AromaticContact NE2-CG 3.91Å
105	K	29.6	Very low	36.9	Very low	131 Å²	131	78.1 Å²	78.1	57%	0.57	36%	0.363	S	S	*	.	S	Bend	trans	-59.7	118	161.1	-77.1	-163.8	172.3	-173	0	108	K676 S678	K105-K676 VanDerWaalsContact CE-O 3.23Å; K105-K676 WeakPolarHBondContact CE-O 3.09Å; K105-K676 PolarHBondContact NZ-O 3.32Å; K105-S678 PolarHBondContact NZ-OG 3.43Å
106	M	30.2	Very low	37.2	Very low	122 Å²	122	81.4 Å²	81.4	60%	0.601	38%	0.377	S	S	*	.			trans	63.3	92.4	-157.1	-49	-159.4	165.2	0	0	113.9	H104 N112	H104-M106 CarbonylContact O-C 3.57Å; H104-M106 PolarHBondContact O-N 3.48Å; H104-M106 VanDerWaalsContact O-N 3.1Å; M106-N112 WeakPolarHBondContact O-CB 3.31Å; M106-N112 PolarHBondContact O-ND2 2.99Å
107	V	29.4	Very low	37.7	Very low	50 Å²	50	76.4 Å²	76.4	30%	0.303	35%	0.354	S	S	.	.			trans	-97.8	-0.8	143.3	-168.6	0	0	0	0	111.3	H104 R109 N112 V113	H104-V107 HydrophobicContact CB-CG2 4.21Å; H104-V107 PolarHBondContact O-N 3.05Å; V107-R109 PolarHBondContact O-N 3.17Å; V107-N112 HydrophobicContact CB-CB 4.39Å; V107-N112 HydrophobicContact CG1-CB 4.19Å; V107-V113 HydrophobicContact CG1-CG2 4.05Å
108	H	32.1	Very low	38.2	Very low	130 Å²	130	74.1 Å²	74.1	60%	0.602	34%	0.343	S	S	*	.	S	Bend	trans	-56.1	10.2	178.5	-40.9	-60.7	0	0	0	117.5	H77	H77-H108 AromaticContact NE2-ND1 3.92Å
109	R	37.4	Very low	38.9	Very low	189 Å²	189	73.1 Å²	73.1	71%	0.713	34%	0.337	S	S	*	.	S	Bend	trans	-145.6	137.3	172.6	-65.2	-170.5	175.5	179.3	-2.8	108.6	V107 D111 N112	V107-R109 PolarHBondContact O-N 3.17Å; R109-D111 HydrophobicContact CB-CB 4.31Å; R109-D111 PolarHBondContact O-N 3.05Å; R109-N112 WeakPolarHBondContact O-CB 3.41Å; R109-N112 PolarHBondContact O-N 3.42Å; R109-N112 PolarHBondContact O-ND2 2.93Å; R109-N112 VanDerWaalsContact O-ND2 3.09Å
110	C	39.5	Very low	39.7	Very low	17 Å²	17	72.3 Å²	72.3	12%	0.115	33%	0.333	C	S	.	.	T	Hydrogen-bonded Turn	trans	-50.6	-36.1	-174.4	-37.3	0	0	0	0	113.9	N112 V113 W157 A161 R164	C110-N112 PolarHBondContact O-N 2.87Å; C110-V113 PolarHBondContact O-N 3.26Å; C110-V113 VanDerWaalsContact O-N 3.15Å; C110-W157 VanDerWaalsContact CA-CH2 3.42Å; C110-W157 HydrophobicContact CB-CD2 3.79Å; C110-W157 HydrophobicContact CB-CE3 3.82Å; C110-W157 HydrophobicContact CB-CH2 3.62Å; C110-W157 HydrophobicContact CB-CZ2 3.55Å; C110-W157 HydrophobicContact CB-CZ3 3.73Å; C110-W157 WeakPolarHBondContact SG-CZ2 3.36Å; C110-W157 PolarHBondContact SG-NE1 3.04Å; C110-W157 VanDerWaalsContact SG-NE1 3.44Å; C110-A161 HydrophobicContact CB-CB 3.68Å; C110-R164 PolarHBondContact SG-NH2 3.14Å
111	D	41.8	Very low	40.6	Very low	41 Å²	41	67.1 Å²	67.1	22%	0.219	31%	0.306	C	S	.	.	H	α-helix	trans	-31.3	-43.8	162	-106.1	53.2	0	0	0	114.9	R109 M115 R165	R109-D111 HydrophobicContact CB-CB 4.31Å; R109-D111 PolarHBondContact O-N 3.05Å; D111-M115 PolarHBondContact O-N 3.09Å; D111-M115 VanDerWaalsContact O-N 3.09Å; D111-R165 VanDerWaalsContact CG-CZ 3.44Å; D111-R165 PolarHBondContact O-NH1 2.91Å; D111-R165 PolarHBondContact O-NH2 2.73Å; D111-R165 VanDerWaalsContact OD1-CG 3.27Å; D111-R165 WeakPolarHBondContact OD1-CG 3.2Å; D111-R165 IonicContact OD1-NE 3.64Å; D111-R165 WeakPolarHBondContact OD2-CG 3.45Å; D111-R165 IonicContact OD2-CZ 3.09Å; D111-R165 IonicContact OD2-NE 2.73Å; D111-R165 PolarHBondContact OD2-NE 3.1Å; D111-R165 IonicContact OD2-NH2 2.75Å; D111-R165 PolarHBondContact OD2-NH2 3.49Å
112	N	43.4	Very low	41.7	Very low	38 Å²	38	67.4 Å²	67.4	20%	0.203	31%	0.308	C	S	.	.	H	α-helix	trans	-80	-26.4	-168.9	-64.7	-54	0	0	0	112.9	M106 V107 R109 C110 M115 F116	M106-N112 WeakPolarHBondContact O-CB 3.31Å; M106-N112 PolarHBondContact O-ND2 2.99Å; V107-N112 HydrophobicContact CB-CB 4.39Å; V107-N112 HydrophobicContact CG1-CB 4.19Å; R109-N112 WeakPolarHBondContact O-CB 3.41Å; R109-N112 PolarHBondContact O-N 3.42Å; R109-N112 PolarHBondContact O-ND2 2.93Å; R109-N112 VanDerWaalsContact O-ND2 3.09Å; C110-N112 PolarHBondContact O-N 2.87Å; N112-M115 CarbonylContact O-C 3.54Å; N112-M115 PolarHBondContact O-N 3.32Å; N112-F116 WeakPolarHBondContact O-CB 3.45Å; N112-F116 PolarHBondContact O-N 3Å
113	V	46.7	Very low	42.6	Very low	27 Å²	27	60.3 Å²	60.3	16%	0.164	28%	0.28	C	S	.	.	H	α-helix	trans	-66.9	-47.1	170	176.9	0	0	0	0	110.2	V107 C110 M115 F116 M117 W157 L158	V107-V113 HydrophobicContact CG1-CG2 4.05Å; C110-V113 PolarHBondContact O-N 3.26Å; C110-V113 VanDerWaalsContact O-N 3.15Å; V113-M115 PolarHBondContact O-N 3.2Å; V113-F116 WeakPolarHBondContact O-CA 3.43Å; V113-F116 WeakPolarHBondContact O-CB 3.08Å; V113-F116 PolarHBondContact O-N 3.26Å; V113-M117 HydrophobicContact CG1-SD 4.22Å; V113-M117 PolarHBondContact O-N 2.75Å; V113-W157 HydrophobicContact CB-CH2 4.21Å; V113-W157 HydrophobicContact CB-CZ3 4.04Å; V113-W157 HydrophobicContact CG1-CZ3 4.46Å; V113-W157 HydrophobicContact CG2-CH2 3.73Å; V113-W157 HydrophobicContact CG2-CZ3 4.06Å; V113-L158 HydrophobicContact CG1-CD2 4.4Å
114	L	48.5	Very low	43.6	Very low	4 Å²	4	53.1 Å²	53.1	2%	0.021	25%	0.254	C	S	.	.	H	α-helix	trans	-56.8	-35.1	171.3	-75.5	172.7	0	0	0	112.3	C118 L158 A161 A162 W172 L184	L114-C118 PolarHBondContact O-N 3.04Å; L114-C118 PolarHBondContact O-SG 3.01Å; L114-L158 HydrophobicContact CD2-CD2 3.82Å; L114-L158 HydrophobicContact CG-CD2 3.83Å; L114-A161 HydrophobicContact CD1-CB 3.69Å; L114-A162 HydrophobicContact CD1-CB 4.47Å; L114-W172 HydrophobicContact CD1-CH2 4.44Å; L114-L184 HydrophobicContact CD2-CD2 3.54Å
115	M	50	Low	44.6	Very low	64 Å²	64	54.9 Å²	54.9	32%	0.315	27%	0.268	S	S	.	.	H	α-helix	trans	-81.4	-18.2	174.2	-73.8	-61.5	-58.8	0	0	113.8	D111 N112 V113 K119	D111-M115 PolarHBondContact O-N 3.09Å; D111-M115 VanDerWaalsContact O-N 3.09Å; N112-M115 CarbonylContact O-C 3.54Å; N112-M115 PolarHBondContact O-N 3.32Å; V113-M115 PolarHBondContact O-N 3.2Å; M115-K119 WeakPolarHBondContact O-CD 3.36Å; M115-K119 WeakPolarHBondContact O-CE 3.26Å; M115-K119 WeakPolarHBondContact O-CG 3.47Å; M115-K119 PolarHBondContact O-N 3.46Å; M115-K119 PolarHBondContact O-NZ 2.98Å; M115-K119 VanDerWaalsContact O-NZ 3.13Å
116	F	47.5	Very low	45.6	Very low	74 Å²	74	55.5 Å²	55.5	33%	0.325	27%	0.273	S	S	.	.	H	α-helix	trans	-74.1	-54.8	174.8	170.4	-126.9	0	0	0	108.5	H104 N112 V113 C118 K119 V120	H104-F116 AromaticContact CE1-CD2 3.33Å; H104-F116 WeakPolarHBondContact CE1-CD2 3.47Å; H104-F116 AromaticContact CE1-CE2 3.55Å; H104-F116 AromaticContact CE1-CG 3.86Å; H104-F116 AromaticContact NE2-CD2 3.11Å; H104-F116 WeakPolarHBondContact NE2-CD2 3.45Å; H104-F116 AromaticContact NE2-CE2 3.54Å; H104-F116 AromaticContact NE2-CG 3.91Å; N112-F116 WeakPolarHBondContact O-CB 3.45Å; N112-F116 PolarHBondContact O-N 3Å; V113-F116 WeakPolarHBondContact O-CA 3.43Å; V113-F116 WeakPolarHBondContact O-CB 3.08Å; V113-F116 PolarHBondContact O-N 3.26Å; F116-C118 PolarHBondContact O-N 3.04Å; F116-K119 CarbonylContact O-C 3.42Å; F116-K119 WeakPolarHBondContact O-CA 3.23Å; F116-K119 WeakPolarHBondContact O-CB 3.21Å; F116-K119 PolarHBondContact O-N 3.33Å; F116-V120 HydrophobicContact CD2-CG2 3.78Å; F116-V120 HydrophobicContact CE1-CG2 4.31Å; F116-V120 HydrophobicContact CE2-CG2 3.46Å; F116-V120 VanDerWaalsContact CE2-CG2 3.46Å; F116-V120 HydrophobicContact CG-CG2 4.36Å; F116-V120 HydrophobicContact CZ-CG2 3.75Å; F116-V120 WeakPolarHBondContact O-CG2 3.15Å; F116-V120 PolarHBondContact O-N 3.41Å
117	M	51.5	Low	46.4	Very low	30 Å²	30	52.3 Å²	52.3	15%	0.148	26%	0.258	C	S	.	.	H	α-helix	trans	-56.4	-45.7	177.3	-60.7	162	57.3	0	0	112.8	V113 K119 V120 E121 Y145 L184	V113-M117 HydrophobicContact CG1-SD 4.22Å; V113-M117 PolarHBondContact O-N 2.75Å; M117-K119 PolarHBondContact O-N 2.82Å; M117-V120 PolarHBondContact O-N 3.46Å; M117-V120 VanDerWaalsContact O-N 3.15Å; M117-E121 PolarHBondContact O-N 2.79Å; M117-Y145 HydrophobicContact CE-CD2 3.21Å; M117-Y145 HydrophobicContact CE-CE2 3.42Å; M117-Y145 VanDerWaalsContact CE-CE2 3.42Å; M117-Y145 HydrophobicContact CE-CG 4.31Å; M117-L184 HydrophobicContact CB-CD1 4.43Å; M117-L184 HydrophobicContact CE-CD1 4.24Å; M117-L184 HydrophobicContact CE-CD2 3.66Å; M117-L184 HydrophobicContact CE-CG 4.04Å; M117-L184 HydrophobicContact SD-CD2 4.45Å
118	C	50.6	Low	47.4	Very low	11 Å²	11	58.9 Å²	58.9	7%	0.074	28%	0.282	C	S	.	.	H	α-helix	trans	-59.7	-27.9	174.7	-69.3	0	0	0	0	113.5	L114 F116 Q122	L114-C118 PolarHBondContact O-N 3.04Å; L114-C118 PolarHBondContact O-SG 3.01Å; F116-C118 PolarHBondContact O-N 3.04Å; C118-Q122 WeakPolarHBondContact O-CG 3.26Å; C118-Q122 PolarHBondContact O-N 3.23Å; C118-Q122 PolarHBondContact O-NE2 2.91Å
119	K	51.1	Low	47.9	Very low	17 Å²	17	58 Å²	58	7%	0.074	29%	0.286	C	S	.	.	H	α-helix	trans	-84.1	-36.2	175.4	-67.9	162	-152.1	140.8	0	111.4	M115 F116 M117 Q122 S123	M115-K119 WeakPolarHBondContact O-CD 3.36Å; M115-K119 WeakPolarHBondContact O-CE 3.26Å; M115-K119 WeakPolarHBondContact O-CG 3.47Å; M115-K119 PolarHBondContact O-N 3.46Å; M115-K119 PolarHBondContact O-NZ 2.98Å; M115-K119 VanDerWaalsContact O-NZ 3.13Å; F116-K119 CarbonylContact O-C 3.42Å; F116-K119 WeakPolarHBondContact O-CA 3.23Å; F116-K119 WeakPolarHBondContact O-CB 3.21Å; F116-K119 PolarHBondContact O-N 3.33Å; M117-K119 PolarHBondContact O-N 2.82Å; K119-Q122 PolarHBondContact O-N 2.84Å; K119-S123 WeakPolarHBondContact O-CB 3.19Å; K119-S123 PolarHBondContact O-N 3.08Å; K119-S123 PolarHBondContact O-OG 3.03Å
120	V	51.1	Low	48.6	Very low	15 Å²	15	51 Å²	51	9%	0.091	27%	0.273	C	S	.	.	H	α-helix	trans	-60	-51.6	175.5	170.5	0	0	0	0	109.2	I55 F116 M117 Q122 S123 L124 I141	I55-V120 HydrophobicContact CD1-CG2 4.47Å; F116-V120 HydrophobicContact CD2-CG2 3.78Å; F116-V120 HydrophobicContact CE1-CG2 4.31Å; F116-V120 HydrophobicContact CE2-CG2 3.46Å; F116-V120 VanDerWaalsContact CE2-CG2 3.46Å; F116-V120 HydrophobicContact CG-CG2 4.36Å; F116-V120 HydrophobicContact CZ-CG2 3.75Å; F116-V120 WeakPolarHBondContact O-CG2 3.15Å; F116-V120 PolarHBondContact O-N 3.41Å; M117-V120 PolarHBondContact O-N 3.46Å; M117-V120 VanDerWaalsContact O-N 3.15Å; V120-Q122 VanDerWaalsContact C-N 3.34Å; V120-Q122 PolarHBondContact O-N 3.15Å; V120-S123 PolarHBondContact O-N 2.86Å; V120-L124 HydrophobicContact CG1-CD1 3.83Å; V120-L124 HydrophobicContact CG1-CG 4.35Å; V120-L124 WeakPolarHBondContact O-CB 3.26Å; V120-L124 WeakPolarHBondContact O-CG 3.45Å; V120-L124 PolarHBondContact O-N 3.05Å; V120-I141 HydrophobicContact CG1-CD1 3.92Å; V120-I141 HydrophobicContact CG1-CG2 4.04Å
121	E	52.4	Low	48.7	Very low	3 Å²	3	55.3 Å²	55.3	1%	0.014	30%	0.301	C	S	.	.	H	α-helix	trans	-53.3	-48.2	172.9	-174.2	-176.8	-139.7	0	0	111.9	M117 L124 T125 G178 L180 F181	M117-E121 PolarHBondContact O-N 2.79Å; E121-L124 PolarHBondContact O-N 3.43Å; E121-T125 WeakPolarHBondContact O-CG2 3.39Å; E121-T125 PolarHBondContact O-N 3.25Å; E121-T125 VanDerWaalsContact O-N 3.11Å; E121-T125 PolarHBondContact O-OG1 3.29Å; E121-G178 WeakPolarHBondContact OE1-CA 3.46Å; E121-L180 HydrophobicContact CB-CD1 4.11Å; E121-L180 HydrophobicContact CG-CB 4.32Å; E121-L180 HydrophobicContact CG-CD1 4.32Å; E121-F181 WeakPolarHBondContact OE1-CB 3.48Å; E121-F181 PolarHBondContact OE1-N 2.9Å; E121-F181 WeakPolarHBondContact OE2-CB 3.12Å
122	Q	52.6	Low	49.1	Very low	70 Å²	70	55 Å²	55	33%	0.327	30%	0.301	S	S	.	.	H	α-helix	trans	-60.6	-50.1	177.8	-74.8	166	12.1	0	0	112.2	C118 K119 V120 L124 T125 E126 K175	C118-Q122 WeakPolarHBondContact O-CG 3.26Å; C118-Q122 PolarHBondContact O-N 3.23Å; C118-Q122 PolarHBondContact O-NE2 2.91Å; K119-Q122 PolarHBondContact O-N 2.84Å; V120-Q122 VanDerWaalsContact C-N 3.34Å; V120-Q122 PolarHBondContact O-N 3.15Å; Q122-L124 VanDerWaalsContact C-N 3.35Å; Q122-L124 PolarHBondContact O-N 3.21Å; Q122-T125 PolarHBondContact O-N 2.81Å; Q122-T125 PolarHBondContact O-OG1 2.91Å; Q122-E126 WeakPolarHBondContact O-CG 3.45Å; Q122-E126 PolarHBondContact O-N 2.85Å; Q122-K175 PolarHBondContact NE2-O 3.03Å
123	S	50.2	Low	49.7	Very low	28 Å²	28	55.5 Å²	55.5	20%	0.196	31%	0.307	C	S	.	.	H	α-helix	trans	-67.3	-31.9	-178.7	-67.6	0	0	0	0	113	K119 V120 E126 L127	K119-S123 WeakPolarHBondContact O-CB 3.19Å; K119-S123 PolarHBondContact O-N 3.08Å; K119-S123 PolarHBondContact O-OG 3.03Å; V120-S123 PolarHBondContact O-N 2.86Å; S123-E126 PolarHBondContact O-N 2.94Å; S123-L127 VanDerWaalsContact O-CB 3.26Å; S123-L127 WeakPolarHBondContact O-CB 3.31Å; S123-L127 WeakPolarHBondContact O-CD1 3.15Å; S123-L127 WeakPolarHBondContact O-CG 3.32Å; S123-L127 PolarHBondContact O-N 2.63Å
124	L	48.7	Very low	50	Low	12 Å²	12	56.8 Å²	56.8	6%	0.063	32%	0.315	C	S	.	.	H	α-helix	trans	-62.3	-45.9	170.2	-68.9	165.3	0	0	0	111.5	V120 E121 Q122 E126 L127 R137 I141	V120-L124 HydrophobicContact CG1-CD1 3.83Å; V120-L124 HydrophobicContact CG1-CG 4.35Å; V120-L124 WeakPolarHBondContact O-CB 3.26Å; V120-L124 WeakPolarHBondContact O-CG 3.45Å; V120-L124 PolarHBondContact O-N 3.05Å; E121-L124 PolarHBondContact O-N 3.43Å; Q122-L124 VanDerWaalsContact C-N 3.35Å; Q122-L124 PolarHBondContact O-N 3.21Å; L124-E126 PolarHBondContact O-N 2.96Å; L124-L127 PolarHBondContact O-N 3.48Å; L124-R137 HydrophobicContact CD2-CB 3.96Å; L124-I141 HydrophobicContact CD1-CD1 3.67Å; L124-I141 HydrophobicContact CD1-CG2 4.49Å; L124-I141 HydrophobicContact CD2-CD1 4.12Å; L124-I141 HydrophobicContact CG-CD1 4.41Å
125	T	51.8	Low	50.3	Low	79 Å²	79	62.2 Å²	62.2	49%	0.485	34%	0.344	S	S	.	.	H	α-helix	trans	-68.4	-18.1	176.3	63.3	0	0	0	0	114	E121 Q122	E121-T125 WeakPolarHBondContact O-CG2 3.39Å; E121-T125 PolarHBondContact O-N 3.25Å; E121-T125 VanDerWaalsContact O-N 3.11Å; E121-T125 PolarHBondContact O-OG1 3.29Å; Q122-T125 PolarHBondContact O-N 2.81Å; Q122-T125 PolarHBondContact O-OG1 2.91Å
126	E	50.7	Low	50.5	Low	145 Å²	145	64.2 Å²	64.2	68%	0.678	35%	0.352	S	S	*	.	H	α-helix	trans	-88.8	-28.3	173.4	-69.8	171.7	174.5	0	0	112.5	Q122 S123 L124 K128	Q122-E126 WeakPolarHBondContact O-CG 3.45Å; Q122-E126 PolarHBondContact O-N 2.85Å; S123-E126 PolarHBondContact O-N 2.94Å; L124-E126 PolarHBondContact O-N 2.96Å; E126-K128 PolarHBondContact O-N 3.16Å
127	L	47	Very low	50.8	Low	55 Å²	55	61.3 Å²	61.3	29%	0.288	34%	0.339	S	S	.	.			trans	-83.4	72.4	-174.9	-78	168.5	0	0	0	113.7	S123 L124 T129 R137	S123-L127 VanDerWaalsContact O-CB 3.26Å; S123-L127 WeakPolarHBondContact O-CB 3.31Å; S123-L127 WeakPolarHBondContact O-CD1 3.15Å; S123-L127 WeakPolarHBondContact O-CG 3.32Å; S123-L127 PolarHBondContact O-N 2.63Å; L124-L127 PolarHBondContact O-N 3.48Å; L127-T129 PolarHBondContact O-N 3.4Å; L127-R137 PolarHBondContact O-NH1 2.89Å; L127-R137 PolarHBondContact O-NH2 3.28Å
128	K	50.9	Low	51	Low	188 Å²	188	61.4 Å²	61.4	82%	0.817	34%	0.339	S	S	*	.			trans	-60.6	-8	173.1	-67.6	-170.3	174.9	-169.9	0	115.8	E126	E126-K128 PolarHBondContact O-N 3.16Å
129	T	42.7	Very low	51.4	Low	110 Å²	110	66.3 Å²	66.3	68%	0.675	36%	0.361	S	S	*	.			trans	-129.3	149.7	-178.6	51.1	0	0	0	0	111.5	L127 R137	L127-T129 PolarHBondContact O-N 3.4Å; T129-R137 PolarHBondContact O-NH1 3.42Å
130	G	51.3	Low	51.6	Low	43 Å²	43	67.9 Å²	67.9	44%	0.443	38%	0.377	S	S	.	.	S	Bend	trans	161.4	164	-176.5	0	0	0	0	0	109.7	V132	G130-V132 VanDerWaalsContact C-N 3.27Å
131	P	42.9	Very low	51.7	Low	107 Å²	107	68.7 Å²	68.7	70%	0.695	38%	0.38	S	S	*	.	S	Bend	trans	-76.7	-16.2	173.7	31.7	-34.1	0	0	0	113	C59	C59-P131 WeakPolarHBondContact O-CD 3.47Å
132	V	48.7	Very low	51.9	Low	36 Å²	36	69.6 Å²	69.6	22%	0.218	39%	0.385	C	S	.	.	S	Bend	trans	-107.9	144.5	176.6	-178	0	0	0	0	108.4	V61 G130 E136 R137	V61-V132 HydrophobicContact CG2-CB 4.28Å; V61-V132 HydrophobicContact CG2-CG2 3.57Å; G130-V132 VanDerWaalsContact C-N 3.27Å; V132-E136 HydrophobicContact CG1-CB 3.62Å; V132-E136 HydrophobicContact CG1-CG 4.35Å; V132-E136 VanDerWaalsContact CG1-OE2 3.29Å; V132-E136 WeakPolarHBondContact CG1-OE2 3.41Å; V132-R137 HydrophobicContact CB-CG 4.07Å; V132-R137 HydrophobicContact CG1-CG 3.76Å; V132-R137 PolarHBondContact O-NE 3.27Å; V132-R137 PolarHBondContact O-NH2 3.24Å
133	S	56.4	Low	52.1	Low	48 Å²	48	70.2 Å²	70.2	34%	0.336	39%	0.391	S	S	.	.			trans	-60	169.6	-178.7	72.6	0	0	0	0	112.5	D135 E136 R137	S133-D135 VanDerWaalsContact C-N 3.25Å; S133-D135 PolarHBondContact OG-N 3.11Å; S133-E136 WeakPolarHBondContact CA-OE2 3.21Å; S133-E136 WeakPolarHBondContact CB-OE2 3.19Å; S133-E136 PolarHBondContact N-OE2 2.71Å; S133-E136 WeakPolarHBondContact OG-CB 3.44Å; S133-E136 VanDerWaalsContact OG-CD 3.27Å; S133-E136 VanDerWaalsContact OG-CG 3.27Å; S133-E136 WeakPolarHBondContact OG-CG 3.4Å; S133-E136 PolarHBondContact OG-N 3.22Å; S133-E136 VanDerWaalsContact OG-N 3.13Å; S133-E136 PolarHBondContact OG-OE2 3.02Å; S133-R137 WeakPolarHBondContact O-CG 3.38Å; S133-R137 PolarHBondContact O-NE 3.22Å
134	V	52.7	Low	52.3	Low	54 Å²	54	71.4 Å²	71.4	33%	0.327	39%	0.391	S	S	.	.	H	α-helix	trans	-67.3	-32.5	172.9	176	0	0	0	0	110.6	H138	V134-H138 PolarHBondContact O-N 3.15Å; V134-H138 PolarHBondContact O-ND1 3.26Å
135	D	55.8	Low	52.7	Low	118 Å²	118	71.5 Å²	71.5	63%	0.631	39%	0.391	S	S	*	.	H	α-helix	trans	-84.2	-46.2	-167.4	-52.7	-60.2	0	0	0	111.9	S133 R137 H138 E139	S133-D135 VanDerWaalsContact C-N 3.25Å; S133-D135 PolarHBondContact OG-N 3.11Å; D135-R137 PolarHBondContact O-N 3.32Å; D135-H138 WeakPolarHBondContact O-CA 3.35Å; D135-H138 PolarHBondContact O-N 3.06Å; D135-E139 PolarHBondContact O-N 3.29Å
136	E	54.6	Low	53.1	Low	106 Å²	106	70.1 Å²	70.1	50%	0.495	38%	0.377	S	S	.	.	H	α-helix	trans	-54.2	-38.2	170.4	-65.8	158.3	122.5	0	0	111.7	V132 S133 E139 A140	V132-E136 HydrophobicContact CG1-CB 3.62Å; V132-E136 HydrophobicContact CG1-CG 4.35Å; V132-E136 VanDerWaalsContact CG1-OE2 3.29Å; V132-E136 WeakPolarHBondContact CG1-OE2 3.41Å; S133-E136 WeakPolarHBondContact CA-OE2 3.21Å; S133-E136 WeakPolarHBondContact CB-OE2 3.19Å; S133-E136 PolarHBondContact N-OE2 2.71Å; S133-E136 WeakPolarHBondContact OG-CB 3.44Å; S133-E136 VanDerWaalsContact OG-CD 3.27Å; S133-E136 VanDerWaalsContact OG-CG 3.27Å; S133-E136 WeakPolarHBondContact OG-CG 3.4Å; S133-E136 PolarHBondContact OG-N 3.22Å; S133-E136 VanDerWaalsContact OG-N 3.13Å; S133-E136 PolarHBondContact OG-OE2 3.02Å; E136-E139 PolarHBondContact O-N 3.12Å; E136-A140 WeakPolarHBondContact O-CB 3.46Å; E136-A140 PolarHBondContact O-N 2.76Å
137	R	54	Low	53.4	Low	12 Å²	12	65.7 Å²	65.7	5%	0.045	36%	0.362	C	S	.	.	H	α-helix	trans	-71.1	-26.8	177	-73.1	-176.5	-71.2	160.9	4.4	113.2	L124 L127 T129 V132 S133 D135 I141	L124-R137 HydrophobicContact CD2-CB 3.96Å; L127-R137 PolarHBondContact O-NH1 2.89Å; L127-R137 PolarHBondContact O-NH2 3.28Å; T129-R137 PolarHBondContact O-NH1 3.42Å; V132-R137 HydrophobicContact CB-CG 4.07Å; V132-R137 HydrophobicContact CG1-CG 3.76Å; V132-R137 PolarHBondContact O-NE 3.27Å; V132-R137 PolarHBondContact O-NH2 3.24Å; S133-R137 WeakPolarHBondContact O-CG 3.38Å; S133-R137 PolarHBondContact O-NE 3.22Å; D135-R137 PolarHBondContact O-N 3.32Å; R137-I141 WeakPolarHBondContact O-CD1 3.19Å
138	H	55.9	Low	53.7	Low	32 Å²	32	65.5 Å²	65.5	15%	0.148	36%	0.361	C	S	.	.	H	α-helix	trans	-77.7	-41.5	169.6	-77.1	93.9	0	0	0	111.2	V134 D135 I141 L142	V134-H138 PolarHBondContact O-N 3.15Å; V134-H138 PolarHBondContact O-ND1 3.26Å; D135-H138 WeakPolarHBondContact O-CA 3.35Å; D135-H138 PolarHBondContact O-N 3.06Å; H138-I141 PolarHBondContact O-N 3.2Å; H138-L142 WeakPolarHBondContact O-CB 3.3Å; H138-L142 VanDerWaalsContact O-CG 3.3Å; H138-L142 WeakPolarHBondContact O-CG 3.48Å; H138-L142 PolarHBondContact O-N 3.18Å
139	E	58.6	Low	54.1	Low	115 Å²	115	57.2 Å²	57.2	54%	0.537	33%	0.326	S	S	.	.	H	α-helix	trans	-61.7	-50.9	-179.6	-171.9	-179.2	175.3	0	0	112.4	D135 E136 I141 L142 N143	D135-E139 PolarHBondContact O-N 3.29Å; E136-E139 PolarHBondContact O-N 3.12Å; E139-I141 PolarHBondContact O-N 2.96Å; E139-I141 VanDerWaalsContact O-N 3.16Å; E139-L142 WeakPolarHBondContact O-CB 3.47Å; E139-L142 PolarHBondContact O-N 2.99Å; E139-L142 VanDerWaalsContact O-N 3.09Å; E139-N143 PolarHBondContact O-N 3.15Å
140	A	53.8	Low	55	Low	49 Å²	49	58.2 Å²	58.2	41%	0.405	32%	0.322	S	S	.	.	H	α-helix	trans	-55.7	-37.8	178.2	0	0	0	0	0	112.5	E136 R144	E136-A140 WeakPolarHBondContact O-CB 3.46Å; E136-A140 PolarHBondContact O-N 2.76Å; A140-R144 PolarHBondContact O-N 2.82Å
141	I	53.6	Low	55.4	Low	32 Å²	32	58.6 Å²	58.6	16%	0.164	31%	0.312	C	S	.	.	H	α-helix	trans	-83.8	-24.3	-177.3	-65.8	173.8	0	0	0	111.5	C62 V120 L124 R137 H138 E139 Y145 L180	C62-I141 HydrophobicContact CB-CD1 4.4Å; V120-I141 HydrophobicContact CG1-CD1 3.92Å; V120-I141 HydrophobicContact CG1-CG2 4.04Å; L124-I141 HydrophobicContact CD1-CD1 3.67Å; L124-I141 HydrophobicContact CD1-CG2 4.49Å; L124-I141 HydrophobicContact CD2-CD1 4.12Å; L124-I141 HydrophobicContact CG-CD1 4.41Å; R137-I141 WeakPolarHBondContact O-CD1 3.19Å; H138-I141 PolarHBondContact O-N 3.2Å; E139-I141 PolarHBondContact O-N 2.96Å; E139-I141 VanDerWaalsContact O-N 3.16Å; I141-Y145 VanDerWaalsContact O-CB 3.26Å; I141-Y145 WeakPolarHBondContact O-CB 3.43Å; I141-Y145 PolarHBondContact O-N 3.35Å; I141-L180 HydrophobicContact CG2-CD1 3.87Å; I141-L180 HydrophobicContact CG2-CD2 4.44Å
142	L	56.3	Low	56.2	Low	23 Å²	23	57.4 Å²	57.4	12%	0.12	30%	0.304	C	S	.	.	H	α-helix	trans	-67.1	-49.3	164.6	-77.1	163.2	0	0	0	111.6	H138 E139 R144 Y145 Y146 P179 L180	H138-L142 WeakPolarHBondContact O-CB 3.3Å; H138-L142 VanDerWaalsContact O-CG 3.3Å; H138-L142 WeakPolarHBondContact O-CG 3.48Å; H138-L142 PolarHBondContact O-N 3.18Å; E139-L142 WeakPolarHBondContact O-CB 3.47Å; E139-L142 PolarHBondContact O-N 2.99Å; E139-L142 VanDerWaalsContact O-N 3.09Å; L142-R144 VanDerWaalsContact C-N 3.34Å; L142-R144 PolarHBondContact O-N 3.47Å; L142-Y145 CarbonylContact O-C 3.56Å; L142-Y145 WeakPolarHBondContact O-CA 3.44Å; L142-Y145 WeakPolarHBondContact O-CB 3.16Å; L142-Y145 PolarHBondContact O-N 2.85Å; L142-Y146 HydrophobicContact CB-CD2 4.29Å; L142-Y146 HydrophobicContact CB-CE2 4.06Å; L142-Y146 HydrophobicContact CD2-CE2 4.11Å; L142-Y146 WeakPolarHBondContact O-CD2 3.44Å; L142-Y146 PolarHBondContact O-N 2.8Å; L142-P179 HydrophobicContact CD1-CB 4.06Å; L142-P179 HydrophobicContact CD1-CG 3.41Å; L142-P179 VanDerWaalsContact CD1-CG 3.41Å; L142-P179 HydrophobicContact CD2-CB 3.6Å; L142-P179 HydrophobicContact CD2-CG 3.66Å; L142-P179 HydrophobicContact CG-CB 4.44Å; L142-P179 HydrophobicContact CG-CG 4.02Å; L142-L180 HydrophobicContact CD2-CD2 3.88Å; L142-L180 HydrophobicContact CD2-CG 3.84Å; L142-L180 HydrophobicContact CG-CD2 4.43Å; L142-L180 HydrophobicContact CG-CG 4.33Å
143	N	58.5	Low	56.3	Low	82 Å²	82	58.7 Å²	58.7	44%	0.439	32%	0.315	S	S	.	.	H	α-helix	trans	-61.3	-43.7	-179.1	-68.5	-15.6	0	0	0	110.7	E139 Y145 Y146 S147	E139-N143 PolarHBondContact O-N 3.15Å; N143-Y145 PolarHBondContact O-N 3.01Å; N143-Y146 PolarHBondContact O-N 3.27Å; N143-S147 WeakPolarHBondContact O-CB 3.4Å; N143-S147 PolarHBondContact O-N 3.44Å
144	R	53.8	Low	56.2	Low	53 Å²	53	56.8 Å²	56.8	20%	0.2	30%	0.3	C	S	.	.	H	α-helix	trans	-61.8	-40.4	171.1	-168	58.1	151.4	-165.5	-4.5	112.6	D53 H64 T65 A140 L142 L148	D53-R144 IonicContact OD1-CZ 3.75Å; D53-R144 IonicContact OD1-NE 3.68Å; D53-R144 IonicContact OD1-NH2 3.26Å; D53-R144 PolarHBondContact OD1-NH2 2.88Å; D53-R144 IonicContact OD2-CZ 3.21Å; D53-R144 IonicContact OD2-NE 2.82Å; D53-R144 PolarHBondContact OD2-NE 3.41Å; D53-R144 IonicContact OD2-NH2 2.75Å; D53-R144 PolarHBondContact OD2-NH2 3.24Å; H64-R144 VanDerWaalsContact CE1-CD 3.41Å; H64-R144 WeakPolarHBondContact CE1-CD 3.47Å; H64-R144 PolarHBondContact CE1-NE 2.75Å; T65-R144 PolarHBondContact O-NH2 2.86Å; A140-R144 PolarHBondContact O-N 2.82Å; L142-R144 VanDerWaalsContact C-N 3.34Å; L142-R144 PolarHBondContact O-N 3.47Å; R144-L148 VanDerWaalsContact O-CG 3.31Å; R144-L148 WeakPolarHBondContact O-CG 3.16Å; R144-L148 PolarHBondContact O-N 3.11Å
145	Y	57.1	Low	56.6	Low	15 Å²	15	56.6 Å²	56.6	6%	0.059	29%	0.294	C	S	.	.	H	α-helix	trans	-65	-41.7	175.6	167.2	-96.5	0	0	0	113	M117 I141 L142 N143 L148 M149 L180 S183	M117-Y145 HydrophobicContact CE-CD2 3.21Å; M117-Y145 HydrophobicContact CE-CE2 3.42Å; M117-Y145 VanDerWaalsContact CE-CE2 3.42Å; M117-Y145 HydrophobicContact CE-CG 4.31Å; I141-Y145 VanDerWaalsContact O-CB 3.26Å; I141-Y145 WeakPolarHBondContact O-CB 3.43Å; I141-Y145 PolarHBondContact O-N 3.35Å; L142-Y145 CarbonylContact O-C 3.56Å; L142-Y145 WeakPolarHBondContact O-CA 3.44Å; L142-Y145 WeakPolarHBondContact O-CB 3.16Å; L142-Y145 PolarHBondContact O-N 2.85Å; N143-Y145 PolarHBondContact O-N 3.01Å; Y145-L148 PolarHBondContact O-N 3.44Å; Y145-M149 HydrophobicContact CD1-CG 4.36Å; Y145-M149 HydrophobicContact CD2-CG 4.03Å; Y145-M149 HydrophobicContact CE1-CG 3.73Å; Y145-M149 HydrophobicContact CE2-CG 3.42Å; Y145-M149 VanDerWaalsContact CE2-CG 3.42Å; Y145-M149 HydrophobicContact CE2-SD 3.92Å; Y145-M149 WeakPolarHBondContact O-CB 3.45Å; Y145-M149 WeakPolarHBondContact O-CG 3.41Å; Y145-M149 PolarHBondContact O-N 3.28Å; Y145-M149 WeakPolarHBondContact OH-CG 3.26Å; Y145-L180 HydrophobicContact CD1-CD2 4.24Å; Y145-L180 HydrophobicContact CG-CD2 3.87Å; Y145-S183 VanDerWaalsContact CZ-CB 3.44Å; Y145-S183 WeakPolarHBondContact OH-CB 3.34Å
146	Y	60	Low	56.8	Low	49 Å²	49	57.6 Å²	57.6	19%	0.192	29%	0.289	C	S	.	.	H	α-helix	trans	-63.9	-43.8	177.3	-73.5	-60.8	0	0	0	111	L142 N143 L148 M149 Q150 I211	L142-Y146 HydrophobicContact CB-CD2 4.29Å; L142-Y146 HydrophobicContact CB-CE2 4.06Å; L142-Y146 HydrophobicContact CD2-CE2 4.11Å; L142-Y146 WeakPolarHBondContact O-CD2 3.44Å; L142-Y146 PolarHBondContact O-N 2.8Å; N143-Y146 PolarHBondContact O-N 3.27Å; Y146-L148 PolarHBondContact O-N 2.65Å; Y146-M149 PolarHBondContact O-N 3.29Å; Y146-M149 VanDerWaalsContact O-N 3.09Å; Y146-Q150 WeakPolarHBondContact O-CG 3.28Å; Y146-Q150 PolarHBondContact O-N 3.43Å; Y146-I211 HydrophobicContact CD1-CG2 4.37Å; Y146-I211 HydrophobicContact CE1-CG2 4.42Å
147	S	57.2	Low	57	Low	53 Å²	53	56.3 Å²	56.3	37%	0.371	28%	0.28	S	S	.	.	H	α-helix	trans	-55.2	-49.9	170.9	169.7	0	0	0	0	112.1	N143 M149 Q150	N143-S147 WeakPolarHBondContact O-CB 3.4Å; N143-S147 PolarHBondContact O-N 3.44Å; S147-M149 PolarHBondContact O-N 3.4Å; S147-Q150 WeakPolarHBondContact O-CB 3.38Å; S147-Q150 PolarHBondContact O-N 2.9Å; S147-Q150 VanDerWaalsContact O-N 3.14Å
148	L	53.9	Low	57.3	Low	50 Å²	50	56 Å²	56	26%	0.262	28%	0.279	S	S	.	.	H	α-helix	trans	-63.9	-23.7	176.7	-68.7	-179.2	0	0	0	113.9	L70 R144 Y145 Y146 I154	L70-L148 HydrophobicContact CD1-CD1 3.99Å; L70-L148 HydrophobicContact CD1-CD2 3.67Å; L70-L148 HydrophobicContact CD1-CG 4.41Å; R144-L148 VanDerWaalsContact O-CG 3.31Å; R144-L148 WeakPolarHBondContact O-CG 3.16Å; R144-L148 PolarHBondContact O-N 3.11Å; Y145-L148 PolarHBondContact O-N 3.44Å; Y146-L148 PolarHBondContact O-N 2.65Å; L148-I154 HydrophobicContact CD2-CD1 4Å; L148-I154 WeakPolarHBondContact O-CB 3.32Å; L148-I154 WeakPolarHBondContact O-CG2 3.47Å
149	M	58.4	Low	57.7	Low	15 Å²	15	55.5 Å²	55.5	7%	0.074	28%	0.277	C	S	.	.	H	α-helix	trans	-86.4	-17.1	176.5	-76.5	-61.1	-62.4	0	0	114.5	Y145 Y146 S147 R155 L158 I187	Y145-M149 HydrophobicContact CD1-CG 4.36Å; Y145-M149 HydrophobicContact CD2-CG 4.03Å; Y145-M149 HydrophobicContact CE1-CG 3.73Å; Y145-M149 HydrophobicContact CE2-CG 3.42Å; Y145-M149 VanDerWaalsContact CE2-CG 3.42Å; Y145-M149 HydrophobicContact CE2-SD 3.92Å; Y145-M149 WeakPolarHBondContact O-CB 3.45Å; Y145-M149 WeakPolarHBondContact O-CG 3.41Å; Y145-M149 PolarHBondContact O-N 3.28Å; Y145-M149 WeakPolarHBondContact OH-CG 3.26Å; Y146-M149 PolarHBondContact O-N 3.29Å; Y146-M149 VanDerWaalsContact O-N 3.09Å; S147-M149 PolarHBondContact O-N 3.4Å; M149-R155 HydrophobicContact CE-CB 4.19Å; M149-R155 HydrophobicContact CE-CG 3.79Å; M149-L158 HydrophobicContact SD-CD1 3.84Å; M149-I187 HydrophobicContact CE-CD1 3.79Å; M149-I187 HydrophobicContact CE-CG1 3.8Å; M149-I187 HydrophobicContact SD-CD1 3.56Å; M149-I187 VanDerWaalsContact SD-CD1 3.56Å; M149-I187 HydrophobicContact SD-CG1 4.27Å
150	Q	61.3	Low	57.9	Low	130 Å²	130	57.7 Å²	57.7	61%	0.607	28%	0.28	S	S	*	.	H	α-helix	trans	-70.3	-37	171.6	-72.4	165.7	-13	0	0	111	Y146 S147 P152	Y146-Q150 WeakPolarHBondContact O-CG 3.28Å; Y146-Q150 PolarHBondContact O-N 3.43Å; S147-Q150 WeakPolarHBondContact O-CB 3.38Å; S147-Q150 PolarHBondContact O-N 2.9Å; S147-Q150 VanDerWaalsContact O-N 3.14Å; Q150-P152 WeakPolarHBondContact O-CD 3.37Å
151	K	60	Low	58.1	Low	52 Å²	52	55.4 Å²	55.4	23%	0.226	26%	0.261	C	S	.	.	S	Bend	trans	-63.6	111.6	175.5	-73.3	-164.4	167.2	-165.9	0	111.3	E67 E71 S153 I154 R155	E67-K151 IonicContact OE1-NZ 3.26Å; E67-K151 PolarHBondContact OE1-NZ 2.77Å; E71-K151 VanDerWaalsContact CD-NZ 3.31Å; E71-K151 WeakPolarHBondContact OE1-CD 3.23Å; E71-K151 IonicContact OE1-NZ 2.87Å; E71-K151 PolarHBondContact OE1-NZ 3.18Å; E71-K151 IonicContact OE2-NZ 2.93Å; E71-K151 PolarHBondContact OE2-NZ 3.42Å; K151-S153 VanDerWaalsContact C-N 3.3Å; K151-S153 PolarHBondContact O-N 3.13Å; K151-I154 HydrophobicContact CB-CB 4.27Å; K151-I154 HydrophobicContact CB-CD1 3.71Å; K151-I154 HydrophobicContact CB-CG1 3.89Å; K151-I154 HydrophobicContact CD-CD1 3.81Å; K151-I154 HydrophobicContact CG-CD1 4.25Å; K151-I154 PolarHBondContact O-N 3.27Å; K151-R155 PolarHBondContact O-N 3.03Å; K151-R155 VanDerWaalsContact O-N 3.11Å
152	P	59	Low	58.5	Low	82 Å²	82	54 Å²	54	53%	0.532	25%	0.254	S	S	.	.	H	α-helix	trans	-70.8	-21.3	-170.4	-22	35.1	0	0	0	114.9	Q150 R156	Q150-P152 WeakPolarHBondContact O-CD 3.37Å; P152-R156 WeakPolarHBondContact O-CB 3.25Å; P152-R156 WeakPolarHBondContact O-CG 3.25Å; P152-R156 PolarHBondContact O-N 3.5Å; P152-R156 VanDerWaalsContact O-N 3.12Å; P152-R156 PolarHBondContact O-NE 3.35Å
153	S	51.4	Low	58.8	Low	62 Å²	62	53.5 Å²	53.5	43%	0.434	25%	0.253	S	S	.	.	H	α-helix	trans	-61.3	-56.8	169.7	46.4	0	0	0	0	110.2	K151 R155 R156 W157	K151-S153 VanDerWaalsContact C-N 3.3Å; K151-S153 PolarHBondContact O-N 3.13Å; S153-R155 PolarHBondContact O-N 3.37Å; S153-R156 PolarHBondContact O-N 3.42Å; S153-W157 VanDerWaalsContact O-CB 3.23Å; S153-W157 WeakPolarHBondContact O-CB 3.48Å; S153-W157 PolarHBondContact O-N 2.8Å
154	I	54.4	Low	59	Low	8 Å²	8	55.5 Å²	55.5	4%	0.041	26%	0.255	C	S	.	.	H	α-helix	trans	-59.9	-46.5	-179.3	-53.6	-178.8	0	0	0	110.4	L70 L148 K151 W157 L158	L70-I154 HydrophobicContact CB-CD1 3.64Å; L70-I154 HydrophobicContact CB-CG1 4.23Å; L70-I154 HydrophobicContact CD1-CD1 3.97Å; L70-I154 HydrophobicContact CD1-CG2 4.43Å; L70-I154 HydrophobicContact CG-CD1 4.27Å; L148-I154 HydrophobicContact CD2-CD1 4Å; L148-I154 WeakPolarHBondContact O-CB 3.32Å; L148-I154 WeakPolarHBondContact O-CG2 3.47Å; K151-I154 HydrophobicContact CB-CB 4.27Å; K151-I154 HydrophobicContact CB-CD1 3.71Å; K151-I154 HydrophobicContact CB-CG1 3.89Å; K151-I154 HydrophobicContact CD-CD1 3.81Å; K151-I154 HydrophobicContact CG-CD1 4.25Å; K151-I154 PolarHBondContact O-N 3.27Å; I154-W157 PolarHBondContact O-N 3.35Å; I154-L158 HydrophobicContact CG2-CD1 3.93Å; I154-L158 HydrophobicContact CG2-CG 4.32Å; I154-L158 WeakPolarHBondContact O-CB 3.32Å; I154-L158 VanDerWaalsContact O-CG 3.26Å; I154-L158 WeakPolarHBondContact O-CG 3.48Å; I154-L158 PolarHBondContact O-N 3.03Å
155	R	60.7	Low	59.3	Low	50 Å²	50	54 Å²	54	19%	0.189	25%	0.249	C	C	.	.	H	α-helix	trans	-57.3	-54.1	174.6	179.5	171.5	176.2	-156.8	1.6	111.8	M149 K151 S153 W157 L158 I159 E190	M149-R155 HydrophobicContact CE-CB 4.19Å; M149-R155 HydrophobicContact CE-CG 3.79Å; K151-R155 PolarHBondContact O-N 3.03Å; K151-R155 VanDerWaalsContact O-N 3.11Å; S153-R155 PolarHBondContact O-N 3.37Å; R155-W157 VanDerWaalsContact C-N 3.28Å; R155-W157 PolarHBondContact O-N 2.93Å; R155-L158 PolarHBondContact O-N 3.23Å; R155-I159 HydrophobicContact CG-CD1 3.95Å; R155-I159 VanDerWaalsContact O-CG1 3.24Å; R155-I159 WeakPolarHBondContact O-CG1 3.27Å; R155-I159 PolarHBondContact O-N 2.99Å; R155-E190 IonicContact CZ-OE1 3.73Å; R155-E190 IonicContact NE-OE1 3.62Å; R155-E190 IonicContact NE-OE2 3.24Å; R155-E190 IonicContact NH2-OE1 3.21Å; R155-E190 PolarHBondContact NH2-OE1 3.43Å; R155-E190 IonicContact NH2-OE2 2.63Å
156	R	59.7	Low	59.6	Low	140 Å²	140	55.2 Å²	55.2	53%	0.528	25%	0.254	S	S	.	.	H	α-helix	trans	-57.7	-40.4	179	-77.7	-175.5	-83.8	-170.7	-4.1	112.1	P152 S153 I159 R160	P152-R156 WeakPolarHBondContact O-CB 3.25Å; P152-R156 WeakPolarHBondContact O-CG 3.25Å; P152-R156 PolarHBondContact O-N 3.5Å; P152-R156 VanDerWaalsContact O-N 3.12Å; P152-R156 PolarHBondContact O-NE 3.35Å; S153-R156 PolarHBondContact O-N 3.42Å; R156-I159 PolarHBondContact O-N 3.16Å; R156-R160 WeakPolarHBondContact O-CG 3.29Å; R156-R160 PolarHBondContact O-N 2.92Å
157	W	60	Low	59.7	Low	79 Å²	79	62.4 Å²	62.4	30%	0.299	28%	0.28	S	S	.	.	H	α-helix	trans	-66.4	-41.8	178.4	-174.2	103.5	0	0	0	112.9	L70 C110 V113 S153 I154 R155 R160 A161	L70-W157 HydrophobicContact CD2-CH2 4.42Å; C110-W157 VanDerWaalsContact CA-CH2 3.42Å; C110-W157 HydrophobicContact CB-CD2 3.79Å; C110-W157 HydrophobicContact CB-CE3 3.82Å; C110-W157 HydrophobicContact CB-CH2 3.62Å; C110-W157 HydrophobicContact CB-CZ2 3.55Å; C110-W157 HydrophobicContact CB-CZ3 3.73Å; C110-W157 WeakPolarHBondContact SG-CZ2 3.36Å; C110-W157 PolarHBondContact SG-NE1 3.04Å; C110-W157 VanDerWaalsContact SG-NE1 3.44Å; V113-W157 HydrophobicContact CB-CH2 4.21Å; V113-W157 HydrophobicContact CB-CZ3 4.04Å; V113-W157 HydrophobicContact CG1-CZ3 4.46Å; V113-W157 HydrophobicContact CG2-CH2 3.73Å; V113-W157 HydrophobicContact CG2-CZ3 4.06Å; S153-W157 VanDerWaalsContact O-CB 3.23Å; S153-W157 WeakPolarHBondContact O-CB 3.48Å; S153-W157 PolarHBondContact O-N 2.8Å; I154-W157 PolarHBondContact O-N 3.35Å; R155-W157 VanDerWaalsContact C-N 3.28Å; R155-W157 PolarHBondContact O-N 2.93Å; W157-R160 PolarHBondContact O-N 3.08Å; W157-A161 WeakPolarHBondContact O-CB 3.35Å; W157-A161 PolarHBondContact O-N 3.4Å
158	L	60.9	Low	59.8	Low	4 Å²	4	66.1 Å²	66.1	2%	0.021	30%	0.296	C	S	.	.	H	α-helix	trans	-65.9	-37.7	174.2	-69.3	171	0	0	0	112.1	V113 L114 M149 I154 R155 A161 A162 I187	V113-L158 HydrophobicContact CG1-CD2 4.4Å; L114-L158 HydrophobicContact CD2-CD2 3.82Å; L114-L158 HydrophobicContact CG-CD2 3.83Å; M149-L158 HydrophobicContact SD-CD1 3.84Å; I154-L158 HydrophobicContact CG2-CD1 3.93Å; I154-L158 HydrophobicContact CG2-CG 4.32Å; I154-L158 WeakPolarHBondContact O-CB 3.32Å; I154-L158 VanDerWaalsContact O-CG 3.26Å; I154-L158 WeakPolarHBondContact O-CG 3.48Å; I154-L158 PolarHBondContact O-N 3.03Å; R155-L158 PolarHBondContact O-N 3.23Å; L158-A161 WeakPolarHBondContact O-CB 3.23Å; L158-A161 PolarHBondContact O-N 3.39Å; L158-A162 PolarHBondContact O-N 3.16Å; L158-I187 HydrophobicContact CB-CD1 4.08Å; L158-I187 HydrophobicContact CB-CG2 4Å; L158-I187 HydrophobicContact CD1-CD1 3.96Å
159	I	63.9	Low	60.4	Low	22 Å²	22	70.5 Å²	70.5	11%	0.113	31%	0.313	C	S	.	.	H	α-helix	trans	-63.9	-47.9	173.4	-58.8	163.5	0	0	0	110.3	R155 R156 A161 A162 A163 I187 E190 I194	R155-I159 HydrophobicContact CG-CD1 3.95Å; R155-I159 VanDerWaalsContact O-CG1 3.24Å; R155-I159 WeakPolarHBondContact O-CG1 3.27Å; R155-I159 PolarHBondContact O-N 2.99Å; R156-I159 PolarHBondContact O-N 3.16Å; I159-A161 VanDerWaalsContact C-N 3.27Å; I159-A161 PolarHBondContact O-N 2.95Å; I159-A162 PolarHBondContact O-N 3.1Å; I159-A163 PolarHBondContact O-N 3.45Å; I159-I187 HydrophobicContact CB-CG2 4.43Å; I159-I187 HydrophobicContact CG1-CG2 3.89Å; I159-E190 HydrophobicContact CD1-CB 4.16Å; I159-E190 WeakPolarHBondContact CD1-OE2 2.96Å; I159-E190 HydrophobicContact CG1-CB 4.1Å; I159-E190 WeakPolarHBondContact CG1-OE2 3.42Å; I159-E190 HydrophobicContact CG2-CB 4.08Å; I159-I194 HydrophobicContact CG2-CD1 3.57Å; I159-I194 HydrophobicContact CG2-CG1 4.35Å
160	R	61.8	Low	60.3	Low	162 Å²	162	74.6 Å²	74.6	61%	0.611	34%	0.343	S	S	*	.	H	α-helix	trans	-57.7	-37	174.4	-72.7	174.5	-179.6	178.7	-0.7	112	R156 W157 R164	R156-R160 WeakPolarHBondContact O-CG 3.29Å; R156-R160 PolarHBondContact O-N 2.92Å; W157-R160 PolarHBondContact O-N 3.08Å; R160-R164 WeakPolarHBondContact O-CG 3.38Å; R160-R164 PolarHBondContact O-N 3.14Å; R160-R164 PolarHBondContact O-NE 3.44Å
161	A	58.9	Low	60.3	Low	0 Å²	0	74.5 Å²	74.5	0%	0	35%	0.352	C	S	.	.	H	α-helix	trans	-67.4	-46.5	174.9	0	0	0	0	0	112.1	C110 L114 W157 L158 I159 A163 R164 R165	C110-A161 HydrophobicContact CB-CB 3.68Å; L114-A161 HydrophobicContact CD1-CB 3.69Å; W157-A161 WeakPolarHBondContact O-CB 3.35Å; W157-A161 PolarHBondContact O-N 3.4Å; L158-A161 WeakPolarHBondContact O-CB 3.23Å; L158-A161 PolarHBondContact O-N 3.39Å; I159-A161 VanDerWaalsContact C-N 3.27Å; I159-A161 PolarHBondContact O-N 2.95Å; A161-A163 VanDerWaalsContact C-N 3.29Å; A161-A163 PolarHBondContact O-N 3.4Å; A161-R164 PolarHBondContact O-N 3.02Å; A161-R165 WeakPolarHBondContact O-CG 3.41Å; A161-R165 PolarHBondContact O-N 3.26Å
162	A	61.9	Low	60.2	Low	2 Å²	2	74 Å²	74	2%	0.017	35%	0.349	C	S	.	.	H	α-helix	trans	-60.9	-36	176	0	0	0	0	0	112.8	L114 L158 I159 R166 W172 I187	L114-A162 HydrophobicContact CD1-CB 4.47Å; L158-A162 PolarHBondContact O-N 3.16Å; I159-A162 PolarHBondContact O-N 3.1Å; A162-R166 PolarHBondContact O-N 3.02Å; A162-W172 HydrophobicContact CB-CZ3 4.42Å; A162-I187 HydrophobicContact CB-CG2 4.39Å
163	A	62.6	Low	60.5	Low	13 Å²	13	76.2 Å²	76.2	11%	0.107	35%	0.35	C	S	.	.	H	α-helix	trans	-67.9	-50.2	174.6	0	0	0	0	0	112.5	I159 A161 R165 R166 R167 I194	I159-A163 PolarHBondContact O-N 3.45Å; A161-A163 VanDerWaalsContact C-N 3.29Å; A161-A163 PolarHBondContact O-N 3.4Å; A163-R165 PolarHBondContact O-N 2.88Å; A163-R166 WeakPolarHBondContact O-CB 3.42Å; A163-R166 PolarHBondContact O-N 3.16Å; A163-R167 PolarHBondContact O-N 2.9Å; A163-I194 HydrophobicContact CB-CB 4.27Å; A163-I194 HydrophobicContact CB-CD1 4.47Å; A163-I194 HydrophobicContact CB-CG2 4.36Å
164	R	61.3	Low	60.9	Low	125 Å²	125	73.8 Å²	73.8	47%	0.472	33%	0.333	S	S	.	.	H	α-helix	trans	-56.9	-38.5	175.4	-77.3	-176.4	-71.6	-176.4	-2.3	112	C110 R160 A161 R166 R167 N168	C110-R164 PolarHBondContact SG-NH2 3.14Å; R160-R164 WeakPolarHBondContact O-CG 3.38Å; R160-R164 PolarHBondContact O-N 3.14Å; R160-R164 PolarHBondContact O-NE 3.44Å; A161-R164 PolarHBondContact O-N 3.02Å; R164-R166 PolarHBondContact O-N 3.27Å; R164-R167 PolarHBondContact O-N 3.32Å; R164-N168 PolarHBondContact O-N 3.12Å
165	R	61.8	Low	60.9	Low	20 Å²	20	81.3 Å²	81.3	8%	0.075	37%	0.365	C	S	.	.	H	α-helix	trans	-61.1	-37.8	173.3	-79	-160.4	150.6	137.9	10.3	114.7	D111 A161 A163 N168 K169 W172	D111-R165 VanDerWaalsContact CG-CZ 3.44Å; D111-R165 PolarHBondContact O-NH1 2.91Å; D111-R165 PolarHBondContact O-NH2 2.73Å; D111-R165 VanDerWaalsContact OD1-CG 3.27Å; D111-R165 WeakPolarHBondContact OD1-CG 3.2Å; D111-R165 IonicContact OD1-NE 3.64Å; D111-R165 WeakPolarHBondContact OD2-CG 3.45Å; D111-R165 IonicContact OD2-CZ 3.09Å; D111-R165 IonicContact OD2-NE 2.73Å; D111-R165 PolarHBondContact OD2-NE 3.1Å; D111-R165 IonicContact OD2-NH2 2.75Å; D111-R165 PolarHBondContact OD2-NH2 3.49Å; A161-R165 WeakPolarHBondContact O-CG 3.41Å; A161-R165 PolarHBondContact O-N 3.26Å; A163-R165 PolarHBondContact O-N 2.88Å; R165-N168 PolarHBondContact O-N 3.02Å; R165-K169 CarbonylContact O-C 3.56Å; R165-K169 WeakPolarHBondContact O-CA 3.24Å; R165-K169 PolarHBondContact O-N 2.78Å; R165-W172 HydrophobicContact CB-CD2 4.11Å; R165-W172 HydrophobicContact CB-CE3 3.59Å; R165-W172 HydrophobicContact CB-CZ3 3.95Å; R165-W172 HydrophobicContact CG-CE3 4.3Å; R165-W172 HydrophobicContact CG-CZ3 4.4Å
166	R	63.3	Low	60.5	Low	41 Å²	41	80.5 Å²	80.5	16%	0.155	37%	0.372	C	S	.	.	H	α-helix	trans	-66.2	-41.4	176	-84.6	-167.9	171.4	108.5	-5.1	112.3	A162 A163 R164 N168 K169 S170 Y188 G191 R192	A162-R166 PolarHBondContact O-N 3.02Å; A163-R166 WeakPolarHBondContact O-CB 3.42Å; A163-R166 PolarHBondContact O-N 3.16Å; R164-R166 PolarHBondContact O-N 3.27Å; R166-N168 VanDerWaalsContact C-N 3.32Å; R166-N168 PolarHBondContact O-N 3.24Å; R166-K169 CarbonylContact O-C 3.58Å; R166-K169 PolarHBondContact O-N 2.85Å; R166-S170 VanDerWaalsContact O-CA 3.32Å; R166-S170 WeakPolarHBondContact O-CA 3.01Å; R166-S170 PolarHBondContact O-N 3.22Å; R166-Y188 HydrophobicContact CG-CE2 4.24Å; R166-Y188 VanDerWaalsContact CZ-CE2 3.49Å; R166-Y188 PolarHBondContact NE-OH 3.46Å; R166-Y188 PolarHBondContact NH1-O 3.13Å; R166-Y188 PolarHBondContact NH2-O 3.45Å; R166-Y188 PolarHBondContact NH2-OH 3.3Å; R166-G191 PolarHBondContact NH1-O 3.44Å; R166-R192 VanDerWaalsContact NH1-CA 3.27Å; R166-R192 VanDerWaalsContact NH1-N 3.15Å
167	R	62.2	Low	60.1	Low	200 Å²	200	82.8 Å²	82.8	76%	0.755	39%	0.386	S	S	*	.	H	α-helix	trans	-56.6	-48.4	174.9	-65.2	-173.7	179.9	-176.8	-0.9	110.3	A163 R164	A163-R167 PolarHBondContact O-N 2.9Å; R164-R167 PolarHBondContact O-N 3.32Å
168	N	59.6	Low	59.6	Low	131 Å²	131	80.2 Å²	80.2	70%	0.701	38%	0.383	S	S	*	.	H	α-helix	trans	-75.4	-26.5	-179.4	-65.5	-12.7	0	0	0	114.3	R164 R165 R166	R164-N168 PolarHBondContact O-N 3.12Å; R165-N168 PolarHBondContact O-N 3.02Å; R166-N168 VanDerWaalsContact C-N 3.32Å; R166-N168 PolarHBondContact O-N 3.24Å
169	K	64.9	Low	59	Low	143 Å²	143	82.8 Å²	82.8	62%	0.622	40%	0.4	S	S	*	.			trans	-150.3	87.7	-177.8	-66.4	-178.9	-177.5	162	0	110.2	R165 R166 T171 W172	R165-K169 CarbonylContact O-C 3.56Å; R165-K169 WeakPolarHBondContact O-CA 3.24Å; R165-K169 PolarHBondContact O-N 2.78Å; R166-K169 CarbonylContact O-C 3.58Å; R166-K169 PolarHBondContact O-N 2.85Å; K169-T171 PolarHBondContact O-N 3.21Å; K169-T171 VanDerWaalsContact O-N 3.09Å; K169-W172 HydrophobicContact CB-CB 3.82Å; K169-W172 VanDerWaalsContact O-CB 3.26Å; K169-W172 WeakPolarHBondContact O-CB 3.26Å; K169-W172 PolarHBondContact O-N 2.88Å
170	S	57.6	Low	58.4	Low	101 Å²	101	82 Å²	82	71%	0.706	40%	0.397	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.4	-29.9	-179.5	59.6	0	0	0	0	114.3	R166	R166-S170 VanDerWaalsContact O-CA 3.32Å; R166-S170 WeakPolarHBondContact O-CA 3.01Å; R166-S170 PolarHBondContact O-N 3.22Å
171	T	61.1	Low	58.3	Low	128 Å²	128	76.9 Å²	76.9	79%	0.785	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.1	-6.2	176.6	56.1	0	0	0	0	114.3	K169 K173	K169-T171 PolarHBondContact O-N 3.21Å; K169-T171 VanDerWaalsContact O-N 3.09Å; T171-K173 PolarHBondContact O-N 2.97Å
172	W	57.5	Low	58.1	Low	42 Å²	42	80.9 Å²	80.9	16%	0.159	41%	0.405	C	S	.	.			trans	-66.7	133.5	177.4	-174.7	78.3	0	0	0	110.9	L114 A162 R165 K169 Y188	L114-W172 HydrophobicContact CD1-CH2 4.44Å; A162-W172 HydrophobicContact CB-CZ3 4.42Å; R165-W172 HydrophobicContact CB-CD2 4.11Å; R165-W172 HydrophobicContact CB-CE3 3.59Å; R165-W172 HydrophobicContact CB-CZ3 3.95Å; R165-W172 HydrophobicContact CG-CE3 4.3Å; R165-W172 HydrophobicContact CG-CZ3 4.4Å; K169-W172 HydrophobicContact CB-CB 3.82Å; K169-W172 VanDerWaalsContact O-CB 3.26Å; K169-W172 WeakPolarHBondContact O-CB 3.26Å; K169-W172 PolarHBondContact O-N 2.88Å; W172-Y188 HydrophobicContact CE3-CD2 4.03Å; W172-Y188 AromaticContact CE3-CE2 3.87Å; W172-Y188 HydrophobicContact CE3-CE2 3.87Å; W172-Y188 AromaticContact CZ3-CD2 3.72Å; W172-Y188 HydrophobicContact CZ3-CD2 3.72Å; W172-Y188 HydrophobicContact CZ3-CE2 4.06Å; W172-Y188 WeakPolarHBondContact O-CE2 3.09Å; W172-Y188 PolarHBondContact O-OH 3.02Å
173	K	64.7	Low	57.9	Low	127 Å²	127	81.8 Å²	81.8	55%	0.552	41%	0.412	S	S	*	.			trans	-141.2	153.7	172.6	-69.3	177.9	179.4	-180	0	106.2	T171 Y188	T171-K173 PolarHBondContact O-N 2.97Å; K173-Y188 HydrophobicContact CB-CE1 4.3Å; K173-Y188 HydrophobicContact CD-CE1 4.49Å; K173-Y188 HydrophobicContact CG-CE1 3.71Å; K173-Y188 HydrophobicContact CG-CE2 4.41Å; K173-Y188 VanDerWaalsContact CG-OH 3.26Å; K173-Y188 WeakPolarHBondContact CG-OH 3.08Å
174	P	59.7	Low	57.8	Low	12 Å²	12	81.4 Å²	81.4	8%	0.078	41%	0.408	C	S	.	.			trans	-53	153.3	159.1	26	-33.8	0	0	0	109.7	F181 Y188	P174-F181 HydrophobicContact CB-CD2 4.06Å; P174-F181 HydrophobicContact CB-CE2 3.96Å; P174-F181 HydrophobicContact CG-CE2 4.13Å; P174-Y188 VanDerWaalsContact CD-CG 3.47Å; P174-Y188 HydrophobicContact CG-CD1 4.47Å; P174-Y188 HydrophobicContact CG-CG 4.22Å
175	K	55.1	Low	58	Low	166 Å²	166	76.5 Å²	76.5	72%	0.722	39%	0.393	S	S	*	.			trans	-141.8	111	176.8	-73.8	-171.4	177	-174	0	109.6	Q122	Q122-K175 PolarHBondContact NE2-O 3.03Å
176	G	52.1	Low	58.2	Low	32 Å²	32	78.2 Å²	78.2	33%	0.33	41%	0.408	S	S	.	.			trans	-172	-172.5	-179.5	0	0	0	0	0	110.3
177	K	50.5	Low	58.2	Low	189 Å²	189	76.4 Å²	76.4	82%	0.822	40%	0.401	S	S	*	.			trans	-144.3	122.5	165.1	-73.4	-176.9	178.5	-178.2	0	105.7
178	G	50.6	Low	58.3	Low	24 Å²	24	68 Å²	68	25%	0.247	37%	0.37	C	S	.	.	S	Bend	trans	153.9	166.7	-178.5	0	0	0	0	0	111.5	E121 L180 F181 C182	E121-G178 WeakPolarHBondContact OE1-CA 3.46Å; G178-L180 VanDerWaalsContact C-N 3.29Å; G178-L180 PolarHBondContact O-N 3.3Å; G178-F181 WeakPolarHBondContact O-CB 3.35Å; G178-F181 PolarHBondContact O-N 3.21Å; G178-C182 PolarHBondContact O-N 3.48Å; G178-C182 PolarHBondContact O-SG 3.3Å; G178-C182 VanDerWaalsContact O-SG 3.41Å
179	P	49.1	Very low	58.5	Low	58 Å²	58	69.6 Å²	69.6	38%	0.377	37%	0.366	S	S	.	.	H	α-helix	trans	-64.4	-30.4	175.3	23.1	-32.5	0	0	0	112.9	L142 C182 S183	L142-P179 HydrophobicContact CD1-CB 4.06Å; L142-P179 HydrophobicContact CD1-CG 3.41Å; L142-P179 VanDerWaalsContact CD1-CG 3.41Å; L142-P179 HydrophobicContact CD2-CB 3.6Å; L142-P179 HydrophobicContact CD2-CG 3.66Å; L142-P179 HydrophobicContact CG-CB 4.44Å; L142-P179 HydrophobicContact CG-CG 4.02Å; P179-C182 WeakPolarHBondContact O-CB 3.43Å; P179-C182 PolarHBondContact O-N 2.88Å; P179-S183 PolarHBondContact O-N 3.28Å; P179-S183 PolarHBondContact O-OG 2.73Å
180	L	50.9	Low	58.4	Low	7 Å²	7	65.1 Å²	65.1	4%	0.037	35%	0.347	C	S	.	.	H	α-helix	trans	-61.5	-48.3	170.5	-69.4	166.7	0	0	0	110.9	E121 I141 L142 Y145 G178 C182 S183 L184	E121-L180 HydrophobicContact CB-CD1 4.11Å; E121-L180 HydrophobicContact CG-CB 4.32Å; E121-L180 HydrophobicContact CG-CD1 4.32Å; I141-L180 HydrophobicContact CG2-CD1 3.87Å; I141-L180 HydrophobicContact CG2-CD2 4.44Å; L142-L180 HydrophobicContact CD2-CD2 3.88Å; L142-L180 HydrophobicContact CD2-CG 3.84Å; L142-L180 HydrophobicContact CG-CD2 4.43Å; L142-L180 HydrophobicContact CG-CG 4.33Å; Y145-L180 HydrophobicContact CD1-CD2 4.24Å; Y145-L180 HydrophobicContact CG-CD2 3.87Å; G178-L180 VanDerWaalsContact C-N 3.29Å; G178-L180 PolarHBondContact O-N 3.3Å; L180-C182 VanDerWaalsContact C-N 3.33Å; L180-C182 PolarHBondContact O-N 2.94Å; L180-S183 PolarHBondContact O-N 2.8Å; L180-L184 WeakPolarHBondContact O-CB 3.37Å; L180-L184 WeakPolarHBondContact O-CG 3.23Å; L180-L184 PolarHBondContact O-N 3.17Å
181	F	58	Low	58.4	Low	54 Å²	54	60.4 Å²	60.4	24%	0.237	32%	0.315	C	S	.	.	H	α-helix	trans	-59.3	-38.8	173.4	168.9	-93.9	0	0	0	113.2	E121 P174 G178 S185	E121-F181 WeakPolarHBondContact OE1-CB 3.48Å; E121-F181 PolarHBondContact OE1-N 2.9Å; E121-F181 WeakPolarHBondContact OE2-CB 3.12Å; P174-F181 HydrophobicContact CB-CD2 4.06Å; P174-F181 HydrophobicContact CB-CE2 3.96Å; P174-F181 HydrophobicContact CG-CE2 4.13Å; G178-F181 WeakPolarHBondContact O-CB 3.35Å; G178-F181 PolarHBondContact O-N 3.21Å; F181-S185 VanDerWaalsContact O-CB 3.23Å; F181-S185 WeakPolarHBondContact O-CB 3.23Å; F181-S185 PolarHBondContact O-N 3.26Å; F181-S185 PolarHBondContact O-OG 3.25Å
182	C	55.3	Low	58.2	Low	83 Å²	83	61.3 Å²	61.3	56%	0.561	30%	0.304	S	S	*	.	H	α-helix	trans	-61	-46.9	175.8	-72.8	0	0	0	0	111.3	G178 P179 L180 S185 S186	G178-C182 PolarHBondContact O-N 3.48Å; G178-C182 PolarHBondContact O-SG 3.3Å; G178-C182 VanDerWaalsContact O-SG 3.41Å; P179-C182 WeakPolarHBondContact O-CB 3.43Å; P179-C182 PolarHBondContact O-N 2.88Å; L180-C182 VanDerWaalsContact C-N 3.33Å; L180-C182 PolarHBondContact O-N 2.94Å; C182-S185 WeakPolarHBondContact O-CA 3.33Å; C182-S185 VanDerWaalsContact O-CB 3.3Å; C182-S185 WeakPolarHBondContact O-CB 3.32Å; C182-S185 PolarHBondContact O-N 3.18Å; C182-S186 PolarHBondContact O-N 2.77Å
183	S	58.5	Low	58.2	Low	21 Å²	21	64.5 Å²	64.5	15%	0.147	32%	0.324	C	S	.	.	H	α-helix	trans	-72.9	-40.7	-178.3	-55.8	0	0	0	0	112.7	Y145 P179 L180 S185 S186 I187	Y145-S183 VanDerWaalsContact CZ-CB 3.44Å; Y145-S183 WeakPolarHBondContact OH-CB 3.34Å; P179-S183 PolarHBondContact O-N 3.28Å; P179-S183 PolarHBondContact O-OG 2.73Å; L180-S183 PolarHBondContact O-N 2.8Å; S183-S185 PolarHBondContact O-N 2.9Å; S183-S186 WeakPolarHBondContact O-CA 3.41Å; S183-S186 VanDerWaalsContact O-CB 3.23Å; S183-S186 WeakPolarHBondContact O-CB 3.49Å; S183-S186 PolarHBondContact O-N 3.34Å; S183-I187 PolarHBondContact O-N 3.21Å
184	L	61	Low	57.3	Low	6 Å²	6	62.7 Å²	62.7	3%	0.031	32%	0.319	C	S	.	.	H	α-helix	trans	-57.8	-32.4	167.8	-78.3	170.3	0	0	0	112.3	L114 M117 L180 S186 I187 Y188	L114-L184 HydrophobicContact CD2-CD2 3.54Å; M117-L184 HydrophobicContact CB-CD1 4.43Å; M117-L184 HydrophobicContact CE-CD1 4.24Å; M117-L184 HydrophobicContact CE-CD2 3.66Å; M117-L184 HydrophobicContact CE-CG 4.04Å; M117-L184 HydrophobicContact SD-CD2 4.45Å; L180-L184 WeakPolarHBondContact O-CB 3.37Å; L180-L184 WeakPolarHBondContact O-CG 3.23Å; L180-L184 PolarHBondContact O-N 3.17Å; L184-S186 VanDerWaalsContact C-N 3.27Å; L184-S186 PolarHBondContact O-N 3.33Å; L184-I187 HydrophobicContact CD2-CD1 4.39Å; L184-Y188 WeakPolarHBondContact O-CB 3.23Å; L184-Y188 PolarHBondContact O-N 3.45Å
185	S	63.6	Low	56.2	Low	22 Å²	22	65.1 Å²	65.1	15%	0.154	35%	0.347	C	S	.	.	H	α-helix	trans	-71.5	-20.1	173.6	-64.2	0	0	0	0	113.1	F181 C182 S183 R189	F181-S185 VanDerWaalsContact O-CB 3.23Å; F181-S185 WeakPolarHBondContact O-CB 3.23Å; F181-S185 PolarHBondContact O-N 3.26Å; F181-S185 PolarHBondContact O-OG 3.25Å; C182-S185 WeakPolarHBondContact O-CA 3.33Å; C182-S185 VanDerWaalsContact O-CB 3.3Å; C182-S185 WeakPolarHBondContact O-CB 3.32Å; C182-S185 PolarHBondContact O-N 3.18Å; S183-S185 PolarHBondContact O-N 2.9Å; S185-R189 WeakPolarHBondContact O-CG 3.4Å; S185-R189 PolarHBondContact O-N 3.44Å
186	S	66.6	Low	55.4	Low	56 Å²	56	65.9 Å²	65.9	39%	0.392	35%	0.35	S	S	.	.	H	α-helix	trans	-73.5	-51.1	170.9	-158.7	0	0	0	0	111.4	C182 S183 L184 Y188 R189 E190	C182-S186 PolarHBondContact O-N 2.77Å; S183-S186 WeakPolarHBondContact O-CA 3.41Å; S183-S186 VanDerWaalsContact O-CB 3.23Å; S183-S186 WeakPolarHBondContact O-CB 3.49Å; S183-S186 PolarHBondContact O-N 3.34Å; L184-S186 VanDerWaalsContact C-N 3.27Å; L184-S186 PolarHBondContact O-N 3.33Å; S186-Y188 PolarHBondContact O-N 3.03Å; S186-R189 WeakPolarHBondContact O-CA 3.33Å; S186-R189 WeakPolarHBondContact O-CB 3.11Å; S186-R189 PolarHBondContact O-N 2.93Å; S186-E190 PolarHBondContact O-N 3.08Å
187	I	63.5	Low	54.4	Low	2 Å²	2	68 Å²	68	1%	0.01	36%	0.364	C	S	.	.	H	α-helix	trans	-53.6	-40.5	172.7	-52.6	178.2	0	0	0	110.6	M149 L158 I159 A162 S183 L184 R189 E190 G191	M149-I187 HydrophobicContact CE-CD1 3.79Å; M149-I187 HydrophobicContact CE-CG1 3.8Å; M149-I187 HydrophobicContact SD-CD1 3.56Å; M149-I187 VanDerWaalsContact SD-CD1 3.56Å; M149-I187 HydrophobicContact SD-CG1 4.27Å; L158-I187 HydrophobicContact CB-CD1 4.08Å; L158-I187 HydrophobicContact CB-CG2 4Å; L158-I187 HydrophobicContact CD1-CD1 3.96Å; I159-I187 HydrophobicContact CB-CG2 4.43Å; I159-I187 HydrophobicContact CG1-CG2 3.89Å; A162-I187 HydrophobicContact CB-CG2 4.39Å; S183-I187 PolarHBondContact O-N 3.21Å; L184-I187 HydrophobicContact CD2-CD1 4.39Å; I187-R189 VanDerWaalsContact C-N 3.3Å; I187-R189 PolarHBondContact O-N 3.3Å; I187-E190 PolarHBondContact O-N 2.89Å; I187-G191 PolarHBondContact O-N 3.43Å
188	Y	64	Low	53.2	Low	25 Å²	25	61.9 Å²	61.9	10%	0.098	36%	0.355	C	S	.	.	H	α-helix	trans	-69.6	-20	176	-179.2	-98.6	0	0	0	114	R166 W172 K173 P174 L184 S186	R166-Y188 HydrophobicContact CG-CE2 4.24Å; R166-Y188 VanDerWaalsContact CZ-CE2 3.49Å; R166-Y188 PolarHBondContact NE-OH 3.46Å; R166-Y188 PolarHBondContact NH1-O 3.13Å; R166-Y188 PolarHBondContact NH2-O 3.45Å; R166-Y188 PolarHBondContact NH2-OH 3.3Å; W172-Y188 HydrophobicContact CE3-CD2 4.03Å; W172-Y188 AromaticContact CE3-CE2 3.87Å; W172-Y188 HydrophobicContact CE3-CE2 3.87Å; W172-Y188 AromaticContact CZ3-CD2 3.72Å; W172-Y188 HydrophobicContact CZ3-CD2 3.72Å; W172-Y188 HydrophobicContact CZ3-CE2 4.06Å; W172-Y188 WeakPolarHBondContact O-CE2 3.09Å; W172-Y188 PolarHBondContact O-OH 3.02Å; K173-Y188 HydrophobicContact CB-CE1 4.3Å; K173-Y188 HydrophobicContact CD-CE1 4.49Å; K173-Y188 HydrophobicContact CG-CE1 3.71Å; K173-Y188 HydrophobicContact CG-CE2 4.41Å; K173-Y188 VanDerWaalsContact CG-OH 3.26Å; K173-Y188 WeakPolarHBondContact CG-OH 3.08Å; P174-Y188 VanDerWaalsContact CD-CG 3.47Å; P174-Y188 HydrophobicContact CG-CD1 4.47Å; P174-Y188 HydrophobicContact CG-CG 4.22Å; L184-Y188 WeakPolarHBondContact O-CB 3.23Å; L184-Y188 PolarHBondContact O-N 3.45Å; S186-Y188 PolarHBondContact O-N 3.03Å
189	R	63.9	Low	52	Low	163 Å²	163	69.3 Å²	69.3	62%	0.615	38%	0.383	S	S	*	.	H	α-helix	trans	-80.5	-45.7	167.2	-71.6	169.8	-171.2	-155.8	6.5	110.9	S185 S186 I187 G191 R192	S185-R189 WeakPolarHBondContact O-CG 3.4Å; S185-R189 PolarHBondContact O-N 3.44Å; S186-R189 WeakPolarHBondContact O-CA 3.33Å; S186-R189 WeakPolarHBondContact O-CB 3.11Å; S186-R189 PolarHBondContact O-N 2.93Å; I187-R189 VanDerWaalsContact C-N 3.3Å; I187-R189 PolarHBondContact O-N 3.3Å; R189-G191 PolarHBondContact O-N 3.14Å; R189-R192 WeakPolarHBondContact O-CB 3.4Å; R189-R192 PolarHBondContact O-N 3.15Å
190	E	62.2	Low	50.9	Low	50 Å²	50	70.5 Å²	70.5	23%	0.234	39%	0.392	C	S	.	.	H	α-helix	trans	-56.7	-48.2	177.2	-65.9	172.2	170.9	0	0	111.1	R155 I159 S186 I187 R192 N193	R155-E190 IonicContact CZ-OE1 3.73Å; R155-E190 IonicContact NE-OE1 3.62Å; R155-E190 IonicContact NE-OE2 3.24Å; R155-E190 IonicContact NH2-OE1 3.21Å; R155-E190 PolarHBondContact NH2-OE1 3.43Å; R155-E190 IonicContact NH2-OE2 2.63Å; I159-E190 HydrophobicContact CD1-CB 4.16Å; I159-E190 WeakPolarHBondContact CD1-OE2 2.96Å; I159-E190 HydrophobicContact CG1-CB 4.1Å; I159-E190 WeakPolarHBondContact CG1-OE2 3.42Å; I159-E190 HydrophobicContact CG2-CB 4.08Å; S186-E190 PolarHBondContact O-N 3.08Å; I187-E190 PolarHBondContact O-N 2.89Å; E190-R192 PolarHBondContact O-N 2.62Å; E190-N193 PolarHBondContact O-N 2.8Å; E190-N193 VanDerWaalsContact O-N 3.1Å
191	G	58.8	Low	49.9	Very low	2 Å²	2	78.3 Å²	78.3	2%	0.021	43%	0.429	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.6	17.9	175.4	0	0	0	0	0	114.8	R166 I187 R189	R166-G191 PolarHBondContact NH1-O 3.44Å; I187-G191 PolarHBondContact O-N 3.43Å; R189-G191 PolarHBondContact O-N 3.14Å
192	R	57.2	Low	48.5	Very low	147 Å²	147	85.8 Å²	85.8	56%	0.555	46%	0.461	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.7	-19.4	170.6	-156.2	176.6	-164.4	-168.6	-0.7	112.3	R166 R189 E190	R166-R192 VanDerWaalsContact NH1-CA 3.27Å; R166-R192 VanDerWaalsContact NH1-N 3.15Å; R189-R192 WeakPolarHBondContact O-CB 3.4Å; R189-R192 PolarHBondContact O-N 3.15Å; E190-R192 PolarHBondContact O-N 2.62Å
193	N	55.9	Low	47.2	Very low	109 Å²	109	85.4 Å²	85.4	58%	0.583	46%	0.46	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.3	-24.9	-174.6	-59.6	-3	0	0	0	111.4	E190 G195 K196 A197	E190-N193 PolarHBondContact O-N 2.8Å; E190-N193 VanDerWaalsContact O-N 3.1Å; N193-G195 PolarHBondContact O-N 2.95Å; N193-K196 PolarHBondContact O-N 3.46Å; N193-A197 PolarHBondContact O-N 3Å
194	I	47.1	Very low	45.8	Very low	89 Å²	89	90.2 Å²	90.2	46%	0.456	49%	0.487	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.4	117.2	167.8	-58.2	-173	0	0	0	109.1	I159 A163	I159-I194 HydrophobicContact CG2-CD1 3.57Å; I159-I194 HydrophobicContact CG2-CG1 4.35Å; A163-I194 HydrophobicContact CB-CB 4.27Å; A163-I194 HydrophobicContact CB-CD1 4.47Å; A163-I194 HydrophobicContact CB-CG2 4.36Å
195	G	36.4	Very low	44.4	Very low	63 Å²	63	95.3 Å²	95.3	65%	0.649	52%	0.519	S	S	*	.	T	Hydrogen-bonded Turn	trans	85.7	16.5	-172.5	0	0	0	0	0	114.9	N193	N193-G195 PolarHBondContact O-N 2.95Å
196	K	38.6	Very low	42.8	Very low	182 Å²	182	99 Å²	99	79%	0.791	55%	0.545	S	S	*	.	T	Hydrogen-bonded Turn	trans	-125.3	-18.2	166.1	-92.2	-174.8	164.1	-78	0	114.2	N193	N193-K196 PolarHBondContact O-N 3.46Å
197	A	30.6	Very low	41	Very low	75 Å²	75	103.7 Å²	103.7	62%	0.62	57%	0.565	S	S	*	*	S	Bend	trans	-88.8	136.5	158.1	0	0	0	0	0	109	N193	N193-A197 PolarHBondContact O-N 3Å
198	G	25.8	Very low	39.4	Very low	62 Å²	62	108.9 Å²	108.9	64%	0.639	59%	0.592	S	S	*	*			trans	-68.4	172	160.4	0	0	0	0	0	110.9	S200	G198-S200 PolarHBondContact O-N 3.15Å; G198-S200 VanDerWaalsContact O-N 3.13Å
199	H	24.3	Very low	37.6	Very low	179 Å²	179	112.6 Å²	112.6	83%	0.829	62%	0.619	S	S	*	*	S	Bend	trans	-61	114.9	-172.3	-77.6	-101	0	0	0	113.2	E201	H199-E201 IonicContact ND1-OE2 3.97Å
200	S	27.1	Very low	35.9	Very low	83 Å²	83	109.7 Å²	109.7	58%	0.58	62%	0.621	S	S	*	*			trans	-152.8	66.3	163.1	54.2	0	0	0	0	110.2	G198 K202	G198-S200 PolarHBondContact O-N 3.15Å; G198-S200 VanDerWaalsContact O-N 3.13Å; S200-K202 PolarHBondContact O-N 2.83Å
201	E	30.1	Very low	34.4	Very low	171 Å²	171	111.7 Å²	111.7	80%	0.799	63%	0.633	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.9	17.4	-173	-62.5	-170.8	101.9	0	0	115.1	H199	H199-E201 IonicContact ND1-OE2 3.97Å
202	K	28.2	Very low	32.8	Very low	212 Å²	212	118.4 Å²	118.4	92%	0.922	66%	0.663	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.9	-1.3	-171.1	-70.9	-170.2	173.1	-176	0	116.2	S200	S200-K202 PolarHBondContact O-N 2.83Å
203	S	26.9	Very low	31.3	Very low	75 Å²	75	115.3 Å²	115.3	52%	0.524	66%	0.663	S	S	.	*	S	Bend	trans	-130.1	-8.4	-164.2	60.5	0	0	0	0	118.8	T205	S203-T205 PolarHBondContact O-N 2.94Å
204	V	30.7	Very low	30	Very low	121 Å²	121	117.3 Å²	117.3	73%	0.733	67%	0.672	S	S	*	*	S	Bend	trans	-96.3	17.1	-167.6	-158.4	0	0	0	0	113.7
205	T	31	Very low	28.9	Very low	113 Å²	113	121.3 Å²	121.3	69%	0.693	69%	0.691	S	S	*	*	S	Bend	trans	-109	-9.5	-166.8	-31.3	0	0	0	0	115	S203	S203-T205 PolarHBondContact O-N 2.94Å
206	S	29	Very low	28.6	Very low	101 Å²	101	127.1 Å²	127.1	71%	0.706	70%	0.701	S	S	*	*	S	Bend	trans	-132.5	2	-168	56.9	0	0	0	0	117.4
207	L	29	Very low	28	Very low	154 Å²	154	129.6 Å²	129.6	81%	0.806	71%	0.706	S	S	*	*			trans	-128.8	42.5	-167.3	-73.4	170.9	0	0	0	115
208	L	31.3	Very low	27.7	Very low	110 Å²	110	132.6 Å²	132.6	58%	0.576	72%	0.719	S	S	*	*			trans	-130.3	121.3	176.8	-90.1	153.8	0	0	0	110.9
209	P	26.1	Very low	27.6	Very low	103 Å²	103	133.1 Å²	133.1	67%	0.669	72%	0.724	S	S	*	*			trans	-69.3	157.8	-176.6	29	-35.7	0	0	0	112.3	I211	P209-I211 PolarHBondContact O-N 3.2Å
210	P	26.5	Very low	27.7	Very low	102 Å²	102	132.8 Å²	132.8	66%	0.662	72%	0.723	S	S	*	*			trans	-60.1	133.5	176.7	25.2	-34.1	0	0	0	111.2	H212	P210-H212 VanDerWaalsContact C-N 3.3Å; P210-H212 PolarHBondContact O-N 2.77Å
211	I	31.5	Very low	27.6	Very low	93 Å²	93	134.7 Å²	134.7	48%	0.477	73%	0.733	S	S	.	*			trans	-76.4	88.7	170.9	-56	175.9	0	0	0	107.1	Y146 P209	Y146-I211 HydrophobicContact CD1-CG2 4.37Å; Y146-I211 HydrophobicContact CE1-CG2 4.42Å; P209-I211 PolarHBondContact O-N 3.2Å
212	H	25.5	Very low	27.5	Very low	142 Å²	142	129.4 Å²	129.4	66%	0.657	72%	0.719	S	S	*	*			trans	-58.6	144.1	169.2	-82.6	-96.3	0	0	0	110.2	P210 L214	P210-H212 VanDerWaalsContact C-N 3.3Å; P210-H212 PolarHBondContact O-N 2.77Å; H212-L214 PolarHBondContact O-N 2.93Å
213	P	26.2	Very low	27.4	Very low	83 Å²	83	128.9 Å²	128.9	54%	0.539	72%	0.717	S	S	.	*			trans	-61	131.8	168.9	27.4	-33.4	0	0	0	109.1	M215	P213-M215 PolarHBondContact O-N 3.44Å
214	L	27.4	Very low	27.4	Very low	150 Å²	150	133.5 Å²	133.5	79%	0.785	73%	0.73	S	S	*	*			trans	-73.5	83.5	169.6	-81.1	164.9	0	0	0	108.7	H212 E216	H212-L214 PolarHBondContact O-N 2.93Å; L214-E216 PolarHBondContact O-N 3.5Å; L214-E216 VanDerWaalsContact O-N 3.15Å
215	M	25.6	Very low	27.1	Very low	174 Å²	174	137.2 Å²	137.2	86%	0.857	74%	0.736	S	S	*	*			trans	-63.2	111.4	159.1	-81.4	-168.5	155.8	0	0	108	P213 R217	P213-M215 PolarHBondContact O-N 3.44Å; M215-R217 PolarHBondContact O-N 3.24Å; M215-R217 VanDerWaalsContact O-N 3.12Å
216	E	29.2	Very low	26.9	Very low	185 Å²	185	136.6 Å²	136.6	86%	0.864	74%	0.742	S	S	*	*			trans	-66.8	110.4	174	-64.4	-165	152.6	0	0	108.7	L214	L214-E216 PolarHBondContact O-N 3.5Å; L214-E216 VanDerWaalsContact O-N 3.15Å
217	R	25	Very low	26.8	Very low	234 Å²	234	143.3 Å²	143.3	88%	0.883	75%	0.752	S	S	*	*			trans	-57.4	127.9	165.2	-85.1	-176.2	171	172.4	-3	107.8	M215 G219	M215-R217 PolarHBondContact O-N 3.24Å; M215-R217 VanDerWaalsContact O-N 3.12Å; R217-G219 PolarHBondContact O-N 3.13Å
218	P	24.6	Very low	26.7	Very low	138 Å²	138	145.5 Å²	145.5	90%	0.896	76%	0.755	S	S	*	*	S	Bend	trans	-67.7	110.7	-178	26	-33.5	0	0	0	110.5
219	G	25.2	Very low	26.5	Very low	73 Å²	73	146.3 Å²	146.3	75%	0.753	76%	0.759	S	S	*	*			trans	107.6	83.8	164.3	0	0	0	0	0	116.9	R217	R217-G219 PolarHBondContact O-N 3.13Å
220	E	26.6	Very low	26.4	Very low	171 Å²	171	151.8 Å²	151.8	80%	0.799	77%	0.766	S	S	*	*			trans	-156.2	125.4	138.9	-121.6	-163	150.7	0	0	112.8	A222	E220-A222 VanDerWaalsContact C-N 3.27Å; E220-A222 PolarHBondContact O-N 3.26Å
221	P	24.4	Very low	26.4	Very low	123 Å²	123	156.5 Å²	156.5	80%	0.799	77%	0.772	S	S	*	*			trans	-85.3	55.2	-176.3	35	-36.3	0	0	0	113.2	K223	P221-K223 PolarHBondContact O-N 2.89Å
222	A	27.3	Very low	26.2	Very low	60 Å²	60	158.8 Å²	158.8	50%	0.496	79%	0.785	S	S	.	*			trans	-74.7	103.1	-168.6	0	0	0	0	0	114.3	E220 H224	E220-A222 VanDerWaalsContact C-N 3.27Å; E220-A222 PolarHBondContact O-N 3.26Å; A222-H224 VanDerWaalsContact C-N 3.28Å; A222-H224 PolarHBondContact O-N 3.44Å
223	K	26.3	Very low	26.2	Very low	201 Å²	201	157.8 Å²	157.8	87%	0.874	79%	0.791	S	S	*	*			trans	-72.6	58.9	-177.1	-65.8	169.4	-178.2	160.6	0	114.6	P221 K225	P221-K223 PolarHBondContact O-N 2.89Å; K223-K225 PolarHBondContact O-N 2.84Å; K223-K225 VanDerWaalsContact O-N 3.08Å
224	H	26.8	Very low	26.3	Very low	172 Å²	172	163 Å²	163	80%	0.796	81%	0.811	S	S	*	*			trans	-71.8	104.2	-178.5	-81.3	-82.9	0	0	0	114	A222 A226	A222-H224 VanDerWaalsContact C-N 3.28Å; A222-H224 PolarHBondContact O-N 3.44Å; H224-A226 PolarHBondContact O-N 3.16Å; H224-A226 VanDerWaalsContact O-N 3.12Å
225	K	25	Very low	26.3	Very low	200 Å²	200	160.4 Å²	160.4	87%	0.87	81%	0.811	S	S	*	*			trans	-61.6	108.8	168.2	-69	173.3	-179.1	168.1	0	110	K223 R227	K223-K225 PolarHBondContact O-N 2.84Å; K223-K225 VanDerWaalsContact O-N 3.08Å; K225-R227 PolarHBondContact O-N 3.32Å
226	A	27.2	Very low	26.2	Very low	100 Å²	100	162.7 Å²	162.7	83%	0.826	81%	0.812	S	S	*	*			trans	-58.2	107.5	176.8	0	0	0	0	0	111.9	H224 K228	H224-A226 PolarHBondContact O-N 3.16Å; H224-A226 VanDerWaalsContact O-N 3.12Å; A226-K228 PolarHBondContact O-N 3.09Å
227	R	25.8	Very low	26	Very low	242 Å²	242	157.4 Å²	157.4	91%	0.913	81%	0.807	S	S	*	*			trans	-60	132.1	174.4	-86.9	-178.6	166.2	179.7	-3.9	110	K225 I229	K225-R227 PolarHBondContact O-N 3.32Å; R227-I229 PolarHBondContact O-N 2.94Å
228	K	26.7	Very low	26	Very low	200 Å²	200	152.7 Å²	152.7	87%	0.87	81%	0.805	S	S	*	*			trans	-89.4	87.7	-170.7	-167.7	178.3	-173.4	177.6	0	110.8	A226 R230	A226-K228 PolarHBondContact O-N 3.09Å; K228-R230 PolarHBondContact O-N 2.91Å; K228-R230 VanDerWaalsContact O-N 3.1Å
229	I	26.9	Very low	26.2	Very low	127 Å²	127	151.5 Å²	151.5	65%	0.651	80%	0.8	S	S	*	*			trans	-57.7	114.2	177.5	-55	174.9	0	0	0	109.9	R227 Y231	R227-I229 PolarHBondContact O-N 2.94Å; I229-Y231 HydrophobicContact CG2-CD2 4.03Å; I229-Y231 HydrophobicContact CG2-CE2 3.98Å
230	R	24.6	Very low	26.1	Very low	217 Å²	217	153.8 Å²	153.8	82%	0.819	80%	0.804	S	S	*	*			trans	-91.3	150	159.4	-82.7	-179.6	164.1	166.5	-7.1	108.4	K228	K228-R230 PolarHBondContact O-N 2.91Å; K228-R230 VanDerWaalsContact O-N 3.1Å
231	Y	27.5	Very low	26.2	Very low	201 Å²	201	153.2 Å²	153.2	79%	0.788	80%	0.801	S	S	*	*			trans	-116.8	132.4	160.3	-91.5	-104.3	0	0	0	105.2	I229	I229-Y231 HydrophobicContact CG2-CD2 4.03Å; I229-Y231 HydrophobicContact CG2-CE2 3.98Å
232	D	25.9	Very low	26.2	Very low	142 Å²	142	155.5 Å²	155.5	76%	0.759	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-81	151.8	179.8	-67.1	-58.5	0	0	0	112
233	P	26.5	Very low	26.1	Very low	120 Å²	120	161.4 Å²	161.4	78%	0.779	82%	0.821	S	S	*	*	P	Polyproline II helix	trans	-82.9	117.8	172.1	32.5	-29.7	0	0	0	109.7
234	M	28.1	Very low	26.1	Very low	194 Å²	194	157 Å²	157	96%	0.956	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-73.9	158.1	167.9	-126.4	169.8	179.5	0	0	110.8
235	A	26.2	Very low	26.1	Very low	95 Å²	95	153.9 Å²	153.9	79%	0.785	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-68.8	161.5	-159.1	0	0	0	0	0	115.4	G237	A235-G237 PolarHBondContact O-N 3.3Å
236	Y	24.6	Very low	26.4	Very low	221 Å²	221	150.6 Å²	150.6	87%	0.867	81%	0.809	S	S	*	*			trans	-69.6	111.9	170.6	-75.9	-102.5	0	0	0	110.1
237	G	25.8	Very low	26.5	Very low	75 Å²	75	153.9 Å²	153.9	77%	0.773	81%	0.808	S	S	*	*			trans	-78.3	111.9	157.4	0	0	0	0	0	108.9	A235	A235-G237 PolarHBondContact O-N 3.3Å
238	T	24.6	Very low	26.6	Very low	135 Å²	135	150.6 Å²	150.6	83%	0.828	81%	0.808	S	S	*	*			trans	-92.8	95	177.6	48.3	0	0	0	0	110.7
239	S	27.6	Very low	26.8	Very low	113 Å²	113	148.8 Å²	148.8	79%	0.79	81%	0.808	S	S	*	*			trans	-130.9	117.6	161.1	49.7	0	0	0	0	108.9
240	S	24.2	Very low	26.9	Very low	121 Å²	121	147 Å²	147	85%	0.846	81%	0.812	S	S	*	*			trans	-101.5	84.1	-176.1	54	0	0	0	0	110.3
241	E	27.5	Very low	27.2	Very low	159 Å²	159	143.8 Å²	143.8	74%	0.743	81%	0.811	S	S	*	*			trans	-121.9	141.5	171.4	-66.3	-167	144.7	0	0	110.6	F243	E241-F243 HydrophobicContact CB-CE2 4.37Å; E241-F243 PolarHBondContact O-N 3.5Å
242	L	24.4	Very low	27.3	Very low	171 Å²	171	143.3 Å²	143.3	90%	0.895	82%	0.816	S	S	*	*			trans	-81	118.2	-177.4	-68.5	81.7	0	0	0	109
243	F	25.8	Very low	27.4	Very low	183 Å²	183	140 Å²	140	80%	0.803	82%	0.815	S	S	*	*			trans	-118.8	122	159.8	-78.5	-87.7	0	0	0	108.7	E241	E241-F243 HydrophobicContact CB-CE2 4.37Å; E241-F243 PolarHBondContact O-N 3.5Å
244	S	26.3	Very low	27.5	Very low	108 Å²	108	141.8 Å²	141.8	76%	0.755	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-58.4	152.3	176.8	-58.8	0	0	0	0	110.9
245	P	27.6	Very low	27.5	Very low	108 Å²	108	139.7 Å²	139.7	70%	0.701	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-58.1	140	160.3	29.2	-33.7	0	0	0	108.5
246	P	29.7	Very low	27.5	Very low	130 Å²	130	142.1 Å²	142.1	84%	0.844	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-60.1	141.2	166.9	27.9	-33.8	0	0	0	108.7
247	E	30	Very low	27.7	Very low	170 Å²	170	139.5 Å²	139.5	79%	0.794	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-78.5	163	-172.3	-58.8	-170.6	102.1	0	0	111.2	D249	E247-D249 PolarHBondContact O-N 3.35Å
248	D	27.5	Very low	27.8	Very low	172 Å²	172	143.2 Å²	143.2	92%	0.92	81%	0.809	S	S	*	*			trans	-77	74.8	177.2	-77	-58.5	0	0	0	109.6	A250	D248-A250 PolarHBondContact O-N 2.99Å; D248-A250 VanDerWaalsContact O-N 3.14Å
249	D	31.2	Very low	27.9	Very low	162 Å²	162	145.2 Å²	145.2	87%	0.866	81%	0.814	S	S	*	*			trans	-66.2	108.4	169.4	-73.1	-36.5	0	0	0	109.4	E247	E247-D249 PolarHBondContact O-N 3.35Å
250	A	29.4	Very low	27.8	Very low	89 Å²	89	150.2 Å²	150.2	74%	0.736	82%	0.816	S	S	*	*			trans	-120.3	108.6	172.5	0	0	0	0	0	108.8	D248	D248-A250 PolarHBondContact O-N 2.99Å; D248-A250 VanDerWaalsContact O-N 3.14Å
251	D	30.4	Very low	27.8	Very low	151 Å²	151	151.9 Å²	151.9	81%	0.807	81%	0.814	S	S	*	*			trans	-161	151.3	159.2	-114.6	-29.5	0	0	0	111.9
252	E	30	Very low	27.5	Very low	190 Å²	190	149.2 Å²	149.2	89%	0.888	81%	0.811	S	S	*	*			trans	57.5	151.6	170.3	-51.3	-169.7	170	0	0	117.6
253	G	27.6	Very low	27.6	Very low	72 Å²	72	147.3 Å²	147.3	74%	0.742	81%	0.809	S	S	*	*			cis	-170.6	165.1	-6.1	0	0	0	0	0	109.5
254	D	28.9	Very low	27.6	Very low	158 Å²	158	147.5 Å²	147.5	85%	0.845	81%	0.809	S	S	*	*			trans	-82.2	-176	166.1	-86.4	-54.7	0	0	0	110.5
255	D	27.8	Very low	27.5	Very low	150 Å²	150	147.1 Å²	147.1	80%	0.802	81%	0.807	S	S	*	*			trans	90.2	127.8	164.8	-55.3	-28.8	0	0	0	120.5
256	D	26.7	Very low	27.5	Very low	146 Å²	146	148 Å²	148	78%	0.781	82%	0.815	S	S	*	*			trans	66.7	118.7	146.3	-65.5	-10.2	0	0	0	125	Q258	D256-Q258 PolarHBondContact O-N 3.44Å
257	D	29.1	Very low	27.2	Very low	167 Å²	167	151 Å²	151	89%	0.893	82%	0.818	S	S	*	*			trans	-28.8	107.1	153.4	-75.8	-48.8	0	0	0	115.7
258	Q	28	Very low	26.9	Very low	152 Å²	152	147.4 Å²	147.4	71%	0.71	82%	0.817	S	S	*	*			trans	-130.7	106.6	155.6	-69.8	-156.6	22.4	0	0	114	D256 W260	D256-Q258 PolarHBondContact O-N 3.44Å; Q258-W260 PolarHBondContact O-N 2.77Å
259	L	25.5	Very low	26.9	Very low	178 Å²	178	147 Å²	147	93%	0.932	82%	0.815	S	S	*	*			trans	-62.2	106.8	165.3	-72.3	156.8	0	0	0	111
260	W	26.4	Very low	26.5	Very low	218 Å²	218	147.5 Å²	147.5	83%	0.826	82%	0.817	S	S	*	*			trans	-120.4	130.1	168.6	-78.7	91.6	0	0	0	113.1	Q258	Q258-W260 PolarHBondContact O-N 2.77Å
261	L	23.6	Very low	26.3	Very low	156 Å²	156	153.4 Å²	153.4	82%	0.817	83%	0.826	S	S	*	*	P	Polyproline II helix	trans	-82.3	158	-170.9	-75.1	163.4	0	0	0	112.4
262	P	22.3	Very low	26	Very low	103 Å²	103	149.7 Å²	149.7	67%	0.669	82%	0.824	S	S	*	*	P	Polyproline II helix	trans	-67.3	135	-175.7	26.9	-35.3	0	0	0	112.3	K264	P262-K264 PolarHBondContact O-N 2.74Å
263	P	26.3	Very low	25.8	Very low	131 Å²	131	146.1 Å²	146.1	85%	0.851	82%	0.82	S	S	*	*	P	Polyproline II helix	trans	-65.2	127.5	172.8	26.5	-33	0	0	0	110.4
264	K	24.7	Very low	25.8	Very low	187 Å²	187	149 Å²	149	81%	0.813	82%	0.823	S	S	*	*	P	Polyproline II helix	trans	-79.6	170.1	-179.4	-67.2	179.3	178.6	176.7	0	112.2	P262	P262-K264 PolarHBondContact O-N 2.74Å
265	S	24	Very low	25.9	Very low	100 Å²	100	148.8 Å²	148.8	70%	0.699	82%	0.822	S	S	*	*			trans	55.8	105.9	152.4	54.4	0	0	0	0	118.9
266	S	28.1	Very low	25.9	Very low	126 Å²	126	149.3 Å²	149.3	88%	0.881	82%	0.824	S	S	*	*			trans	-144.2	118.2	130.8	-53	0	0	0	0	107
267	E	23.1	Very low	26	Very low	193 Å²	193	150 Å²	150	90%	0.902	83%	0.828	S	S	*	*			trans	-91.9	148.5	-170.6	-62.6	169.9	120.3	0	0	112.1
268	A	24.7	Very low	25.8	Very low	95 Å²	95	145.9 Å²	145.9	79%	0.785	83%	0.825	S	S	*	*			trans	-154	73.7	168.8	0	0	0	0	0	111.9
269	N	26.9	Very low	25.5	Very low	163 Å²	163	143 Å²	143	87%	0.872	83%	0.828	S	S	*	*			trans	56.9	98.3	157.5	-60.4	-38.9	0	0	0	119
270	L	22.8	Very low	25.4	Very low	172 Å²	172	143.4 Å²	143.4	90%	0.901	83%	0.825	S	S	*	*			trans	-66.8	142.9	150.2	-76.7	156.9	0	0	0	110.9
271	K	26.3	Very low	25.2	Very low	213 Å²	213	139.2 Å²	139.2	93%	0.926	82%	0.823	S	S	*	*			trans	-132.7	128.4	134.9	-93.9	-165.6	173.6	-172.8	0	107.5
272	G	22.9	Very low	25.1	Very low	74 Å²	74	139.1 Å²	139.1	76%	0.763	82%	0.822	S	S	*	*			trans	-127.2	159	176	0	0	0	0	0	110.8
273	S	26.9	Very low	25	Very low	115 Å²	115	141.7 Å²	141.7	80%	0.804	83%	0.83	S	S	*	*			trans	-147.7	105.1	159.9	52.9	0	0	0	0	106.3
274	T	27.9	Very low	24.8	Very low	133 Å²	133	139.1 Å²	139.1	82%	0.816	82%	0.82	S	S	*	*			trans	-71.6	142.1	157.1	43.6	0	0	0	0	108.3
275	D	29.5	Very low	24.7	Very low	153 Å²	153	139.1 Å²	139.1	82%	0.818	82%	0.823	S	S	*	*			trans	-149.3	151.6	150.1	-86.5	-43.9	0	0	0	107.8
276	D	28.8	Very low	24.6	Very low	160 Å²	160	140 Å²	140	86%	0.856	82%	0.823	S	S	*	*			trans	-76.4	120.3	-165.6	-56.7	-73	0	0	0	113.3
277	D	28.2	Very low	24.3	Very low	161 Å²	161	145.2 Å²	145.2	86%	0.861	82%	0.824	S	S	*	*				-170.1	152.1	111.7	-126.8	-34.9	0	0	0	113.5	A279	D277-A279 PolarHBondContact O-N 2.7Å
278	G	25.1	Very low	24.3	Very low	80 Å²	80	144.1 Å²	144.1	83%	0.825	82%	0.818	S	S	*	*	S	Bend	trans	-81.3	45.8	-156.6	0	0	0	0	0	119.7
279	A	21.5	Very low	24.6	Very low	93 Å²	93	145 Å²	145	77%	0.769	82%	0.816	S	S	*	*			trans	-157.9	119.1	170.5	0	0	0	0	0	115.3	D277	D277-A279 PolarHBondContact O-N 2.7Å
280	Q	23.8	Very low	24.6	Very low	185 Å²	185	143.7 Å²	143.7	86%	0.864	81%	0.814	S	S	*	*			trans	-137.7	119.3	166.8	-69.3	-165.6	10.9	0	0	114.7
281	V	21.4	Very low	24.7	Very low	131 Å²	131	144.7 Å²	144.7	79%	0.794	81%	0.814	S	S	*	*			trans	-80.6	150.8	150.7	175.3	0	0	0	0	107.6
282	I	21.8	Very low	24.6	Very low	154 Å²	154	139.5 Å²	139.5	79%	0.79	81%	0.805	S	S	*	*			trans	-171.4	114	142.7	-99.9	149.2	0	0	0	113.1
283	D	21.2	Very low	24.7	Very low	156 Å²	156	141.3 Å²	141.3	83%	0.834	80%	0.801	S	S	*	*				48.6	168.3	128.9	-136.2	-8.5	0	0	0	124
284	A	22.4	Very low	24.8	Very low	78 Å²	78	145 Å²	145	65%	0.645	80%	0.803	S	S	*	*			trans	-128.1	166.7	-173.2	0	0	0	0	0	112.9
285	Q	21.8	Very low	24.6	Very low	186 Å²	186	142.7 Å²	142.7	87%	0.869	80%	0.797	S	S	*	*			trans	-131.9	141.3	165.1	-71.6	-162.5	8.2	0	0	113.1
286	V	21	Very low	24.4	Very low	118 Å²	118	147.7 Å²	147.7	72%	0.715	80%	0.804	S	S	*	*			trans	-129.2	141.9	176.7	174.7	0	0	0	0	108.2
287	R	23.1	Very low	24.4	Very low	236 Å²	236	150.1 Å²	150.1	89%	0.891	81%	0.808	S	S	*	*			trans	-130	153.8	163.1	-76.2	-168.4	170.9	-173	-2.9	111.3
288	H	23.2	Very low	24.3	Very low	171 Å²	171	147.4 Å²	147.4	79%	0.792	80%	0.801	S	S	*	*			trans	-97.7	161.4	-153.1	-93.1	-113.6	0	0	0	115.6
289	P	29.9	Very low	24.4	Very low	113 Å²	113	151 Å²	151	73%	0.734	80%	0.801	S	S	*	*			trans	-100	163.7	175.8	39.4	-34.3	0	0	0	113.3
290	T	26.5	Very low	24.5	Very low	136 Å²	136	154 Å²	154	83%	0.834	80%	0.804	S	S	*	*			trans	-145.3	144.7	171.7	5.7	0	0	0	0	114.7
291	Q	26.3	Very low	24.5	Very low	192 Å²	192	154.7 Å²	154.7	90%	0.897	80%	0.804	S	S	*	*			trans	82.2	152.6	159.7	-65.4	-176.8	7.5	0	0	121.1
292	S	24.1	Very low	24.6	Very low	104 Å²	104	154.9 Å²	154.9	73%	0.727	80%	0.799	S	S	*	*			trans	-122.6	-177.4	-170.4	56.6	0	0	0	0	107.7
293	V	25.1	Very low	24.7	Very low	112 Å²	112	157.1 Å²	157.1	68%	0.679	80%	0.803	S	S	*	*			cis	-133.1	-148.6	16	-133.5	0	0	0	0	108.2
294	F	28.2	Very low	24.9	Very low	193 Å²	193	156.9 Å²	156.9	85%	0.846	80%	0.801	S	S	*	*			cis	-145.4	-177.2	0.6	-125.2	-47.7	0	0	0	108.7
295	A	22.9	Very low	25.1	Very low	85 Å²	85	158.7 Å²	158.7	70%	0.702	81%	0.806	S	S	*	*			trans	-146.4	142	170.7	0	0	0	0	0	111.8
296	R	26.8	Very low	25.2	Very low	257 Å²	257	155.8 Å²	155.8	97%	0.97	80%	0.797	S	S	*	*			trans	-112.8	137	161.3	-80.5	-169.2	171.1	-167	-2.2	110.2
297	K	27.3	Very low	25.4	Very low	212 Å²	212	158 Å²	158	92%	0.922	80%	0.803	S	S	*	*			trans	-93.3	132.9	-175.4	-59.9	167.8	-177.9	169.8	0	109.8
298	S	26.7	Very low	25.6	Very low	104 Å²	104	155.2 Å²	155.2	73%	0.727	80%	0.798	S	S	*	*			trans	-151	134.9	151.5	55.3	0	0	0	0	111.6	L300	S298-L300 PolarHBondContact O-N 2.75Å
299	N	27.2	Very low	25.8	Very low	155 Å²	155	152.6 Å²	152.6	83%	0.829	80%	0.799	S	S	*	*			trans	59.8	44.1	156.9	-56.6	-24.2	0	0	0	119.1	K301	N299-K301 PolarHBondContact O-N 3.2Å
300	L	23	Very low	25.6	Very low	156 Å²	156	153.2 Å²	153.2	82%	0.817	80%	0.8	S	S	*	*			trans	-70	109.2	143.7	-112.7	168.4	0	0	0	108.4	S298 I302	S298-L300 PolarHBondContact O-N 2.75Å; L300-I302 HydrophobicContact CD2-CD1 4.25Å; L300-I302 HydrophobicContact CD2-CG1 3.97Å
301	K	24.8	Very low	25.5	Very low	200 Å²	200	158 Å²	158	87%	0.87	80%	0.803	S	S	*	*			trans	-125.8	81.7	174	-143.9	167.2	-168.4	171.5	0	110.6	N299 K303	N299-K301 PolarHBondContact O-N 3.2Å; K301-K303 PolarHBondContact O-N 3.35Å
302	I	23.5	Very low	25.4	Very low	135 Å²	135	151.9 Å²	151.9	69%	0.692	79%	0.785	S	S	*	*			trans	-68.2	124	176.5	-62.9	172	0	0	0	108.6	L300	L300-I302 HydrophobicContact CD2-CD1 4.25Å; L300-I302 HydrophobicContact CD2-CG1 3.97Å
303	K	24	Very low	25.5	Very low	200 Å²	200	152.8 Å²	152.8	87%	0.87	79%	0.786	S	S	*	*			trans	-106.1	96.1	165.5	-85.3	-169.1	172.4	-174	0	110.4	K301	K301-K303 PolarHBondContact O-N 3.35Å
304	L	25.8	Very low	25.5	Very low	152 Å²	152	153.1 Å²	153.1	80%	0.796	79%	0.79	S	S	*	*			trans	-97.2	162.7	137.3	-63.5	168.2	0	0	0	106.5
305	P	26	Very low	25.4	Very low	115 Å²	115	148.2 Å²	148.2	75%	0.747	79%	0.786	S	S	*	*			cis	-120.1	-172.5	-8.4	41.8	-29.1	0	0	0	111.8
306	N	24.3	Very low	25.5	Very low	126 Å²	126	152.9 Å²	152.9	67%	0.674	79%	0.79	S	S	*	*				-160.3	99.3	124.2	-158.5	0.5	0	0	0	111.5	K308	N306-K308 VanDerWaalsContact C-N 3.29Å; N306-K308 PolarHBondContact O-N 3.22Å; N306-K308 VanDerWaalsContact O-N 3.09Å; N306-K308 WeakPolarHBondContact OD1-CB 3.16Å; N306-K308 VanDerWaalsContact OD1-CG 3.29Å; N306-K308 WeakPolarHBondContact OD1-CG 3.39Å
307	L	24.4	Very low	25.5	Very low	164 Å²	164	149.5 Å²	149.5	86%	0.859	79%	0.785	S	S	*	*			trans	-83.3	70.1	172.9	-77.6	167.8	0	0	0	110.3
308	K	27.2	Very low	25.5	Very low	177 Å²	177	150.6 Å²	150.6	77%	0.77	78%	0.783	S	S	*	*			trans	-135.2	55.8	-178.4	-75.6	-168.8	175.6	-172.6	0	114.3	N306	N306-K308 VanDerWaalsContact C-N 3.29Å; N306-K308 PolarHBondContact O-N 3.22Å; N306-K308 VanDerWaalsContact O-N 3.09Å; N306-K308 WeakPolarHBondContact OD1-CB 3.16Å; N306-K308 VanDerWaalsContact OD1-CG 3.29Å; N306-K308 WeakPolarHBondContact OD1-CG 3.39Å
309	S	28	Very low	25.4	Very low	116 Å²	116	156.1 Å²	156.1	81%	0.811	79%	0.788	S	S	*	*			trans	-155.2	36.9	158.8	54.6	0	0	0	0	113.1	R311	S309-R311 PolarHBondContact O-N 2.86Å
310	V	24.4	Very low	25.2	Very low	126 Å²	126	153.3 Å²	153.3	76%	0.764	78%	0.781	S	S	*	*			trans	-68.9	99.9	166.8	171.9	0	0	0	0	108.7	A312	V310-A312 HydrophobicContact CG1-CB 3.85Å
311	R	25	Very low	25.4	Very low	237 Å²	237	153.9 Å²	153.9	89%	0.894	78%	0.783	S	S	*	*			trans	-133.9	81.8	169.5	-156.8	-177.2	-159.5	-173.2	7.4	105.8	S309	S309-R311 PolarHBondContact O-N 2.86Å
312	A	24.5	Very low	25.5	Very low	64 Å²	64	151.2 Å²	151.2	53%	0.529	78%	0.783	S	S	.	*			cis	60.9	78.3	47.5	0	0	0	0	0	112.5	V310	V310-A312 HydrophobicContact CG1-CB 3.85Å
313	V	26.1	Very low	25.5	Very low	123 Å²	123	147.1 Å²	147.1	75%	0.745	77%	0.774	S	S	*	*			trans	65.6	157.8	153	-107.4	0	0	0	0	116.4	A315	V313-A315 HydrophobicContact CG1-CB 4.28Å; V313-A315 VanDerWaalsContact CG1-N 3.34Å
314	P	25.2	Very low	25.5	Very low	118 Å²	118	148.3 Å²	148.3	77%	0.766	77%	0.773	S	S	*	*				-125.1	123.4	52.3	35.5	-19.4	0	0	0	116.3	K316	P314-K316 VanDerWaalsContact C-N 3.32Å; P314-K316 PolarHBondContact O-N 2.98Å; P314-K316 VanDerWaalsContact O-N 3.17Å
315	A	25.9	Very low	25.5	Very low	90 Å²	90	148.1 Å²	148.1	74%	0.744	77%	0.773	S	S	*	*			trans	-79.2	85.3	153.5	0	0	0	0	0	107.7	V313	V313-A315 HydrophobicContact CG1-CB 4.28Å; V313-A315 VanDerWaalsContact CG1-N 3.34Å
316	K	25.8	Very low	25.6	Very low	183 Å²	183	148.2 Å²	148.2	80%	0.796	77%	0.773	S	S	*	*			trans	-165.7	86.4	169	-109.6	162.3	-171.5	179	0	111.6	P314	P314-K316 VanDerWaalsContact C-N 3.32Å; P314-K316 PolarHBondContact O-N 2.98Å; P314-K316 VanDerWaalsContact O-N 3.17Å
317	H	27.4	Very low	25.5	Very low	187 Å²	187	147.4 Å²	147.4	87%	0.866	78%	0.778	S	S	*	*			trans	-136.2	56.3	141.9	-123.5	-70.7	0	0	0	110.5
318	R	25.3	Very low	25.5	Very low	235 Å²	235	143.5 Å²	143.5	89%	0.887	77%	0.769	S	S	*	*			trans	-63.7	160.1	148.4	-100.9	-173.9	171.9	-168.2	-1.6	108.1
319	R	25.8	Very low	25.4	Very low	220 Å²	220	143.1 Å²	143.1	83%	0.83	77%	0.772	S	S	*	*			trans	82.6	96.6	-167.1	-55.3	174.2	-180	179.9	-1.7	111
320	S	23.2	Very low	25.1	Very low	96 Å²	96	141.7 Å²	141.7	67%	0.671	77%	0.767	S	S	*	*				75.6	85.4	63.3	77.3	0	0	0	0	112.9
321	I	27.6	Very low	25.2	Very low	168 Å²	168	143.7 Å²	143.7	86%	0.862	77%	0.772	S	S	*	*			trans	-98.8	94.4	146.1	-63.5	-180	0	0	0	105.6
322	V	25.8	Very low	25.1	Very low	143 Å²	143	136.3 Å²	136.3	87%	0.867	76%	0.756	S	S	*	*			trans	-82	125.6	159.5	173.6	0	0	0	0	105.7
323	G	24.4	Very low	25.1	Very low	49 Å²	49	140.5 Å²	140.5	51%	0.505	77%	0.768	S	S	.	*			trans	152.8	81.5	-169.5	0	0	0	0	0	108.4
324	R	24	Very low	25	Very low	226 Å²	226	141 Å²	141	85%	0.853	76%	0.762	S	S	*	*				81.9	124.9	83.2	-83.1	-175.8	171.7	-178.7	-2.4	112
325	N	26.3	Very low	24.8	Very low	148 Å²	148	141.8 Å²	141.8	79%	0.791	76%	0.76	S	S	*	*			trans	75.2	154.8	155.6	-58.1	-1.3	0	0	0	116.1
326	P	26.4	Very low	24.7	Very low	117 Å²	117	142.3 Å²	142.3	76%	0.76	76%	0.758	S	S	*	*				-137.5	-157.9	-74.8	34.9	-14.1	0	0	0	112.4
327	S	22.6	Very low	24.5	Very low	109 Å²	109	138.2 Å²	138.2	76%	0.762	76%	0.759	S	S	*	*			trans	-1.1	126.3	149.7	-164.3	0	0	0	0	115.9
328	A	23.8	Very low	24.3	Very low	82 Å²	82	134.6 Å²	134.6	68%	0.678	76%	0.761	S	S	*	*				-167.6	165.3	66.9	0	0	0	0	0	110.2
329	M	26.3	Very low	24.3	Very low	169 Å²	169	126.8 Å²	126.8	83%	0.833	75%	0.754	S	S	*	*			cis	-148.5	151.4	-3.5	-116.7	161.1	-176.1	0	0	106.6
330	A	22.4	Very low	24.2	Very low	85 Å²	85	128.2 Å²	128.2	70%	0.702	76%	0.76	S	S	*	*				36.8	133.2	98.6	0	0	0	0	0	114.7
331	I	26	Very low	24.5	Very low	169 Å²	169	129 Å²	129	87%	0.867	76%	0.763	S	S	*	*			cis	-106.8	130.6	45.8	-59	172.4	0	0	0	113.5
332	S	22.7	Very low	24.6	Very low	81 Å²	81	126.6 Å²	126.6	57%	0.566	76%	0.757	S	S	*	*			trans	-130.2	117.5	164	146.3	0	0	0	0	107.4
333	I	24.3	Very low	24.5	Very low	152 Å²	152	126.1 Å²	126.1	78%	0.779	76%	0.755	S	S	*	*			trans	-138.6	95.8	156.3	-55.8	-179	0	0	0	103.9
334	Q	23.1	Very low	24.4	Very low	133 Å²	133	134.1 Å²	134.1	62%	0.621	77%	0.77	S	S	*	*				64.4	132.7	65.8	-71	-168.9	-19	0	0	114.3
335	N	22.1	Very low	24.5	Very low	135 Å²	135	132 Å²	132	72%	0.722	77%	0.772	S	S	*	*			trans	64.6	161.9	146.7	-58.6	-5	0	0	0	116.7
336	S	22.7	Very low	24.3	Very low	101 Å²	101	130.3 Å²	130.3	71%	0.706	77%	0.767	S	S	*	*			cis	-172.8	173.4	-28.8	-90.1	0	0	0	0	105.7
337	A	22.1	Very low	24.3	Very low	98 Å²	98	131.2 Å²	131.2	81%	0.81	77%	0.77	S	S	*	*			trans	67.1	126	154.8	0	0	0	0	0	119.9
338	A	22.9	Very low	24.5	Very low	110 Å²	110	130.6 Å²	130.6	91%	0.909	77%	0.766	S	S	*	*			trans	2.7	136.9	139.1	0	0	0	0	0	120.6
339	G	25.4	Very low	24.6	Very low	72 Å²	72	133.7 Å²	133.7	74%	0.742	77%	0.771	S	S	*	*			trans	152	65	172.2	0	0	0	0	0	110.5
340	R	23.1	Very low	24.9	Very low	250 Å²	250	129.7 Å²	129.7	94%	0.943	76%	0.757	S	S	*	*				63.7	144.7	94.5	-95.2	-163.7	171.8	-166.7	-1.4	115.4
341	P	30.9	Very low	25.2	Very low	113 Å²	113	132.4 Å²	132.4	73%	0.734	76%	0.76	S	S	*	*			trans	-80.3	-179.1	-172.3	41.6	-41.8	0	0	0	110.9
342	P	29	Very low	25.4	Very low	116 Å²	116	130.2 Å²	130.2	75%	0.753	75%	0.754	S	S	*	*			cis	-135.6	-161	38	27.3	2.2	0	0	0	113.4
343	V	24.7	Very low	25.6	Very low	134 Å²	134	129.2 Å²	129.2	81%	0.812	76%	0.757	S	S	*	*			cis	-147.4	161.1	24.2	-171.1	0	0	0	0	112.4
344	R	22.4	Very low	26	Very low	217 Å²	217	130.4 Å²	130.4	82%	0.819	76%	0.757	S	S	*	*			trans	-68.1	152.4	172.7	-54.3	162.9	172.3	164.8	-6.7	113.3
345	M	25.3	Very low	26.4	Very low	182 Å²	182	131.6 Å²	131.6	90%	0.897	76%	0.762	S	S	*	*				-164.6	128.5	119.7	-72.3	-146.8	175.6	0	0	106.2
346	T	22.5	Very low	26.9	Very low	111 Å²	111	136.1 Å²	136.1	68%	0.681	77%	0.769	S	S	*	*			cis	69.9	145.8	24.5	68	0	0	0	0	116.7
347	V	25.4	Very low	27.4	Very low	136 Å²	136	136.7 Å²	136.7	82%	0.824	77%	0.77	S	S	*	*			trans	82.9	130.7	-173.1	-175	0	0	0	0	113.1
348	S	27.2	Very low	28.1	Very low	97 Å²	97	136.9 Å²	136.9	68%	0.678	76%	0.763	S	S	*	*			cis	-168.5	140.1	-22.7	52.1	0	0	0	0	106.5
349	N	25.4	Very low	28.6	Very low	146 Å²	146	141.5 Å²	141.5	78%	0.781	76%	0.763	S	S	*	*				55.7	146.3	70.9	-157.5	63.1	0	0	0	114.4
350	P	33.4	Very low	28.8	Very low	85 Å²	85	147.4 Å²	147.4	55%	0.552	76%	0.763	S	S	*	*			cis	-122.3	-176.9	-40.9	37.5	-23	0	0	0	112.3
351	N	28.2	Very low	29.2	Very low	143 Å²	143	141.6 Å²	141.6	77%	0.765	75%	0.748	S	S	*	*				166.8	149.3	119.9	-95	-36.1	0	0	0	115.7
352	V	30.4	Very low	29.2	Very low	122 Å²	122	141.2 Å²	141.2	74%	0.739	75%	0.746	S	S	*	*			trans	46.2	130.5	148.6	-178.6	0	0	0	0	119	F354	V352-F354 HydrophobicContact CG1-CD2 4.13Å; V352-F354 HydrophobicContact CG1-CE2 4.02Å
353	G	28.1	Very low	29.3	Very low	60 Å²	60	142.6 Å²	142.6	62%	0.619	75%	0.745	S	S	*	*			cis	151.6	174	0.7	0	0	0	0	0	111.5
354	F	31.1	Very low	29.4	Very low	178 Å²	178	141 Å²	141	78%	0.781	75%	0.746	S	S	*	*			trans	65.4	143.4	175.3	-52.7	-92.2	0	0	0	115.4	V352	V352-F354 HydrophobicContact CG1-CD2 4.13Å; V352-F354 HydrophobicContact CG1-CE2 4.02Å
355	E	32.7	Very low	29.7	Very low	157 Å²	157	133.9 Å²	133.9	73%	0.734	74%	0.741	S	S	*	*			cis	-148.2	137.5	-15.2	-102.4	171	164.1	0	0	107.1
356	R	31.3	Very low	29.9	Very low	230 Å²	230	130.6 Å²	130.6	87%	0.868	74%	0.735	S	S	*	*				54.9	150.9	85.1	-88.3	-165.2	162	-172.1	-3.1	115.9
357	P	34.5	Very low	30.2	Very low	113 Å²	113	129.9 Å²	129.9	73%	0.734	74%	0.735	S	S	*	*			cis	-138.4	-164.7	-32.7	41	-21.8	0	0	0	112
358	P	37	Very low	30.3	Very low	102 Å²	102	133 Å²	133	66%	0.662	74%	0.74	S	S	*	*			trans	-117.1	176.7	-177	42.1	-32.4	0	0	0	115.7
359	F	31.8	Very low	30.4	Very low	208 Å²	208	132.1 Å²	132.1	91%	0.912	75%	0.747	S	S	*	*			trans	-106.4	130.5	157.9	-66.4	-92.7	0	0	0	107.9
360	R	30.6	Very low	30.6	Very low	196 Å²	196	133.4 Å²	133.4	74%	0.74	75%	0.752	S	S	*	*			cis	61.5	106.9	15.2	-74.5	-166.6	166.3	-148.4	-2.6	113.9
361	M	30.7	Very low	30.2	Very low	127 Å²	127	133.5 Å²	133.5	63%	0.626	76%	0.76	S	S	*	*				121	175.5	73.6	-95.4	173.9	70.8	0	0	106.9	I363	M361-I363 HydrophobicContact CE-CD1 4.06Å
362	P	31.1	Very low	30.3	Very low	105 Å²	105	132.1 Å²	132.1	68%	0.682	76%	0.759	S	S	*	*			cis	-113.6	168	-19.8	13.3	12.5	0	0	0	111.4
363	I	30.7	Very low	30.1	Very low	146 Å²	146	132.9 Å²	132.9	75%	0.749	76%	0.764	S	S	*	*				61.5	117.8	63.1	-42	165.8	0	0	0	115.2	M361	M361-I363 HydrophobicContact CE-CD1 4.06Å
364	A	27.9	Very low	30	Very low	99 Å²	99	134 Å²	134	82%	0.818	77%	0.767	S	S	*	*				152.9	144.1	123.8	0	0	0	0	0	115.1
365	G	28	Very low	29.8	Very low	69 Å²	69	131.6 Å²	131.6	71%	0.711	77%	0.767	S	S	*	*			trans	76	117.1	164.4	0	0	0	0	0	116
366	S	29.3	Very low	29.8	Very low	112 Å²	112	132.4 Å²	132.4	78%	0.783	77%	0.771	S	S	*	*			cis	90.5	147.1	34.9	82.5	0	0	0	0	115.4
367	S	28.8	Very low	29.6	Very low	97 Å²	97	130.7 Å²	130.7	68%	0.678	77%	0.77	S	S	*	*			trans	60.1	105.4	172.1	50	0	0	0	0	119.1
368	E	28.1	Very low	29.7	Very low	200 Å²	200	130.1 Å²	130.1	94%	0.935	77%	0.766	S	S	*	*				48.9	119.5	120.8	-60.9	170.2	163.7	0	0	119.9
369	G	28.5	Very low	29.4	Very low	80 Å²	80	130.7 Å²	130.7	83%	0.825	77%	0.769	S	S	*	*			trans	-171.3	85.1	177.9	0	0	0	0	0	115.7
370	I	30.7	Very low	29.1	Very low	172 Å²	172	129 Å²	129	88%	0.882	76%	0.762	S	S	*	*			trans	-38.1	135.7	171.3	-64.1	153.6	0	0	0	115
371	A	25.6	Very low	28.9	Very low	87 Å²	87	130.6 Å²	130.6	72%	0.719	77%	0.768	S	S	*	*			trans	-88.9	157	165.6	0	0	0	0	0	111.5
372	P	30	Very low	28.5	Very low	114 Å²	114	129.7 Å²	129.7	74%	0.74	77%	0.77	S	S	*	*				-156.3	156.7	96.7	40.3	-21.8	0	0	0	118.7
373	V	25.6	Very low	28.2	Very low	139 Å²	139	131.3 Å²	131.3	84%	0.842	78%	0.778	S	S	*	*			trans	33.4	127.3	132.4	-176.2	0	0	0	0	121.4
374	A	25.7	Very low	28.2	Very low	83 Å²	83	131.7 Å²	131.7	69%	0.686	78%	0.781	S	S	*	*				-169.4	130.5	127.6	0	0	0	0	0	114.7
375	T	28.2	Very low	28.2	Very low	127 Å²	127	132.4 Å²	132.4	78%	0.779	78%	0.777	S	S	*	*			trans	25.3	151.1	137.5	61.1	0	0	0	0	122.2
376	E	31.1	Very low	28	Very low	175 Å²	175	132.7 Å²	132.7	82%	0.818	77%	0.768	S	S	*	*			cis	-139.4	143.5	20.7	-73.5	-170.2	131.3	0	0	110.4
377	K	28.2	Very low	27.8	Very low	194 Å²	194	134.7 Å²	134.7	84%	0.843	77%	0.769	S	S	*	*				85.5	153.1	62.5	-89.4	-163.1	171.9	176.3	0	115.4
378	P	35.1	Very low	27.5	Very low	100 Å²	100	135.5 Å²	135.5	65%	0.649	78%	0.775	S	S	*	*			trans	-120.5	-163.5	-143.9	41.2	-24.5	0	0	0	113.7
379	P	31.5	Very low	27.3	Very low	114 Å²	114	130.7 Å²	130.7	74%	0.74	76%	0.763	S	S	*	*				-153.7	160	87.8	39.3	-19.6	0	0	0	119.2
380	F	25.5	Very low	27.1	Very low	172 Å²	172	133.8 Å²	133.8	75%	0.754	76%	0.76	S	S	*	*			trans	-2.6	141.6	146.2	-59.6	-103.1	0	0	0	121
381	R	25.9	Very low	26.8	Very low	231 Å²	231	131.4 Å²	131.4	87%	0.872	75%	0.748	S	S	*	*				-177.9	116	102.5	-91.7	173.7	-179	-163.9	-0.3	109.1
382	T	23.2	Very low	26.7	Very low	107 Å²	107	133.7 Å²	133.7	66%	0.656	74%	0.744	S	S	*	*				50.4	107.1	81	66.8	0	0	0	0	115.5
383	T	25.4	Very low	26.5	Very low	139 Å²	139	136.4 Å²	136.4	85%	0.853	74%	0.744	S	S	*	*				-169	129.5	120.3	26.2	0	0	0	0	110.5
384	L	29.1	Very low	26.5	Very low	154 Å²	154	135 Å²	135	81%	0.806	74%	0.738	S	S	*	*			trans	-76.8	149.4	151.4	-73.7	161.6	0	0	0	108.1
385	P	28.4	Very low	26.9	Very low	115 Å²	115	136.4 Å²	136.4	75%	0.747	74%	0.74	S	S	*	*				-115.6	131.9	105.3	32.5	-33	0	0	0	110
386	S	24	Very low	26.8	Very low	75 Å²	75	136.3 Å²	136.3	52%	0.524	74%	0.741	S	S	.	*			cis	70	133.5	25.9	99.2	0	0	0	0	115.9
387	L	24.1	Very low	26.6	Very low	153 Å²	153	136.5 Å²	136.5	80%	0.801	74%	0.74	S	S	*	*			trans	69.8	126.5	158.9	-64.8	169.2	0	0	0	118.4
388	S	22.9	Very low	26.3	Very low	114 Å²	114	133.2 Å²	133.2	80%	0.797	74%	0.736	S	S	*	*			trans	69.5	144.6	157.8	-53.8	0	0	0	0	116.5
389	S	25.2	Very low	25.8	Very low	99 Å²	99	135.1 Å²	135.1	69%	0.692	75%	0.746	S	S	*	*			cis	-134.7	121.4	10.4	58.5	0	0	0	0	109.4
390	L	23.4	Very low	25.5	Very low	146 Å²	146	133 Å²	133	76%	0.764	75%	0.745	S	S	*	*				78.1	150.9	94.7	-73.7	167.2	0	0	0	114.8
391	I	25	Very low	25.5	Very low	121 Å²	121	131.2 Å²	131.2	62%	0.621	74%	0.742	S	S	*	*			trans	71.7	99.2	148.8	-73.7	161.6	0	0	0	115.6
392	E	24.2	Very low	25.5	Very low	136 Å²	136	125.9 Å²	125.9	64%	0.636	74%	0.737	S	S	*	*				65.1	125.5	110.4	-60.1	166.5	-168.7	0	0	115
393	K	25.1	Very low	25.5	Very low	171 Å²	171	129.3 Å²	129.3	74%	0.743	74%	0.739	S	S	*	*				-171.7	169.5	62.9	-118.8	127	-174.2	162.9	0	111.2
394	P	25.4	Very low	25.4	Very low	110 Å²	110	128.2 Å²	128.2	71%	0.714	73%	0.732	S	S	*	*			trans	-79.4	172	-172.5	34.2	-35.9	0	0	0	113.9
395	P	33.2	Very low	25.2	Very low	112 Å²	112	126.9 Å²	126.9	73%	0.727	73%	0.726	S	S	*	*			trans	-79.1	152.8	-171.5	32.2	-37.2	0	0	0	113.8
396	P	27.5	Very low	25.1	Very low	124 Å²	124	128.2 Å²	128.2	81%	0.805	73%	0.726	S	S	*	*			trans	-83.6	113.2	161.2	32	-29.2	0	0	0	110.9
397	F	25.7	Very low	25.1	Very low	179 Å²	179	129 Å²	129	79%	0.785	74%	0.737	S	S	*	*			trans	-58.3	-178.9	146.1	-100	-94.8	0	0	0	110.6
398	T	23.3	Very low	25.2	Very low	126 Å²	126	127.4 Å²	127.4	77%	0.773	74%	0.736	S	S	*	*			trans	75.3	151.4	174.9	86.4	0	0	0	0	114.4
399	T	24.2	Very low	25.2	Very low	140 Å²	140	132.2 Å²	132.2	86%	0.859	74%	0.742	S	S	*	*			cis	-151.3	152.8	-12.7	8.6	0	0	0	0	108.5
400	G	24.7	Very low	25.2	Very low	69 Å²	69	131.1 Å²	131.1	71%	0.711	75%	0.746	S	S	*	*			trans	173.4	35.2	179.2	0	0	0	0	0	118.8	P402	G400-P402 WeakPolarHBondContact O-CD 2.98Å
401	I	25.4	Very low	25.2	Very low	135 Å²	135	129 Å²	129	69%	0.692	74%	0.744	S	S	*	*			trans	-94.5	123.9	177	-43.8	173.9	0	0	0	111.3	Y403	I401-Y403 HydrophobicContact CB-CD2 3.92Å; I401-Y403 HydrophobicContact CD1-CD2 4.34Å; I401-Y403 HydrophobicContact CD1-CE2 4.2Å; I401-Y403 HydrophobicContact CG2-CD2 3.35Å; I401-Y403 HydrophobicContact CG2-CE2 4.06Å; I401-Y403 HydrophobicContact CG2-CG 3.89Å
402	P	26.8	Very low	25.2	Very low	119 Å²	119	129.2 Å²	129.2	77%	0.773	75%	0.753	S	S	*	*			trans	-118.5	95.6	144.7	32.8	-21.4	0	0	0	107.6	G400	G400-P402 WeakPolarHBondContact O-CD 2.98Å
403	Y	22.7	Very low	25.2	Very low	178 Å²	178	130.3 Å²	130.3	70%	0.698	76%	0.763	S	S	*	*				52.8	112.6	53.6	-105	-51.6	0	0	0	113.7	I401	I401-Y403 HydrophobicContact CB-CD2 3.92Å; I401-Y403 HydrophobicContact CD1-CD2 4.34Å; I401-Y403 HydrophobicContact CD1-CE2 4.2Å; I401-Y403 HydrophobicContact CG2-CD2 3.35Å; I401-Y403 HydrophobicContact CG2-CE2 4.06Å; I401-Y403 HydrophobicContact CG2-CG 3.89Å
404	T	23.4	Very low	25.1	Very low	116 Å²	116	131.7 Å²	131.7	71%	0.712	77%	0.768	S	S	*	*			trans	69.2	149.9	172	79	0	0	0	0	114.4
405	N	25	Very low	25	Very low	126 Å²	126	135 Å²	135	67%	0.674	78%	0.776	S	S	*	*			cis	-141.7	152.5	26.3	-102.9	-58.1	0	0	0	115.4
406	I	26.6	Very low	24.4	Very low	143 Å²	143	134.5 Å²	134.5	73%	0.733	78%	0.782	S	S	*	*			trans	49.7	115.9	142.7	-59.7	159	0	0	0	118.7
407	A	24.1	Very low	24.1	Very low	93 Å²	93	135.5 Å²	135.5	77%	0.769	79%	0.785	S	S	*	*			trans	-86.5	124.1	162.2	0	0	0	0	0	111.8
408	P	24.9	Very low	23.9	Very low	119 Å²	119	132 Å²	132	77%	0.773	78%	0.783	S	S	*	*			trans	-80.1	135	165.6	29.9	-29.3	0	0	0	111.1	G410	P408-G410 PolarHBondContact O-N 3.41Å
409	K	24.4	Very low	24.1	Very low	215 Å²	215	135.8 Å²	135.8	94%	0.935	79%	0.789	S	S	*	*			trans	-77.1	110.3	177.2	-67.5	170.1	-176.9	166.1	0	110.9
410	G	23.5	Very low	24.3	Very low	75 Å²	75	135 Å²	135	77%	0.773	79%	0.786	S	S	*	*			trans	74.2	122.9	146.7	0	0	0	0	0	119.6	P408	P408-G410 PolarHBondContact O-N 3.41Å
411	S	24.6	Very low	24.3	Very low	102 Å²	102	138.8 Å²	138.8	71%	0.713	79%	0.791	S	S	*	*			trans	-160	155.7	131.7	58.5	0	0	0	0	110.2
412	P	24.7	Very low	24.3	Very low	126 Å²	126	138.7 Å²	138.7	82%	0.818	79%	0.79	S	S	*	*			trans	-104.4	77.2	-170.4	38.2	-32.4	0	0	0	113.2	K414	P412-K414 PolarHBondContact O-N 3.1Å
413	L	23.8	Very low	24.2	Very low	159 Å²	159	141 Å²	141	83%	0.832	79%	0.792	S	S	*	*			trans	-83.5	108.7	176.1	-74.4	174.9	0	0	0	112.5
414	K	22.2	Very low	24.3	Very low	199 Å²	199	137.5 Å²	137.5	87%	0.865	80%	0.8	S	S	*	*			trans	-69.8	131.9	156.8	-58.2	161.7	-174.8	156.9	0	107.7	P412	P412-K414 PolarHBondContact O-N 3.1Å
415	M	23.3	Very low	24.5	Very low	179 Å²	179	135.5 Å²	135.5	88%	0.882	80%	0.803	S	S	*	*			trans	-124.3	128.7	146.5	-71.9	-162.7	-72.7	0	0	108.3
416	A	20.6	Very low	24.6	Very low	102 Å²	102	140 Å²	140	84%	0.843	82%	0.816	S	S	*	*			trans	-110.8	130.6	166.9	0	0	0	0	0	106.1
417	V	22.8	Very low	24.6	Very low	145 Å²	145	138.9 Å²	138.9	88%	0.879	82%	0.821	S	S	*	*			trans	-120.5	130.5	169.4	-176.3	0	0	0	0	106.7
418	S	21.6	Very low	24.7	Very low	105 Å²	105	139.2 Å²	139.2	73%	0.734	82%	0.818	S	S	*	*			trans	-118.6	142	-177.9	48.8	0	0	0	0	109.8
419	F	27.6	Very low	24.8	Very low	206 Å²	206	140.9 Å²	140.9	90%	0.904	82%	0.82	S	S	*	*			trans	-52.8	147.7	176.4	-59	-94.1	0	0	0	113.5
420	P	26.6	Very low	24.9	Very low	123 Å²	123	136.5 Å²	136.5	80%	0.799	81%	0.811	S	S	*	*			trans	-91.2	135.3	139.6	31.3	-21.6	0	0	0	110.9
421	N	25.2	Very low	24.9	Very low	150 Å²	150	142 Å²	142	80%	0.802	81%	0.813	S	S	*	*			trans	-90.3	-176.1	158.1	-173.4	9.7	0	0	0	108.1
422	I	25.4	Very low	25.1	Very low	133 Å²	133	143.5 Å²	143.5	68%	0.682	82%	0.818	S	S	*	*			trans	132.6	136.5	151.2	-69.5	155.9	0	0	0	115.7
423	M	26.3	Very low	25.1	Very low	167 Å²	167	141.5 Å²	141.5	82%	0.823	81%	0.812	S	S	*	*			trans	60.6	125.5	-176.7	-49.3	-40.7	175.6	0	0	116.4
424	A	24.9	Very low	25.2	Very low	104 Å²	104	141 Å²	141	86%	0.86	81%	0.809	S	S	*	*			cis	85.6	118.2	19.7	0	0	0	0	0	116
425	G	26.2	Very low	25.5	Very low	74 Å²	74	137.7 Å²	137.7	76%	0.763	81%	0.808	S	S	*	*			trans	-152.6	16.2	-162.7	0	0	0	0	0	120.2
426	K	26.7	Very low	25.6	Very low	220 Å²	220	139 Å²	139	96%	0.957	80%	0.804	S	S	*	*			trans	63.7	136.4	165.2	-56.1	174.7	-177	173.2	0	119.7
427	S	27.9	Very low	26	Very low	121 Å²	121	140.5 Å²	140.5	85%	0.846	80%	0.803	S	S	*	*			trans	-97.5	147.8	165.9	55.2	0	0	0	0	112.6
428	S	26.4	Very low	26.2	Very low	100 Å²	100	140.3 Å²	140.3	70%	0.699	80%	0.797	S	S	*	*			trans	-146.4	132.5	159.4	62.1	0	0	0	0	108.6
429	L	25.4	Very low	26.6	Very low	154 Å²	154	140.6 Å²	140.6	81%	0.806	80%	0.8	S	S	*	*				50.9	126.1	102.5	-64.7	144.8	0	0	0	112.6
430	V	26.9	Very low	26.8	Very low	123 Å²	123	135.8 Å²	135.8	75%	0.745	79%	0.792	S	S	*	*			cis	-145.3	150.2	32.7	169.6	0	0	0	0	108.3
431	K	24.3	Very low	26.8	Very low	189 Å²	189	134.2 Å²	134.2	82%	0.822	79%	0.789	S	S	*	*			cis	92.5	55.8	21.2	-152.8	-161.8	175.8	-172.8	0	117.6
432	T	28.2	Very low	27.1	Very low	134 Å²	134	136.2 Å²	136.2	82%	0.822	79%	0.793	S	S	*	*			trans	-141.8	141.2	157.5	31.4	0	0	0	0	107.9
433	A	25.9	Very low	27.1	Very low	84 Å²	84	139.4 Å²	139.4	69%	0.694	80%	0.802	S	S	*	*			cis	116.4	83.1	12.1	0	0	0	0	0	113
434	I	25.8	Very low	27.5	Very low	150 Å²	150	136.8 Å²	136.8	77%	0.769	80%	0.797	S	S	*	*				36.8	120.2	128.5	-64	173.4	0	0	0	116.4	Y436	I434-Y436 HydrophobicContact CG2-CD2 4.42Å
435	P	28.5	Very low	27.7	Very low	128 Å²	128	138.2 Å²	138.2	83%	0.831	80%	0.798	S	S	*	*				-140.4	168	92.4	37.9	-23.2	0	0	0	118.2
436	Y	24.2	Very low	27.6	Very low	206 Å²	206	139 Å²	139	81%	0.808	80%	0.797	S	S	*	*			trans	-71.7	156.1	178.9	-74.2	-113.5	0	0	0	114.1	I434	I434-Y436 HydrophobicContact CG2-CD2 4.42Å
437	T	30.2	Very low	27.4	Very low	134 Å²	134	140 Å²	140	82%	0.822	80%	0.795	S	S	*	*			trans	167.9	156	132.9	29.4	0	0	0	0	109.7
438	N	27.3	Very low	27.3	Very low	141 Å²	141	142.5 Å²	142.5	75%	0.754	80%	0.795	S	S	*	*			cis	-157.2	174.1	-35.9	-137.6	-7.7	0	0	0	108.7
439	S	29.3	Very low	27.1	Very low	112 Å²	112	142.3 Å²	142.3	78%	0.783	80%	0.8	S	S	*	*			trans	63.4	147.1	173	57.4	0	0	0	0	117.8
440	S	30.6	Very low	27.1	Very low	105 Å²	105	143.9 Å²	143.9	73%	0.734	80%	0.801	S	S	*	*			cis	-162.9	145.1	-15.8	45.4	0	0	0	0	111.1
441	A	27.7	Very low	26.9	Very low	90 Å²	90	143.4 Å²	143.4	74%	0.744	80%	0.803	S	S	*	*			trans	56.4	143.7	158	0	0	0	0	0	119.2
442	E	30.3	Very low	26.9	Very low	192 Å²	192	139.7 Å²	139.7	90%	0.897	80%	0.799	S	S	*	*			cis	-152.3	-172.1	-9.2	-123.8	171.6	174.9	0	0	110.1
443	K	27	Very low	26.9	Very low	200 Å²	200	139.6 Å²	139.6	87%	0.87	80%	0.801	S	S	*	*			trans	-118	160.1	-172.3	-100	-176.4	176.4	173.5	0	114.4
444	P	34.9	Very low	26.9	Very low	111 Å²	111	140.7 Å²	140.7	72%	0.721	80%	0.804	S	S	*	*			trans	-93.2	177	-161.5	39.2	-39.8	0	0	0	114.2
445	P	27.5	Very low	27	Very low	134 Å²	134	138.3 Å²	138.3	87%	0.87	80%	0.801	S	S	*	*				-129.8	-166.3	129.3	38.6	-29.1	0	0	0	113
446	A	24.2	Very low	27	Very low	90 Å²	90	138.7 Å²	138.7	74%	0.744	80%	0.8	S	S	*	*			trans	-130.9	169.5	-163.8	0	0	0	0	0	114.1
447	R	24	Very low	27.1	Very low	241 Å²	241	133.6 Å²	133.6	91%	0.909	79%	0.791	S	S	*	*			trans	64	114.9	169.3	-66.5	175.5	162.9	179.3	-6.2	117.2
448	M	24.4	Very low	27.1	Very low	174 Å²	174	133.6 Å²	133.6	86%	0.857	79%	0.786	S	S	*	*				-138.9	156.2	124.8	-75.4	-155.9	176	0	0	109.6	F450	M448-F450 HydrophobicContact CB-CE2 4.41Å; M448-F450 HydrophobicContact SD-CE2 4.24Å
449	A	22.3	Very low	27.3	Very low	97 Å²	97	135.5 Å²	135.5	80%	0.802	79%	0.79	S	S	*	*			trans	-122.3	144.8	167.9	0	0	0	0	0	107.5
450	F	24.9	Very low	27.1	Very low	186 Å²	186	136.4 Å²	136.4	82%	0.816	79%	0.791	S	S	*	*			trans	-126.1	136.1	175.4	-90.4	-89.5	0	0	0	110.1	M448	M448-F450 HydrophobicContact CB-CE2 4.41Å; M448-F450 HydrophobicContact SD-CE2 4.24Å
451	S	23.8	Very low	27.3	Very low	114 Å²	114	136.7 Å²	136.7	80%	0.797	79%	0.79	S	S	*	*			trans	-115.3	148.8	173.4	-60.3	0	0	0	0	109.5
452	C	24.8	Very low	27.5	Very low	110 Å²	110	138.2 Å²	138.2	74%	0.743	79%	0.79	S	S	*	*			trans	-7.3	146.6	169.1	-45.2	0	0	0	0	120.5
453	P	28.4	Very low	27.4	Very low	132 Å²	132	136.5 Å²	136.5	86%	0.857	78%	0.782	S	S	*	*			trans	-84.4	162.4	138.7	35.6	-30.2	0	0	0	111.6
454	S	25.3	Very low	27.6	Very low	107 Å²	107	135.2 Å²	135.2	75%	0.748	78%	0.781	S	S	*	*			trans	-128.6	-161	-166.7	-55.6	0	0	0	0	112.4
455	S	27.5	Very low	27.3	Very low	101 Å²	101	133.9 Å²	133.9	71%	0.706	79%	0.788	S	S	*	*			trans	72.7	106.8	153.1	64.5	0	0	0	0	120.9
456	V	27.9	Very low	27.3	Very low	135 Å²	135	135.5 Å²	135.5	82%	0.818	79%	0.789	S	S	*	*				-147.4	114	116.2	-152.1	0	0	0	0	102.3
457	T	27.5	Very low	27.5	Very low	100 Å²	100	134.9 Å²	134.9	61%	0.613	78%	0.784	S	S	*	*				56.3	142.6	57.1	89.2	0	0	0	0	112.2
458	D	30.3	Very low	27.8	Very low	134 Å²	134	133.2 Å²	133.2	72%	0.717	78%	0.779	S	S	*	*			cis	-149	170.2	18.7	-109.9	-50.5	0	0	0	114.3
459	E	31	Very low	28.2	Very low	181 Å²	181	131.3 Å²	131.3	85%	0.846	77%	0.768	S	S	*	*			trans	63.4	149.9	154.1	-69.9	-176.5	174.4	0	0	124.3
460	T	24.7	Very low	28.7	Very low	130 Å²	130	133.8 Å²	133.8	80%	0.798	76%	0.763	S	S	*	*			trans	-150.3	-178.2	-177.9	57.9	0	0	0	0	107
461	P	34.4	Very low	28.8	Very low	112 Å²	112	129.5 Å²	129.5	73%	0.727	76%	0.756	S	S	*	*			cis	-120.2	-160.1	-37.7	37.1	-20.2	0	0	0	110.3
462	V	31.6	Very low	29.2	Very low	121 Å²	121	131.6 Å²	131.6	73%	0.733	76%	0.758	S	S	*	*				168.7	123.8	127.9	154.7	0	0	0	0	113.2
463	E	29.6	Very low	29.3	Very low	156 Å²	156	131 Å²	131	73%	0.729	76%	0.755	S	S	*	*			trans	28.9	153.2	147.6	-52.7	-169.5	118.4	0	0	127.5
464	M	29.6	Very low	29.5	Very low	173 Å²	173	132.5 Å²	132.5	85%	0.852	76%	0.755	S	S	*	*			trans	78.1	133.8	145.5	-85.9	178.7	-83.6	0	0	121.8
465	G	30.3	Very low	29.7	Very low	84 Å²	84	136.4 Å²	136.4	87%	0.866	76%	0.759	S	S	*	*			trans	148.1	88.9	168	0	0	0	0	0	114
466	D	27.8	Very low	29.8	Very low	168 Å²	168	137.3 Å²	137.3	90%	0.898	76%	0.762	S	S	*	*			trans	-104	162.1	-176.4	-121.5	-38.7	0	0	0	113.9
467	A	27	Very low	30.1	Very low	76 Å²	76	137 Å²	137	63%	0.628	76%	0.764	S	S	*	*			trans	77.2	165.2	156.9	0	0	0	0	0	122.1
468	Y	31.4	Very low	30	Very low	207 Å²	207	138.7 Å²	138.7	81%	0.812	77%	0.773	S	S	*	*			trans	67	146.6	179.1	-69.5	-97.1	0	0	0	118
469	Q	32.5	Very low	30.1	Very low	134 Å²	134	141.7 Å²	141.7	63%	0.626	78%	0.78	S	S	*	*			cis	-170.4	161	-41.8	-124.8	178.3	0	0	0	107.8
470	Q	31.3	Very low	30	Very low	149 Å²	149	142.1 Å²	142.1	70%	0.696	78%	0.779	S	S	*	*			trans	33.9	107.1	148.1	-76.1	159.1	-27.9	0	0	119.3
471	S	28.8	Very low	30.2	Very low	96 Å²	96	145.9 Å²	145.9	67%	0.671	79%	0.785	S	S	*	*				88.7	157.7	74.7	72.9	0	0	0	0	115
472	L	30.9	Very low	29.8	Very low	158 Å²	158	146.8 Å²	146.8	83%	0.827	79%	0.788	S	S	*	*			trans	73.3	113.8	-176.2	-50.1	167.7	0	0	0	112.2
473	S	27.8	Very low	29.9	Very low	98 Å²	98	146.1 Å²	146.1	69%	0.685	79%	0.786	S	S	*	*			cis	80.5	100.6	48.7	79.5	0	0	0	0	114.5
474	D	31.5	Very low	29.7	Very low	162 Å²	162	150.1 Å²	150.1	87%	0.866	80%	0.797	S	S	*	*			trans	-162.1	176.4	133.8	-126.1	-39.8	0	0	0	114.3
475	K	31.1	Very low	29.6	Very low	189 Å²	189	150 Å²	150	82%	0.822	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-92.7	158.6	-169.6	-72.6	174	-178.2	170	0	115.2
476	P	29.4	Very low	29.6	Very low	120 Å²	120	153 Å²	153	78%	0.779	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-91.5	157.9	-172.3	36.4	-37.2	0	0	0	115.1
477	P	33.6	Very low	29.6	Very low	130 Å²	130	148.2 Å²	148.2	84%	0.844	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-102.6	154.6	166.8	37.5	-31.4	0	0	0	113.7
478	V	25.5	Very low	29.7	Very low	134 Å²	134	154.2 Å²	154.2	81%	0.812	80%	0.8	S	S	*	*			trans	-114.6	136.6	176.8	172.5	0	0	0	0	110.4
479	K	33.2	Very low	29.7	Very low	198 Å²	198	149.5 Å²	149.5	86%	0.861	79%	0.789	S	S	*	*			trans	-174.8	119.5	145.9	-102.6	149	-170.5	177.6	0	116
480	K	27.9	Very low	29.5	Very low	189 Å²	189	153.1 Å²	153.1	82%	0.822	80%	0.797	S	S	*	*			trans	13.1	136	140.6	-52.1	179.1	179.6	-175.3	0	120.6
481	F	29.7	Very low	29.3	Very low	209 Å²	209	155.6 Å²	155.6	92%	0.917	81%	0.805	S	S	*	*				-154.6	155.8	129.6	-108.1	-75.2	0	0	0	111
482	T	25.9	Very low	29.2	Very low	131 Å²	131	156.2 Å²	156.2	80%	0.804	81%	0.81	S	S	*	*			trans	-143.6	-166	-177.9	56.7	0	0	0	0	110.8
483	P	33.1	Very low	29	Very low	107 Å²	107	155.9 Å²	155.9	70%	0.695	81%	0.808	S	S	*	*				-118.3	174.1	-105.1	39.3	-22.2	0	0	0	115.1
484	Y	26.3	Very low	28.8	Very low	241 Å²	241	158.1 Å²	158.1	95%	0.945	82%	0.818	S	S	*	*			trans	-147.9	168.1	163.6	-104.3	-78.3	0	0	0	113.6
485	M	25.9	Very low	28.5	Very low	170 Å²	170	156.2 Å²	156.2	84%	0.837	81%	0.812	S	S	*	*			trans	-125.9	-177.5	-164.7	-65.4	-167.8	85.8	0	0	114.9
486	T	30.9	Very low	28.2	Very low	148 Å²	148	155.1 Å²	155.1	91%	0.908	81%	0.812	S	S	*	*			trans	93.2	140.7	162.6	73.8	0	0	0	0	117.2
487	G	28.6	Very low	28	Very low	67 Å²	67	153 Å²	153	69%	0.691	81%	0.813	S	S	*	*			cis	163.6	163.1	-14.4	0	0	0	0	0	115.2
488	K	29.5	Very low	27.7	Very low	201 Å²	201	153.7 Å²	153.7	87%	0.874	81%	0.808	S	S	*	*			trans	71.1	156	167.3	-61.9	-179.2	175.7	176.9	0	117.7
489	D	29.7	Very low	28	Very low	109 Å²	109	151.8 Å²	151.8	58%	0.583	80%	0.798	S	S	*	*			cis	-158.3	149.4	-13.1	-119.7	-54.4	0	0	0	112.1
490	R	28.2	Very low	27.7	Very low	210 Å²	210	151.7 Å²	151.7	79%	0.792	79%	0.794	S	S	*	*			trans	50.4	123.8	146.4	-70.5	158	-166.6	-138.7	-5.4	126
491	K	27.7	Very low	27.8	Very low	200 Å²	200	147.6 Å²	147.6	87%	0.87	79%	0.789	S	S	*	*				48.8	150.3	113.7	-66.6	-171.8	179.9	-171	0	120.9
492	S	26.9	Very low	27.7	Very low	110 Å²	110	144.7 Å²	144.7	77%	0.769	78%	0.778	S	S	*	*			cis	-165.4	169.9	11.8	33.1	0	0	0	0	114
493	N	25.8	Very low	27.9	Very low	150 Å²	150	142.2 Å²	142.2	80%	0.802	78%	0.779	S	S	*	*			trans	-57	167.4	175.5	-41.9	1.4	0	0	0	116.5
494	V	24.4	Very low	27.6	Very low	146 Å²	146	145.1 Å²	145.1	89%	0.885	78%	0.78	S	S	*	*				-159.2	149.4	127.1	131.3	0	0	0	0	112.1
495	T	26	Very low	27.8	Very low	121 Å²	121	144.2 Å²	144.2	74%	0.742	78%	0.777	S	S	*	*			trans	-104.8	165.4	-178.8	-35.6	0	0	0	0	111
496	M	24.8	Very low	27.8	Very low	166 Å²	166	145 Å²	145	82%	0.818	78%	0.776	S	S	*	*			trans	176.2	144.1	131.2	-95	-66.5	-90.8	0	0	112	L498	M496-L498 HydrophobicContact CE-CD1 4.48Å
497	G	25.7	Very low	27.7	Very low	77 Å²	77	148.9 Å²	148.9	79%	0.794	77%	0.773	S	S	*	*			trans	176.2	42.6	-175.2	0	0	0	0	0	117.3
498	L	26.3	Very low	27.7	Very low	144 Å²	144	151.5 Å²	151.5	75%	0.754	78%	0.776	S	S	*	*			trans	-74	179.9	168.2	-76.5	165.8	0	0	0	110.8	M496	M496-L498 HydrophobicContact CE-CD1 4.48Å
499	P	32	Very low	27.5	Very low	93 Å²	93	145.8 Å²	145.8	60%	0.604	77%	0.766	S	S	*	*			cis	-145.2	-170.2	14.2	25.4	3.4	0	0	0	117.5
500	Y	25.9	Very low	27.3	Very low	197 Å²	197	147.1 Å²	147.1	77%	0.773	78%	0.778	S	S	*	*			trans	75.9	150.6	154.8	-71.7	-56.5	0	0	0	120.4
501	S	30.2	Very low	27.4	Very low	102 Å²	102	141.6 Å²	141.6	71%	0.713	77%	0.769	S	S	*	*			cis	-147.1	135.2	-2.1	46.8	0	0	0	0	116
502	H	27.6	Very low	27.2	Very low	149 Å²	149	142.4 Å²	142.4	69%	0.69	77%	0.769	S	S	*	*			trans	-0.1	141.8	149.3	-59.5	-59.3	0	0	0	123.1
503	G	30	Very low	27.1	Very low	79 Å²	79	142.9 Å²	142.9	81%	0.814	77%	0.766	S	S	*	*			trans	-164.5	35.2	168.7	0	0	0	0	0	118
504	K	28.3	Very low	27.1	Very low	167 Å²	167	141.7 Å²	141.7	73%	0.726	76%	0.764	S	S	*	*			trans	-14.7	131.3	156.9	-64.2	163.7	176.7	170.7	0	118.2
505	Y	29.2	Very low	27.2	Very low	223 Å²	223	139 Å²	139	88%	0.875	75%	0.752	S	S	*	*				-176.9	123.6	124.7	-92.8	-70.4	0	0	0	107.3
506	K	27.2	Very low	27.1	Very low	187 Å²	187	141.1 Å²	141.1	81%	0.813	76%	0.755	S	S	*	*			cis	94.1	132.1	24.2	-140.1	-170.2	-161.5	-169	0	114.2
507	R	27.9	Very low	27.2	Very low	228 Å²	228	140.7 Å²	140.7	86%	0.86	76%	0.755	S	S	*	*			trans	85.6	142.5	-177.7	-59.2	179.5	172.7	163.7	-3.1	114.7
508	T	28.3	Very low	27.1	Very low	123 Å²	123	147.4 Å²	147.4	76%	0.755	76%	0.756	S	S	*	*			cis	-155.7	134.8	-10	12.3	0	0	0	0	107.6
509	A	24.8	Very low	27.1	Very low	80 Å²	80	149.9 Å²	149.9	66%	0.661	76%	0.761	S	S	*	*				66.7	111.5	82.9	0	0	0	0	0	113.1
510	V	25.6	Very low	26.7	Very low	138 Å²	138	150.5 Å²	150.5	84%	0.836	77%	0.774	S	S	*	*				89.4	143.3	74.2	148.3	0	0	0	0	112.2
511	P	30.3	Very low	26.7	Very low	93 Å²	93	144.6 Å²	144.6	60%	0.604	77%	0.773	S	S	*	*			cis	-146.5	-163.6	-25.3	43.8	-24	0	0	0	114.9
512	Y	24.3	Very low	26.4	Very low	218 Å²	218	149.3 Å²	149.3	86%	0.855	78%	0.781	S	S	*	*			trans	64.1	-177.2	155.4	-81.4	-151.4	0	0	0	115
513	V	25.5	Very low	26.4	Very low	119 Å²	119	153.1 Å²	153.1	72%	0.721	79%	0.789	S	S	*	*			cis	-154.5	123.4	27.7	166.9	0	0	0	0	111.3
514	V	25.6	Very low	26.4	Very low	125 Å²	125	155.7 Å²	155.7	76%	0.758	79%	0.789	S	S	*	*			trans	52.9	155.1	137.2	-177.8	0	0	0	0	119.1
515	S	25.5	Very low	26.3	Very low	90 Å²	90	153.9 Å²	153.9	63%	0.629	80%	0.795	S	S	*	*			cis	-142.1	155.3	5.3	25.2	0	0	0	0	110
516	M	23.8	Very low	26.1	Very low	165 Å²	165	147.2 Å²	147.2	81%	0.813	79%	0.793	S	S	*	*				32.8	130.8	96.4	-40.2	-167.2	-163.9	0	0	114.8
517	I	27.3	Very low	26.2	Very low	158 Å²	158	143.1 Å²	143.1	81%	0.81	79%	0.794	S	S	*	*				-160.9	127.2	69.8	-76.7	148.1	0	0	0	106.7
518	R	24.1	Very low	26.1	Very low	217 Å²	217	143 Å²	143	82%	0.819	80%	0.796	S	S	*	*				66.1	105.5	58.8	-101.4	-173.8	177.6	-178.2	0.8	117.1
519	K	25.8	Very low	26.4	Very low	197 Å²	197	142.5 Å²	142.5	86%	0.857	79%	0.794	S	S	*	*			trans	86.5	128.2	155.5	-57.5	-179.5	173.7	-177.2	0	120.9
520	A	24.6	Very low	26.5	Very low	106 Å²	106	142.7 Å²	142.7	88%	0.876	80%	0.796	S	S	*	*			trans	73	155.1	140.9	0	0	0	0	0	121.5
521	G	26	Very low	26.7	Very low	72 Å²	72	142.7 Å²	142.7	74%	0.742	79%	0.791	S	S	*	*			trans	90.7	90.4	-179.5	0	0	0	0	0	113.2
522	F	23.6	Very low	26.7	Very low	202 Å²	202	146.3 Å²	146.3	89%	0.886	80%	0.798	S	S	*	*				70	126.5	52.5	-118	-68.3	0	0	0	115.2
523	R	26.7	Very low	27	Very low	229 Å²	229	143.4 Å²	143.4	86%	0.864	80%	0.797	S	S	*	*			trans	87.7	99.4	166.2	-55.9	-169.6	178.3	-167.3	-1.6	120.6
524	T	29.3	Very low	27.2	Very low	133 Å²	133	141.3 Å²	141.3	82%	0.816	80%	0.8	S	S	*	*			trans	-58.6	159.7	132.2	37.2	0	0	0	0	110.8
525	P	28	Very low	27.2	Very low	129 Å²	129	145.7 Å²	145.7	84%	0.838	81%	0.808	S	S	*	*				-157.7	169	62.6	42.8	-21.3	0	0	0	120.5
526	G	25	Very low	27.4	Very low	82 Å²	82	147.2 Å²	147.2	85%	0.845	82%	0.819	S	S	*	*			trans	82.7	154.5	156.7	0	0	0	0	0	117.4
527	A	28.4	Very low	27.6	Very low	101 Å²	101	144.1 Å²	144.1	84%	0.835	82%	0.819	S	S	*	*			cis	-155	168.3	-9.7	0	0	0	0	0	112.4
528	Y	25.3	Very low	27.5	Very low	226 Å²	226	145.4 Å²	145.4	89%	0.886	82%	0.82	S	S	*	*			trans	-66.6	177.1	178.4	-79.2	-81.1	0	0	0	115.4
529	P	34.4	Very low	27.7	Very low	112 Å²	112	141.9 Å²	141.9	73%	0.727	81%	0.812	S	S	*	*			cis	-139.6	171.8	-16.1	29.5	-7	0	0	0	117.5
530	A	27.3	Very low	27.8	Very low	84 Å²	84	137.1 Å²	137.1	69%	0.694	80%	0.804	S	S	*	*			trans	53	114.3	139	0	0	0	0	0	123.9
531	N	30.8	Very low	27.8	Very low	138 Å²	138	136.3 Å²	136.3	74%	0.738	80%	0.797	S	S	*	*				-164.1	123.9	112.8	-99.5	-54.9	0	0	0	108.2
532	K	29.8	Very low	27.7	Very low	170 Å²	170	140.3 Å²	140.3	74%	0.739	80%	0.8	S	S	*	*				76.5	125.5	92.3	-83.9	-167.7	-171.8	174.8	0	115.9
533	D	29.5	Very low	28	Very low	156 Å²	156	137 Å²	137	83%	0.834	79%	0.791	S	S	*	*			trans	64.7	139.8	155.8	-53.5	-45.1	0	0	0	118.6
534	G	29.6	Very low	28	Very low	76 Å²	76	136.3 Å²	136.3	78%	0.784	79%	0.789	S	S	*	*			trans	126.5	81.4	-177.2	0	0	0	0	0	113.7
535	K	27.2	Very low	27.9	Very low	217 Å²	217	137.5 Å²	137.5	94%	0.943	79%	0.79	S	S	*	*			trans	-86	123.9	167.3	-69.5	179.1	-179.4	175.3	0	109.4
536	S	28.5	Very low	27.8	Very low	121 Å²	121	139.2 Å²	139.2	85%	0.846	79%	0.791	S	S	*	*			trans	-136.4	174.7	170.4	55.2	0	0	0	0	111.3
537	A	27.7	Very low	28	Very low	100 Å²	100	139.5 Å²	139.5	83%	0.826	79%	0.785	S	S	*	*			trans	-43.5	145.7	-164.9	0	0	0	0	0	117.8
538	F	25.7	Very low	27.8	Very low	186 Å²	186	144.3 Å²	144.3	82%	0.816	78%	0.783	S	S	*	*			trans	-87.5	151.4	150.8	-159.9	-90.2	0	0	0	108.1
539	E	29.3	Very low	27.8	Very low	142 Å²	142	139.1 Å²	139.1	66%	0.664	78%	0.78	S	S	*	*			trans	-60.6	145.6	-173.3	-60	106.1	133.8	0	0	113.1
540	S	26.7	Very low	27.6	Very low	98 Å²	98	139.1 Å²	139.1	69%	0.685	78%	0.782	S	S	*	*			cis	80.8	122.8	24.1	85.8	0	0	0	0	116.5
541	A	26	Very low	27.6	Very low	89 Å²	89	139.9 Å²	139.9	74%	0.736	78%	0.783	S	S	*	*			trans	62.4	136	-178.4	0	0	0	0	0	114.8
542	I	23.7	Very low	27.6	Very low	155 Å²	155	142.2 Å²	142.2	80%	0.795	79%	0.789	S	S	*	*			cis	59.9	86	6.7	-43.2	179.5	0	0	0	115.2
543	D	28.5	Very low	27.6	Very low	132 Å²	132	143.7 Å²	143.7	71%	0.706	80%	0.799	S	S	*	*				-145.6	130.6	128.2	-92.6	-43	0	0	0	106.2
544	R	27.3	Very low	27.5	Very low	216 Å²	216	139.6 Å²	139.6	82%	0.815	79%	0.794	S	S	*	*				60	109.6	74.7	-72.5	-177.9	160.8	169.2	-5.7	112.7
545	D	27	Very low	27.5	Very low	158 Å²	158	143.9 Å²	143.9	85%	0.845	80%	0.798	S	S	*	*				-162	168.6	110.5	-120.8	-23.3	0	0	0	114.1
546	I	26.8	Very low	27.5	Very low	164 Å²	164	138.5 Å²	138.5	84%	0.841	79%	0.787	S	S	*	*			trans	107.7	99	-177.8	-61.8	167.2	0	0	0	112.1
547	A	27.6	Very low	27.3	Very low	89 Å²	89	137.1 Å²	137.1	74%	0.736	78%	0.783	S	S	*	*			trans	-84.4	150.4	176.6	0	0	0	0	0	112.3
548	Y	26.1	Very low	27.3	Very low	201 Å²	201	138.1 Å²	138.1	79%	0.788	78%	0.779	S	S	*	*			trans	-90.4	117.4	159.4	-109.9	-93.1	0	0	0	108.9
549	S	23.8	Very low	27.3	Very low	118 Å²	118	137.5 Å²	137.5	83%	0.825	78%	0.778	S	S	*	*			trans	-91.6	115.1	165.4	56.1	0	0	0	0	109.3
550	S	31.2	Very low	27.3	Very low	111 Å²	111	136.7 Å²	136.7	78%	0.776	78%	0.784	S	S	*	*			trans	-99.2	135	164.2	56	0	0	0	0	110
551	S	26.1	Very low	27.3	Very low	101 Å²	101	136.5 Å²	136.5	71%	0.706	78%	0.782	S	S	*	*			trans	-60.5	169.4	155.6	50.4	0	0	0	0	109.6
552	E	32.6	Very low	27.3	Very low	186 Å²	186	141.9 Å²	141.9	87%	0.869	79%	0.789	S	S	*	*			cis	-143.1	-173.2	37.3	-68.4	-179.1	141.7	0	0	114.2
553	Q	29	Very low	27.8	Very low	202 Å²	202	139.4 Å²	139.4	94%	0.944	78%	0.783	S	S	*	*			trans	-93	151.8	-171.9	-58.2	160.3	-17.2	0	0	111.3
554	G	26.7	Very low	27.6	Very low	70 Å²	70	143.6 Å²	143.6	72%	0.722	79%	0.79	S	S	*	*			trans	160	107.1	160.9	0	0	0	0	0	118.1
555	L	29.2	Very low	27.7	Very low	166 Å²	166	138.1 Å²	138.1	87%	0.869	79%	0.786	S	S	*	*			trans	59.7	85.8	143.3	-53.1	-179.7	0	0	0	120.5
556	S	27.1	Very low	27.8	Very low	104 Å²	104	133.2 Å²	133.2	73%	0.727	77%	0.772	S	S	*	*				52.1	107.6	122	62.8	0	0	0	0	123
557	A	24.8	Very low	28	Very low	92 Å²	92	131 Å²	131	76%	0.76	77%	0.771	S	S	*	*				80.7	158	117.4	0	0	0	0	0	122.6
558	V	28.1	Very low	27.9	Very low	121 Å²	121	133.5 Å²	133.5	73%	0.733	77%	0.772	S	S	*	*			trans	72.7	101.4	172.3	-166.5	0	0	0	0	113.9
559	E	26	Very low	27.9	Very low	172 Å²	172	129.8 Å²	129.8	80%	0.804	77%	0.766	S	S	*	*				51.9	125.8	97.3	-53.8	176.1	155.9	0	0	113
560	T	28.9	Very low	28.1	Very low	126 Å²	126	131.4 Å²	131.4	77%	0.773	76%	0.761	S	S	*	*			cis	-162.6	132	49.1	31.6	0	0	0	0	109.2
561	S	26.3	Very low	27.8	Very low	93 Å²	93	134.8 Å²	134.8	65%	0.65	76%	0.764	S	S	*	*				73.2	99	78.1	81.5	0	0	0	0	118.7
562	F	26	Very low	27.8	Very low	203 Å²	203	135.4 Å²	135.4	89%	0.89	77%	0.768	S	S	*	*			trans	62.3	-175	143.6	-76.6	-76.8	0	0	0	118.6
563	P	33.9	Very low	27.3	Very low	102 Å²	102	131.6 Å²	131.6	66%	0.662	77%	0.769	S	S	*	*			cis	-131.8	172.1	-10.3	16.1	9.8	0	0	0	117.6
564	Y	25.8	Very low	27.1	Very low	220 Å²	220	126.6 Å²	126.6	86%	0.863	76%	0.762	S	S	*	*			trans	67.5	152.9	148.5	-87.2	-137.2	0	0	0	118.7
565	S	29.4	Very low	26.9	Very low	102 Å²	102	130.4 Å²	130.4	71%	0.713	77%	0.766	S	S	*	*			cis	-153.7	171.1	0.1	-135.8	0	0	0	0	108.9
566	G	28.1	Very low	26.8	Very low	54 Å²	54	130.1 Å²	130.1	56%	0.557	76%	0.763	S	S	*	*			cis	145	150.4	-3.5	0	0	0	0	0	112.2
567	S	30.5	Very low	26.6	Very low	118 Å²	118	128 Å²	128	83%	0.825	76%	0.758	S	S	*	*			trans	63.1	159.2	-179.1	65	0	0	0	0	117.7
568	N	26.9	Very low	26.6	Very low	141 Å²	141	130.1 Å²	130.1	75%	0.754	76%	0.761	S	S	*	*			cis	171.8	153.4	-41.7	-96.1	8.8	0	0	0	106
569	N	26.5	Very low	26.3	Very low	124 Å²	124	129.5 Å²	129.5	66%	0.663	76%	0.762	S	S	*	*			trans	63.6	164.1	164	-66.6	27.4	0	0	0	115.7
570	E	27	Very low	26.2	Very low	152 Å²	152	132.2 Å²	132.2	71%	0.71	77%	0.767	S	S	*	*			cis	-154.3	144.8	-19.4	-115.7	156.5	165.5	0	0	109.9
571	E	24.1	Very low	26.1	Very low	182 Å²	182	135.3 Å²	135.3	85%	0.85	77%	0.772	S	S	*	*			trans	54.1	-169.1	139.3	-143	166.7	-157.3	0	0	121
572	S	26.1	Very low	26.1	Very low	114 Å²	114	138.7 Å²	138.7	80%	0.797	78%	0.783	S	S	*	*			trans	68.3	93.7	175	-64	0	0	0	0	118.4
573	A	22.1	Very low	26.1	Very low	106 Å²	106	132.7 Å²	132.7	88%	0.876	78%	0.778	S	S	*	*			trans	-61.9	160.9	163.4	0	0	0	0	0	113.7
574	A	25.3	Very low	25.7	Very low	97 Å²	97	137 Å²	137	80%	0.802	79%	0.787	S	S	*	*			trans	-141.5	132.7	152.6	0	0	0	0	0	110.6
575	D	23	Very low	25.7	Very low	149 Å²	149	135.6 Å²	135.6	80%	0.797	79%	0.785	S	S	*	*			trans	-48.8	161.1	166.2	-77.6	-75.2	0	0	0	112.8
576	I	27.3	Very low	25.6	Very low	160 Å²	160	140.1 Å²	140.1	82%	0.821	79%	0.792	S	S	*	*				-149.1	136.5	52.1	-65.7	142.4	0	0	0	107
577	G	22.8	Very low	25.5	Very low	59 Å²	59	146.9 Å²	146.9	61%	0.608	81%	0.806	S	S	*	*				83.5	148.1	57.9	0	0	0	0	0	110.7
578	V	23.7	Very low	25.3	Very low	137 Å²	137	147.1 Å²	147.1	83%	0.83	81%	0.805	S	S	*	*			cis	-160	141.8	-3.2	160.8	0	0	0	0	105
579	S	23.5	Very low	25.2	Very low	109 Å²	109	146 Å²	146	76%	0.762	80%	0.804	S	S	*	*			cis	-163.9	178.4	-16.2	-90.4	0	0	0	0	108.9
580	Y	22.7	Very low	25.3	Very low	229 Å²	229	147 Å²	147	90%	0.898	81%	0.814	S	S	*	*			trans	-73.4	142.7	171.3	-80.1	-104.4	0	0	0	112.7
581	E	28.1	Very low	25.3	Very low	191 Å²	191	148.5 Å²	148.5	89%	0.893	82%	0.818	S	S	*	*			trans	-144.6	139.6	153.9	-85	-139.6	125.7	0	0	113.4	G583	E581-G583 PolarHBondContact O-N 2.86Å
582	N	25	Very low	25.3	Very low	163 Å²	163	144.7 Å²	144.7	87%	0.872	81%	0.811	S	S	*	*			trans	-89	70.2	179.4	-88.8	-65.4	0	0	0	112.3	K584	N582-K584 PolarHBondContact O-N 3.44Å
583	G	26.5	Very low	25.4	Very low	77 Å²	77	145.6 Å²	145.6	79%	0.794	82%	0.815	S	S	*	*			trans	-72.8	105.1	-178.3	0	0	0	0	0	115	E581	E581-G583 PolarHBondContact O-N 2.86Å
584	K	25.1	Very low	25.5	Very low	192 Å²	192	146.5 Å²	146.5	84%	0.835	81%	0.809	S	S	*	*			trans	-77.3	142.4	171.7	-72.2	176.1	179.4	166.2	0	112.3	N582	N582-K584 PolarHBondContact O-N 3.44Å
585	K	26	Very low	25.5	Very low	192 Å²	192	145.4 Å²	145.4	84%	0.835	80%	0.799	S	S	*	*			trans	85	151	160.1	-60	166.8	177.3	172.8	0	118.9
586	K	27.1	Very low	25.8	Very low	196 Å²	196	144.9 Å²	144.9	85%	0.852	80%	0.797	S	S	*	*			trans	68.4	109.2	161	-70.8	175.7	178.8	-178.1	0	118.9
587	K	26.3	Very low	25.8	Very low	196 Å²	196	145.5 Å²	145.5	85%	0.852	79%	0.794	S	S	*	*			trans	-64	149	155.2	-58.3	172.8	179.1	175.2	0	110.7
588	P	26.7	Very low	26.4	Very low	124 Å²	124	146.7 Å²	146.7	81%	0.805	79%	0.792	S	S	*	*			trans	-107.1	156.4	135.4	33.2	-28.5	0	0	0	111.1
589	T	23.9	Very low	26.9	Very low	118 Å²	118	147.2 Å²	147.2	72%	0.724	78%	0.784	S	S	*	*			trans	-106.3	124.7	-172.1	-55.4	0	0	0	0	111.3
590	V	29.5	Very low	27.4	Very low	145 Å²	145	146.6 Å²	146.6	88%	0.879	77%	0.772	S	S	*	*			trans	-113.1	144.5	165.3	-176	0	0	0	0	108.9
591	K	26.3	Very low	28	Very low	183 Å²	183	141.1 Å²	141.1	80%	0.796	75%	0.752	S	S	*	*			trans	-111.2	148.6	-163.9	-64.1	174.7	179.6	172.6	0	113.1
592	S	25.5	Very low	28.3	Very low	102 Å²	102	137.5 Å²	137.5	71%	0.713	74%	0.738	S	S	*	*			trans	67.7	162.5	162.9	-90.2	0	0	0	0	117.6
593	P	26.6	Very low	28.6	Very low	133 Å²	133	131.9 Å²	131.9	86%	0.864	71%	0.711	S	S	*	*			cis	-83.2	154.2	-2.1	33.8	-34.6	0	0	0	114.2
594	V	25.1	Very low	29.2	Very low	125 Å²	125	132.8 Å²	132.8	76%	0.758	70%	0.697	S	S	*	*			trans	-107.8	127.7	-175.1	171.1	0	0	0	0	111.7
595	A	25.4	Very low	30	Very low	73 Å²	73	129.6 Å²	129.6	60%	0.603	68%	0.683	S	S	*	*			trans	47.4	125.6	155.8	0	0	0	0	0	120.4
596	N	28.2	Very low	30.5	Very low	139 Å²	139	127.2 Å²	127.2	74%	0.743	67%	0.669	S	S	*	*				-136.9	90	119.8	-134.7	-29.7	0	0	0	111	S598	N596-S598 PolarHBondContact O-N 3.12Å
597	K	28.6	Very low	31	Very low	173 Å²	173	121.5 Å²	121.5	75%	0.752	65%	0.647	S	S	*	*			trans	-80	83.5	-178.6	-74.4	-175.3	177.3	177.6	0	110.1	K599	K597-K599 VanDerWaalsContact C-N 3.28Å; K597-K599 PolarHBondContact O-N 3.19Å
598	S	34.3	Very low	31.3	Very low	83 Å²	83	117.8 Å²	117.8	58%	0.58	64%	0.643	S	S	*	*			trans	-63.5	81	173.3	46.2	0	0	0	0	111.7	N596 N600	N596-S598 PolarHBondContact O-N 3.12Å; S598-N600 PolarHBondContact O-N 3.33Å
599	K	34.8	Very low	31.8	Very low	149 Å²	149	116.3 Å²	116.3	65%	0.648	65%	0.651	S	S	*	*			trans	-73.5	73.4	179.5	-72.6	176.7	-178.2	172.6	0	110.8	K597 K601 S621	K597-K599 VanDerWaalsContact C-N 3.28Å; K597-K599 PolarHBondContact O-N 3.19Å; K599-K601 PolarHBondContact O-N 2.92Å; K599-S621 PolarHBondContact N-OG 3.09Å; K599-S621 PolarHBondContact O-OG 2.94Å
600	N	34.2	Very low	32.6	Very low	96 Å²	96	112.2 Å²	112.2	51%	0.513	63%	0.627	S	S	.	*			trans	-60.5	115.8	168	-69	-18.7	0	0	0	109.2	S598 E619 I620 S621	S598-N600 PolarHBondContact O-N 3.33Å; N600-E619 CarbonylContact C-O 3.56Å; N600-E619 VanDerWaalsContact CA-O 3.28Å; N600-E619 WeakPolarHBondContact CA-O 3.48Å; N600-I620 WeakPolarHBondContact OD1-CA 3.29Å; N600-S621 PolarHBondContact OD1-N 3.33Å; N600-S621 VanDerWaalsContact OD1-N 3.09Å
601	K	33.9	Very low	33.1	Very low	113 Å²	113	111.4 Å²	111.4	49%	0.491	62%	0.617	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-106.2	123.9	179.5	-59	177.9	-159.2	149.7	0	110.8	K599 I618 E619	K599-K601 PolarHBondContact O-N 2.92Å; K601-I618 WeakPolarHBondContact O-CA 3.46Å; K601-E619 HydrophobicContact CB-CB 4.24Å; K601-E619 PolarHBondContact N-O 3.37Å; K601-E619 IonicContact NZ-OE2 3.26Å; K601-E619 PolarHBondContact NZ-OE2 3.4Å; K601-E619 PolarHBondContact O-N 2.95Å
602	I	34.5	Very low	33.5	Very low	116 Å²	116	108 Å²	108	60%	0.595	61%	0.608	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-93.5	103	165.8	-57	176.4	0	0	0	107.3	L604 V615	I602-L604 HydrophobicContact CG2-CD2 3.99Å; I602-L604 HydrophobicContact CG2-CG 4.42Å; I602-L604 PolarHBondContact O-N 2.88Å; I602-V615 HydrophobicContact CG2-CG1 4.21Å; I602-V615 HydrophobicContact CG2-CG2 4.28Å
603	C	32.8	Very low	34.2	Very low	44 Å²	44	109.9 Å²	109.9	30%	0.297	60%	0.6	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-80.3	115.2	172.8	-64.7	0	0	0	0	109.1	K616 K617	C603-K616 HydrophobicContact CB-CB 4.37Å; C603-K616 WeakPolarHBondContact O-CA 3.48Å; C603-K616 VanDerWaalsContact O-CB 3.3Å; C603-K616 WeakPolarHBondContact O-CB 3.28Å; C603-K616 PolarHBondContact O-N 3.05Å; C603-K617 HydrophobicContact CB-CB 4.1Å; C603-K617 PolarHBondContact N-O 3.09Å; C603-K617 PolarHBondContact O-N 3.15Å
604	L	37.9	Very low	34.7	Very low	97 Å²	97	105.7 Å²	105.7	51%	0.508	58%	0.577	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-91.9	151.4	172.5	-63.6	-180	0	0	0	111.4	I602 Y613 A614 V615	I602-L604 HydrophobicContact CG2-CD2 3.99Å; I602-L604 HydrophobicContact CG2-CG 4.42Å; I602-L604 PolarHBondContact O-N 2.88Å; L604-Y613 HydrophobicContact CB-CD1 3.88Å; L604-Y613 HydrophobicContact CB-CG 4.41Å; L604-Y613 HydrophobicContact CD1-CD1 4.44Å; L604-Y613 HydrophobicContact CD1-CG 4.41Å; L604-A614 CarbonylContact C-O 3.57Å; L604-A614 WeakPolarHBondContact CA-O 3.14Å; L604-V615 HydrophobicContact CD2-CG2 3.98Å
605	K	43.1	Very low	35.3	Very low	125 Å²	125	103.9 Å²	103.9	54%	0.543	57%	0.566	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-127.4	120.1	169.6	-179.5	-178.2	179.2	-175.1	0	108.6	I607 A614 K616	K605-I607 PolarHBondContact O-N 3.42Å; K605-A614 PolarHBondContact N-O 2.71Å; K605-A614 PolarHBondContact O-N 3.22Å; K605-K616 HydrophobicContact CB-CB 3.99Å; K605-K616 HydrophobicContact CB-CD 4.31Å; K605-K616 HydrophobicContact CB-CG 4.32Å
606	R	36.2	Very low	35.9	Very low	141 Å²	141	107.9 Å²	107.9	53%	0.532	57%	0.569	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-58.6	133.2	171.8	-169	177.6	-179	-179.4	6.6	109.3	S610 N611 Y613	R606-S610 PolarHBondContact NE-O 3.01Å; R606-N611 PolarHBondContact NH2-OD1 2.74Å; R606-Y613 HydrophobicContact CB-CD1 4.09Å; R606-Y613 HydrophobicContact CB-CE1 3.87Å; R606-Y613 HydrophobicContact CG-CE1 4.46Å
607	I	36.6	Very low	36.2	Very low	76 Å²	76	106.6 Å²	106.6	39%	0.39	56%	0.557	S	S	.	*	P	Polyproline II helix	trans	-79.3	121.4	176.8	-64.7	166.4	0	0	0	107.4	K605 G609 S610 N612 A614	K605-I607 PolarHBondContact O-N 3.42Å; I607-G609 PolarHBondContact O-N 3.34Å; I607-S610 WeakPolarHBondContact CB-OG 3.24Å; I607-S610 PolarHBondContact O-N 3.41Å; I607-S610 VanDerWaalsContact O-N 3.1Å; I607-S610 PolarHBondContact O-OG 2.79Å; I607-S610 VanDerWaalsContact O-OG 3.07Å; I607-N612 HydrophobicContact CD1-CB 4.09Å; I607-N612 PolarHBondContact N-O 3.06Å; I607-A614 HydrophobicContact CD1-CB 4.2Å; I607-A614 HydrophobicContact CG1-CB 4.07Å
608	P	32.9	Very low	36.6	Very low	119 Å²	119	103 Å²	103	77%	0.773	55%	0.546	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55	135.7	-180	-25.4	34.6	0	0	0	111.7
609	G	37.5	Very low	36.4	Very low	93 Å²	93	102 Å²	102	96%	0.959	53%	0.532	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.1	19.9	-175.4	0	0	0	0	0	114.8	I607	I607-G609 PolarHBondContact O-N 3.34Å
610	S	41.6	Very low	36.5	Very low	32 Å²	32	101 Å²	101	22%	0.224	53%	0.532	C	S	.	.	S	Bend	trans	-153.2	168.4	173.4	77.2	0	0	0	0	113.8	R606 I607 N612	R606-S610 PolarHBondContact NE-O 3.01Å; I607-S610 WeakPolarHBondContact CB-OG 3.24Å; I607-S610 PolarHBondContact O-N 3.41Å; I607-S610 VanDerWaalsContact O-N 3.1Å; I607-S610 PolarHBondContact O-OG 2.79Å; I607-S610 VanDerWaalsContact O-OG 3.07Å; S610-N612 VanDerWaalsContact C-N 3.29Å; S610-N612 PolarHBondContact OG-N 3.1Å
611	N	38.8	Very low	36.9	Very low	127 Å²	127	98.8 Å²	98.8	68%	0.679	52%	0.524	S	S	*	.	S	Bend	trans	-87.6	2.7	170.6	-64.2	-18.5	0	0	0	112.9	R606	R606-N611 PolarHBondContact NH2-OD1 2.74Å
612	N	35.8	Very low	36.8	Very low	112 Å²	112	103.1 Å²	103.1	60%	0.599	54%	0.543	S	S	*	.			trans	-88.2	150.1	-178.1	-69.9	-48.9	0	0	0	112.6	I607 S610	I607-N612 HydrophobicContact CD1-CB 4.09Å; I607-N612 PolarHBondContact N-O 3.06Å; S610-N612 VanDerWaalsContact C-N 3.29Å; S610-N612 PolarHBondContact OG-N 3.1Å
613	Y	40	Very low	36.6	Very low	142 Å²	142	100.1 Å²	100.1	56%	0.557	54%	0.541	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-117.1	135.1	179.1	-70.2	-102	0	0	0	110.8	L604 R606	L604-Y613 HydrophobicContact CB-CD1 3.88Å; L604-Y613 HydrophobicContact CB-CG 4.41Å; L604-Y613 HydrophobicContact CD1-CD1 4.44Å; L604-Y613 HydrophobicContact CD1-CG 4.41Å; R606-Y613 HydrophobicContact CB-CD1 4.09Å; R606-Y613 HydrophobicContact CB-CE1 3.87Å; R606-Y613 HydrophobicContact CG-CE1 4.46Å
614	A	36.5	Very low	36.5	Very low	44 Å²	44	104.6 Å²	104.6	36%	0.364	56%	0.562	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-100.3	144.1	170	0	0	0	0	0	110.5	L604 K605 I607 K616	L604-A614 CarbonylContact C-O 3.57Å; L604-A614 WeakPolarHBondContact CA-O 3.14Å; K605-A614 PolarHBondContact N-O 2.71Å; K605-A614 PolarHBondContact O-N 3.22Å; I607-A614 HydrophobicContact CD1-CB 4.2Å; I607-A614 HydrophobicContact CG1-CB 4.07Å; A614-K616 PolarHBondContact O-N 3.02Å
615	V	37.9	Very low	35.9	Very low	88 Å²	88	109.4 Å²	109.4	53%	0.533	58%	0.581	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-68	117.5	171	-178.9	0	0	0	0	109	I602 L604 I618	I602-V615 HydrophobicContact CG2-CG1 4.21Å; I602-V615 HydrophobicContact CG2-CG2 4.28Å; L604-V615 HydrophobicContact CD2-CG2 3.98Å; V615-I618 HydrophobicContact CG1-CD1 4.29Å; V615-I618 HydrophobicContact CG1-CG1 3.74Å
616	K	37.8	Very low	35.3	Very low	156 Å²	156	107.8 Å²	107.8	68%	0.678	59%	0.586	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-89.7	-38.1	-178.7	-171.7	-168.6	176.1	-172.3	0	112.1	C603 K605 A614	C603-K616 HydrophobicContact CB-CB 4.37Å; C603-K616 WeakPolarHBondContact O-CA 3.48Å; C603-K616 VanDerWaalsContact O-CB 3.3Å; C603-K616 WeakPolarHBondContact O-CB 3.28Å; C603-K616 PolarHBondContact O-N 3.05Å; K605-K616 HydrophobicContact CB-CB 3.99Å; K605-K616 HydrophobicContact CB-CD 4.31Å; K605-K616 HydrophobicContact CB-CG 4.32Å; A614-K616 PolarHBondContact O-N 3.02Å
617	K	34.7	Very low	34.8	Very low	113 Å²	113	110 Å²	110	49%	0.491	60%	0.603	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-160.5	143.5	179.3	-165.1	179.5	-178.1	-167	0	108.9	C603 E619	C603-K617 HydrophobicContact CB-CB 4.1Å; C603-K617 PolarHBondContact N-O 3.09Å; C603-K617 PolarHBondContact O-N 3.15Å; K617-E619 HydrophobicContact CD-CG 3.7Å; K617-E619 WeakPolarHBondContact CE-OE1 3.26Å; K617-E619 HydrophobicContact CG-CG 4.07Å; K617-E619 IonicContact NZ-OE1 2.69Å; K617-E619 PolarHBondContact NZ-OE1 2.8Å
618	I	36.7	Very low	34.3	Very low	98 Å²	98	116 Å²	116	50%	0.503	63%	0.629	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-110.6	111.1	163.4	-54.1	177.4	0	0	0	105.9	K601 V615 I620	K601-I618 WeakPolarHBondContact O-CA 3.46Å; V615-I618 HydrophobicContact CG1-CD1 4.29Å; V615-I618 HydrophobicContact CG1-CG1 3.74Å; I618-I620 HydrophobicContact CG2-CG1 3.89Å; I618-I620 PolarHBondContact O-N 3.18Å
619	E	30.2	Very low	33.9	Very low	62 Å²	62	114.8 Å²	114.8	29%	0.29	63%	0.629	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-91.4	93.6	171.1	-61.2	-171.8	152.9	0	0	107.8	N600 K601 K617	N600-E619 CarbonylContact C-O 3.56Å; N600-E619 VanDerWaalsContact CA-O 3.28Å; N600-E619 WeakPolarHBondContact CA-O 3.48Å; K601-E619 HydrophobicContact CB-CB 4.24Å; K601-E619 PolarHBondContact N-O 3.37Å; K601-E619 IonicContact NZ-OE2 3.26Å; K601-E619 PolarHBondContact NZ-OE2 3.4Å; K601-E619 PolarHBondContact O-N 2.95Å; K617-E619 HydrophobicContact CD-CG 3.7Å; K617-E619 WeakPolarHBondContact CE-OE1 3.26Å; K617-E619 HydrophobicContact CG-CG 4.07Å; K617-E619 IonicContact NZ-OE1 2.69Å; K617-E619 PolarHBondContact NZ-OE1 2.8Å
620	I	38.1	Very low	33.3	Very low	126 Å²	126	119.7 Å²	119.7	65%	0.646	62%	0.624	S	S	*	*			trans	-76.4	130.1	166.1	-55.8	-179.3	0	0	0	107.2	N600 I618 K622	N600-I620 WeakPolarHBondContact OD1-CA 3.29Å; I618-I620 HydrophobicContact CG2-CG1 3.89Å; I618-I620 PolarHBondContact O-N 3.18Å; I620-K622 PolarHBondContact O-N 2.73Å
621	S	40.9	Very low	32.6	Very low	51 Å²	51	123.6 Å²	123.6	36%	0.357	65%	0.651	S	S	.	*			trans	-70	120.3	175	-58.4	0	0	0	0	109	K599 N600 G623	K599-S621 PolarHBondContact N-OG 3.09Å; K599-S621 PolarHBondContact O-OG 2.94Å; N600-S621 PolarHBondContact OD1-N 3.33Å; N600-S621 VanDerWaalsContact OD1-N 3.09Å; S621-G623 VanDerWaalsContact C-N 3.31Å; S621-G623 PolarHBondContact O-N 2.81Å
622	K	32.2	Very low	31.8	Very low	203 Å²	203	123.9 Å²	123.9	88%	0.883	66%	0.657	S	S	*	*			trans	-68.8	93.1	164.9	-78.2	-163.6	171	-159.5	0	108.2	I620	I620-K622 PolarHBondContact O-N 2.73Å
623	G	29.5	Very low	31.2	Very low	53 Å²	53	128.3 Å²	128.3	55%	0.546	67%	0.666	S	S	.	*			trans	-68.2	147.3	164.6	0	0	0	0	0	109.8	S621	S621-G623 VanDerWaalsContact C-N 3.31Å; S621-G623 PolarHBondContact O-N 2.81Å
624	N	30.8	Very low	30.5	Very low	139 Å²	139	127.4 Å²	127.4	74%	0.743	68%	0.677	S	S	*	*			trans	-61.4	143.2	-167.4	-64.5	-4.3	0	0	0	113.4	S626	N624-S626 PolarHBondContact O-N 3.1Å
625	E	27.1	Very low	29.9	Very low	197 Å²	197	129.4 Å²	129.4	92%	0.921	69%	0.693	S	S	*	*			trans	-78.9	97.8	166.7	-68.1	169	160.1	0	0	108.4
626	S	28.7	Very low	29.4	Very low	91 Å²	91	134.9 Å²	134.9	64%	0.636	71%	0.71	S	S	*	*			trans	-153.1	118.9	172.6	58.1	0	0	0	0	112.5	N624	N624-S626 PolarHBondContact O-N 3.1Å
627	E	27.1	Very low	28.9	Very low	189 Å²	189	135 Å²	135	88%	0.883	71%	0.713	S	S	*	*			trans	74.4	155.2	155	-57.1	-175.5	137.6	0	0	120	A629	E627-A629 PolarHBondContact O-N 2.92Å
628	Q	24.7	Very low	28.5	Very low	200 Å²	200	138.9 Å²	138.9	94%	0.935	73%	0.73	S	S	*	*			trans	-90.5	84.2	-155	-61.7	178	4.5	0	0	113.6	K630	Q628-K630 PolarHBondContact O-N 3.24Å
629	A	24.4	Very low	28	Very low	95 Å²	95	139.6 Å²	139.6	79%	0.785	74%	0.743	S	S	*	*			trans	-75.9	115.6	161.2	0	0	0	0	0	110.1	E627 S631	E627-A629 PolarHBondContact O-N 2.92Å; A629-S631 PolarHBondContact O-N 3.5Å
630	K	25.6	Very low	28	Very low	196 Å²	196	146.2 Å²	146.2	85%	0.852	77%	0.765	S	S	*	*			trans	-53.9	124.8	174.7	-71.6	177.9	-179.1	173.6	0	109.4	Q628 V632	Q628-K630 PolarHBondContact O-N 3.24Å; K630-V632 VanDerWaalsContact C-N 3.28Å; K630-V632 PolarHBondContact O-N 3.32Å
631	S	25.9	Very low	27.7	Very low	113 Å²	113	145.5 Å²	145.5	79%	0.79	76%	0.762	S	S	*	*			trans	-68.6	86.8	178.6	-174.1	0	0	0	0	110.4	A629 R633	A629-S631 PolarHBondContact O-N 3.5Å; S631-R633 VanDerWaalsContact C-N 3.31Å; S631-R633 PolarHBondContact O-N 2.05Å
632	V	23.2	Very low	27.8	Very low	133 Å²	133	148.3 Å²	148.3	81%	0.806	77%	0.771	S	S	*	*			trans	-61.4	100.2	161.2	179.5	0	0	0	0	105.7	K630	K630-V632 VanDerWaalsContact C-N 3.28Å; K630-V632 PolarHBondContact O-N 3.32Å
633	R	24	Very low	28.7	Very low	206 Å²	206	146.1 Å²	146.1	78%	0.777	76%	0.757	S	S	*	*	P	Polyproline II helix	trans	-52.2	133.8	168.2	-69.6	176.5	173	160.4	-2.4	106.7	S631 A635	S631-R633 VanDerWaalsContact C-N 3.31Å; S631-R633 PolarHBondContact O-N 2.05Å; R633-A635 PolarHBondContact O-N 3.27Å
634	P	24.5	Very low	29.9	Very low	122 Å²	122	144.7 Å²	144.7	79%	0.792	74%	0.739	S	S	*	*	P	Polyproline II helix	trans	-51.5	136.5	159.5	26.1	-33.3	0	0	0	106.4	K636	P634-K636 PolarHBondContact O-N 3.41Å
635	A	22.9	Very low	31.1	Very low	86 Å²	86	141.7 Å²	141.7	71%	0.711	73%	0.726	S	S	*	*	P	Polyproline II helix	trans	-50.3	143.3	-177.7	0	0	0	0	0	109	R633 E637	R633-A635 PolarHBondContact O-N 3.27Å; A635-E637 PolarHBondContact O-N 3.46Å
636	K	28.2	Very low	32.8	Very low	203 Å²	203	132.3 Å²	132.3	88%	0.883	68%	0.682	S	S	*	*			trans	-63.3	91.3	163.6	-78.2	-175.6	175.7	-178.5	0	105.9	P634 K638	P634-K636 PolarHBondContact O-N 3.41Å; K636-K638 PolarHBondContact O-N 3.34Å
637	E	27.4	Very low	34	Very low	160 Å²	160	130.5 Å²	130.5	75%	0.748	67%	0.668	S	S	*	*			trans	-48.1	120.5	163.8	-72	-174	156.8	0	0	105.6	A635 C639	A635-E637 PolarHBondContact O-N 3.46Å; E637-C639 PolarHBondContact O-N 2.73Å
638	K	25.7	Very low	35.2	Very low	193 Å²	193	122 Å²	122	84%	0.839	63%	0.629	S	S	*	*			trans	-54.1	132.6	-179.4	-75	-178.8	177.1	177.5	0	106.2	K636 W640	K636-K638 PolarHBondContact O-N 3.34Å; K638-W640 PolarHBondContact O-N 3.22Å
639	C	27	Very low	37.6	Very low	114 Å²	114	114.9 Å²	114.9	77%	0.77	60%	0.6	S	S	*	*			trans	-50.6	113.4	-179.6	-171.2	0	0	0	0	107.1	E637 D641	E637-C639 PolarHBondContact O-N 2.73Å; C639-D641 PolarHBondContact O-N 3.32Å
640	W	30.2	Very low	39.8	Very low	201 Å²	201	114.8 Å²	114.8	76%	0.761	59%	0.593	S	S	*	*			trans	-49.9	130.7	174.1	-71	55.3	0	0	0	105.5	K638 M642	K638-W640 PolarHBondContact O-N 3.22Å; W640-M642 VanDerWaalsContact C-N 3.26Å; W640-M642 VanDerWaalsContact O-CG 3.24Å; W640-M642 WeakPolarHBondContact O-CG 3.47Å; W640-M642 PolarHBondContact O-N 2.91Å
641	D	32.6	Very low	42	Very low	111 Å²	111	109.5 Å²	109.5	59%	0.594	57%	0.573	S	S	*	*			trans	-69.3	88.1	-168.1	-166.4	5.6	0	0	0	108.8	C639 R643	C639-D641 PolarHBondContact O-N 3.32Å; D641-R643 PolarHBondContact O-N 3.45Å; D641-R643 IonicContact OD1-NE 3.72Å; D641-R643 IonicContact OD2-CZ 3.48Å; D641-R643 IonicContact OD2-NE 3.54Å; D641-R643 PolarHBondContact OD2-NE 3.15Å; D641-R643 IonicContact OD2-NH2 3.44Å; D641-R643 PolarHBondContact OD2-NH2 3.24Å
642	M	41.6	Very low	44.2	Very low	109 Å²	109	108.4 Å²	108.4	54%	0.537	56%	0.562	S	S	.	*			trans	-77	56.9	-167.9	-72.1	-158.8	175.5	0	0	111.2	W640 S644 K654	W640-M642 VanDerWaalsContact C-N 3.26Å; W640-M642 VanDerWaalsContact O-CG 3.24Å; W640-M642 WeakPolarHBondContact O-CG 3.47Å; W640-M642 PolarHBondContact O-N 2.91Å; M642-S644 VanDerWaalsContact C-N 3.26Å; M642-S644 PolarHBondContact O-N 3.08Å; M642-K654 CarbonylContact O-C 3.57Å
643	R	51.4	Low	46.4	Very low	157 Å²	157	104 Å²	104	59%	0.592	53%	0.532	S	S	*	.			trans	-70.7	84.7	166.8	-58.9	-169.5	-164.4	-167.5	11.8	108.4	D641 V645 F653	D641-R643 PolarHBondContact O-N 3.45Å; D641-R643 IonicContact OD1-NE 3.72Å; D641-R643 IonicContact OD2-CZ 3.48Å; D641-R643 IonicContact OD2-NE 3.54Å; D641-R643 PolarHBondContact OD2-NE 3.15Å; D641-R643 IonicContact OD2-NH2 3.44Å; D641-R643 PolarHBondContact OD2-NH2 3.24Å; R643-V645 PolarHBondContact O-N 3.37Å; R643-F653 CarbonylContact C-O 3.58Å; R643-F653 VanDerWaalsContact CA-O 3.29Å; R643-F653 WeakPolarHBondContact CA-O 3.36Å
644	S	54	Low	48.4	Very low	23 Å²	23	103 Å²	103	16%	0.161	53%	0.533	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.9	120.1	168.8	50.4	0	0	0	0	109.2	M642 F653 K655 P656 A659	M642-S644 VanDerWaalsContact C-N 3.26Å; M642-S644 PolarHBondContact O-N 3.08Å; S644-F653 PolarHBondContact N-O 3.02Å; S644-F653 PolarHBondContact O-N 3.33Å; S644-F653 PolarHBondContact OG-O 2.97Å; S644-K655 PolarHBondContact OG-O 2.84Å; S644-P656 VanDerWaalsContact OG-CA 3.29Å; S644-P656 WeakPolarHBondContact OG-CA 3.46Å; S644-A659 VanDerWaalsContact OG-CB 3.25Å; S644-A659 WeakPolarHBondContact OG-CB 3.35Å
645	V	56.9	Low	49.9	Very low	77 Å²	77	101.6 Å²	101.6	47%	0.467	52%	0.515	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	139.8	172.9	-171.4	0	0	0	0	108.8	R643 C650 I651 T652	R643-V645 PolarHBondContact O-N 3.37Å; V645-C650 HydrophobicContact CG1-CB 4.3Å; V645-I651 WeakPolarHBondContact CA-O 3.24Å; V645-T652 HydrophobicContact CG2-CG2 4.09Å
646	C	63	Low	51.2	Low	0 Å²	0	99.1 Å²	99.1	0%	0	49%	0.491	C	S	.	.	P	Polyproline II helix	trans	-75.4	126.1	165.5	177.3	0	0	0	0	110.2	V648 C649 C650 I651 F653 H662	C646-V648 PolarHBondContact O-N 2.97Å; C646-V648 VanDerWaalsContact O-N 3.16Å; C646-C649 VanDerWaalsContact CB-SG 3.54Å; C646-C649 VanDerWaalsContact SG-SG 3.62Å; C646-C650 VanDerWaalsContact O-CA 3.3Å; C646-C650 WeakPolarHBondContact O-CA 3.29Å; C646-C650 PolarHBondContact O-N 3.19Å; C646-I651 PolarHBondContact N-O 2.82Å; C646-F653 HydrophobicContact CB-CE2 4.1Å; C646-H662 VanDerWaalsContact SG-CD2 3.52Å
647	P	54.5	Low	52.5	Low	53 Å²	53	96.4 Å²	96.4	34%	0.344	48%	0.476	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.8	-4.9	-176.6	29.8	-36.7	0	0	0	115	L663 L709 F713	P647-L663 HydrophobicContact CG-CD1 4.17Å; P647-L663 HydrophobicContact CG-CD2 4.41Å; P647-L709 VanDerWaalsContact O-CD1 3.28Å; P647-L709 WeakPolarHBondContact O-CD1 3.3Å; P647-F713 HydrophobicContact CB-CE2 3.89Å; P647-F713 HydrophobicContact CB-CZ 4.31Å; P647-F713 HydrophobicContact CG-CD2 4.35Å; P647-F713 HydrophobicContact CG-CE2 3.47Å; P647-F713 VanDerWaalsContact CG-CE2 3.47Å; P647-F713 HydrophobicContact CG-CZ 3.67Å
648	V	52.4	Low	54.2	Low	11 Å²	11	92.7 Å²	92.7	7%	0.067	46%	0.458	C	S	.	.	T	Hydrogen-bonded Turn	trans	-106.4	-27.2	-177.4	-170.9	0	0	0	0	112.9	C646 L663 H667 R710 F713	C646-V648 PolarHBondContact O-N 2.97Å; C646-V648 VanDerWaalsContact O-N 3.16Å; V648-L663 HydrophobicContact CG2-CD1 3.7Å; V648-H667 HydrophobicContact CB-CB 4.49Å; V648-H667 VanDerWaalsContact CG1-ND1 3.27Å; V648-H667 WeakPolarHBondContact CG1-ND1 3.4Å; V648-H667 HydrophobicContact CG2-CB 4.4Å; V648-R710 HydrophobicContact CG1-CB 4.26Å; V648-F713 HydrophobicContact CG2-CD2 4.14Å
649	C	73.5	Confident	55.8	Low	49 Å²	49	83.9 Å²	83.9	33%	0.331	42%	0.421	S	S	.	.	T	Hydrogen-bonded Turn	trans	-133.4	1.9	-176.9	67.4	0	0	0	0	114.7	C646 I651 H662	C646-C649 VanDerWaalsContact CB-SG 3.54Å; C646-C649 VanDerWaalsContact SG-SG 3.62Å; C649-I651 HydrophobicContact CB-CG1 4.43Å; C649-I651 PolarHBondContact O-N 3.03Å; C649-I651 VanDerWaalsContact SG-CG1 3.56Å; C649-H662 PolarHBondContact SG-NE2 3.05Å
650	C	71.5	Confident	57	Low	94 Å²	94	81 Å²	81	64%	0.635	40%	0.398	S	S	*	.			trans	60.1	9.5	-178.8	-59.2	0	0	0	0	116.9	V645 C646 T652	V645-C650 HydrophobicContact CG1-CB 4.3Å; C646-C650 VanDerWaalsContact O-CA 3.3Å; C646-C650 WeakPolarHBondContact O-CA 3.29Å; C646-C650 PolarHBondContact O-N 3.19Å; C650-T652 PolarHBondContact O-N 3.11Å
651	I	72.7	Confident	58.2	Low	85 Å²	85	73 Å²	73	44%	0.436	38%	0.375	S	S	.	.			trans	-61.9	133.6	175.3	-63.7	172.8	0	0	0	110	V645 C646 C649 F653	V645-I651 WeakPolarHBondContact CA-O 3.24Å; C646-I651 PolarHBondContact N-O 2.82Å; C649-I651 HydrophobicContact CB-CG1 4.43Å; C649-I651 PolarHBondContact O-N 3.03Å; C649-I651 VanDerWaalsContact SG-CG1 3.56Å; I651-F653 HydrophobicContact CB-CE2 3.73Å; I651-F653 HydrophobicContact CB-CZ 4Å; I651-F653 HydrophobicContact CG2-CD2 4.19Å; I651-F653 HydrophobicContact CG2-CE1 4.12Å; I651-F653 HydrophobicContact CG2-CE2 3.46Å; I651-F653 VanDerWaalsContact CG2-CE2 3.46Å; I651-F653 HydrophobicContact CG2-CZ 3.41Å; I651-F653 VanDerWaalsContact CG2-CZ 3.41Å; I651-F653 WeakPolarHBondContact O-CD2 3.48Å; I651-F653 WeakPolarHBondContact O-CE2 3.49Å
652	T	70.5	Confident	59.8	Low	90 Å²	90	68.6 Å²	68.6	55%	0.552	35%	0.351	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97.2	125.3	-178.2	51.3	0	0	0	0	112.5	V645 C650	V645-T652 HydrophobicContact CG2-CG2 4.09Å; C650-T652 PolarHBondContact O-N 3.11Å
653	F	70.3	Confident	60.6	Low	39 Å²	39	64.6 Å²	64.6	17%	0.171	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	133	-177.8	-61.5	-92.9	0	0	0	111.5	R643 S644 C646 I651 K655 H658 A659 H662	R643-F653 CarbonylContact C-O 3.58Å; R643-F653 VanDerWaalsContact CA-O 3.29Å; R643-F653 WeakPolarHBondContact CA-O 3.36Å; S644-F653 PolarHBondContact N-O 3.02Å; S644-F653 PolarHBondContact O-N 3.33Å; S644-F653 PolarHBondContact OG-O 2.97Å; C646-F653 HydrophobicContact CB-CE2 4.1Å; I651-F653 HydrophobicContact CB-CE2 3.73Å; I651-F653 HydrophobicContact CB-CZ 4Å; I651-F653 HydrophobicContact CG2-CD2 4.19Å; I651-F653 HydrophobicContact CG2-CE1 4.12Å; I651-F653 HydrophobicContact CG2-CE2 3.46Å; I651-F653 VanDerWaalsContact CG2-CE2 3.46Å; I651-F653 HydrophobicContact CG2-CZ 3.41Å; I651-F653 VanDerWaalsContact CG2-CZ 3.41Å; I651-F653 WeakPolarHBondContact O-CD2 3.48Å; I651-F653 WeakPolarHBondContact O-CE2 3.49Å; F653-K655 PolarHBondContact O-N 3.04Å; F653-H658 HydrophobicContact CB-CB 3.9Å; F653-H658 HydrophobicContact CD1-CB 3.7Å; F653-H658 HydrophobicContact CG-CB 4.07Å; F653-A659 HydrophobicContact CB-CB 4.15Å; F653-A659 HydrophobicContact CD2-CB 3.58Å; F653-A659 HydrophobicContact CE2-CB 4.31Å; F653-A659 HydrophobicContact CG-CB 4.07Å; F653-H662 HydrophobicContact CE1-CB 3.95Å; F653-H662 HydrophobicContact CE2-CB 4.03Å; F653-H662 AromaticContact CE2-CD2 3.59Å; F653-H662 AromaticContact CE2-CG 3.8Å; F653-H662 HydrophobicContact CZ-CB 3.47Å; F653-H662 VanDerWaalsContact CZ-CB 3.47Å; F653-H662 AromaticContact CZ-CD2 3.51Å; F653-H662 AromaticContact CZ-CG 3.26Å; F653-H662 AromaticContact CZ-ND1 3.72Å
654	K	64.9	Low	60.7	Low	186 Å²	186	60.2 Å²	60.2	81%	0.809	32%	0.319	S	S	*	.	S	Bend	trans	-59.9	-6.9	-179.6	-63.3	-179	177.6	177.5	0	115.7	M642	M642-K654 CarbonylContact O-C 3.57Å
655	K	57.3	Low	61.2	Low	93 Å²	93	64.6 Å²	64.6	40%	0.404	34%	0.341	S	S	.	.	S	Bend	trans	-152.8	129.3	-168.2	-80.2	163.3	162.2	-177.1	0	109.6	S644 F653 W657 H658	S644-K655 PolarHBondContact OG-O 2.84Å; F653-K655 PolarHBondContact O-N 3.04Å; K655-W657 VanDerWaalsContact C-N 3.28Å; K655-W657 HydrophobicContact CB-CD2 3.99Å; K655-W657 HydrophobicContact CB-CE3 4.12Å; K655-W657 HydrophobicContact CB-CH2 4.1Å; K655-W657 HydrophobicContact CB-CZ2 3.96Å; K655-W657 HydrophobicContact CB-CZ3 4.16Å; K655-W657 HydrophobicContact CD-CH2 3.83Å; K655-W657 HydrophobicContact CD-CZ2 3.3Å; K655-W657 VanDerWaalsContact CE-CZ2 3.45Å; K655-W657 HydrophobicContact CG-CH2 3.68Å; K655-W657 HydrophobicContact CG-CZ2 3.63Å; K655-W657 HydrophobicContact CG-CZ3 4.15Å; K655-W657 PolarHBondContact O-N 3.39Å; K655-W657 VanDerWaalsContact O-N 3.16Å; K655-H658 WeakPolarHBondContact O-CB 3.02Å; K655-H658 PolarHBondContact O-N 3.08Å
656	P	49.6	Very low	61.8	Low	34 Å²	34	66.4 Å²	66.4	22%	0.221	35%	0.347	C	S	.	.	H	α-helix	trans	-59	-33.1	-174.3	19.5	-30.8	0	0	0	114.7	S644 H658 A659 I660	S644-P656 VanDerWaalsContact OG-CA 3.29Å; S644-P656 WeakPolarHBondContact OG-CA 3.46Å; P656-H658 VanDerWaalsContact C-N 3.28Å; P656-H658 PolarHBondContact O-N 3.37Å; P656-A659 PolarHBondContact O-N 2.9Å; P656-I660 WeakPolarHBondContact O-CD1 3.24Å; P656-I660 VanDerWaalsContact O-CG1 3.26Å; P656-I660 WeakPolarHBondContact O-CG1 3.44Å; P656-I660 PolarHBondContact O-N 3.25Å; P656-I660 VanDerWaalsContact O-N 3.08Å
657	W	55.8	Low	61.7	Low	146 Å²	146	67.9 Å²	67.9	55%	0.553	35%	0.354	S	S	*	.	H	α-helix	trans	-72.2	-18.5	177.7	62.6	91.2	0	0	0	114	K655 A661	K655-W657 VanDerWaalsContact C-N 3.28Å; K655-W657 HydrophobicContact CB-CD2 3.99Å; K655-W657 HydrophobicContact CB-CE3 4.12Å; K655-W657 HydrophobicContact CB-CH2 4.1Å; K655-W657 HydrophobicContact CB-CZ2 3.96Å; K655-W657 HydrophobicContact CB-CZ3 4.16Å; K655-W657 HydrophobicContact CD-CH2 3.83Å; K655-W657 HydrophobicContact CD-CZ2 3.3Å; K655-W657 VanDerWaalsContact CE-CZ2 3.45Å; K655-W657 HydrophobicContact CG-CH2 3.68Å; K655-W657 HydrophobicContact CG-CZ2 3.63Å; K655-W657 HydrophobicContact CG-CZ3 4.15Å; K655-W657 PolarHBondContact O-N 3.39Å; K655-W657 VanDerWaalsContact O-N 3.16Å; W657-A661 VanDerWaalsContact O-CB 3.32Å; W657-A661 WeakPolarHBondContact O-CB 3.18Å; W657-A661 PolarHBondContact O-N 3.26Å
658	H	62.3	Low	61.1	Low	81 Å²	81	67.5 Å²	67.5	38%	0.375	36%	0.36	S	S	.	.	H	α-helix	trans	-76.9	-40.5	172.5	-64.1	177.9	0	0	0	111.3	F653 K655 P656 I660 A661 H662	F653-H658 HydrophobicContact CB-CB 3.9Å; F653-H658 HydrophobicContact CD1-CB 3.7Å; F653-H658 HydrophobicContact CG-CB 4.07Å; K655-H658 WeakPolarHBondContact O-CB 3.02Å; K655-H658 PolarHBondContact O-N 3.08Å; P656-H658 VanDerWaalsContact C-N 3.28Å; P656-H658 PolarHBondContact O-N 3.37Å; H658-I660 VanDerWaalsContact C-N 3.27Å; H658-I660 PolarHBondContact O-N 3.27Å; H658-A661 PolarHBondContact O-N 2.76Å; H658-H662 VanDerWaalsContact O-CB 3.26Å; H658-H662 WeakPolarHBondContact O-CB 3.32Å; H658-H662 PolarHBondContact O-N 2.88Å
659	A	59.8	Low	60.7	Low	8 Å²	8	67.2 Å²	67.2	7%	0.066	36%	0.359	C	S	.	.	H	α-helix	trans	-64.5	-34.9	172.4	0	0	0	0	0	111.9	S644 F653 P656 L663	S644-A659 VanDerWaalsContact OG-CB 3.25Å; S644-A659 WeakPolarHBondContact OG-CB 3.35Å; F653-A659 HydrophobicContact CB-CB 4.15Å; F653-A659 HydrophobicContact CD2-CB 3.58Å; F653-A659 HydrophobicContact CE2-CB 4.31Å; F653-A659 HydrophobicContact CG-CB 4.07Å; P656-A659 PolarHBondContact O-N 2.9Å; A659-L663 VanDerWaalsContact O-CB 3.25Å; A659-L663 WeakPolarHBondContact O-CB 3Å; A659-L663 PolarHBondContact O-N 2.74Å
660	I	52.2	Low	58.9	Low	53 Å²	53	68.1 Å²	68.1	27%	0.272	36%	0.363	S	S	.	.	H	α-helix	trans	-69.4	-42.3	174.6	-70.3	166.7	0	0	0	111.7	P656 H658 L663 I664 I671 I749	P656-I660 WeakPolarHBondContact O-CD1 3.24Å; P656-I660 VanDerWaalsContact O-CG1 3.26Å; P656-I660 WeakPolarHBondContact O-CG1 3.44Å; P656-I660 PolarHBondContact O-N 3.25Å; P656-I660 VanDerWaalsContact O-N 3.08Å; H658-I660 VanDerWaalsContact C-N 3.27Å; H658-I660 PolarHBondContact O-N 3.27Å; I660-L663 PolarHBondContact O-N 3.39Å; I660-I664 WeakPolarHBondContact O-CG1 3.45Å; I660-I664 PolarHBondContact O-N 3.26Å; I660-I664 VanDerWaalsContact O-N 3.16Å; I660-I671 HydrophobicContact CG2-CD1 3.35Å; I660-I671 HydrophobicContact CG2-CG1 4.29Å; I660-I749 HydrophobicContact CD1-CD1 4.43Å
661	A	55.9	Low	57.3	Low	34 Å²	34	68.3 Å²	68.3	28%	0.281	36%	0.357	S	S	.	.	H	α-helix	trans	-61.2	-54.6	174.3	0	0	0	0	0	110.5	W657 H658 L663 I664 D665	W657-A661 VanDerWaalsContact O-CB 3.32Å; W657-A661 WeakPolarHBondContact O-CB 3.18Å; W657-A661 PolarHBondContact O-N 3.26Å; H658-A661 PolarHBondContact O-N 2.76Å; A661-L663 PolarHBondContact O-N 2.74Å; A661-L663 VanDerWaalsContact O-N 3.16Å; A661-I664 CarbonylContact O-C 3.56Å; A661-I664 WeakPolarHBondContact O-CA 3.23Å; A661-I664 VanDerWaalsContact O-CB 3.31Å; A661-I664 WeakPolarHBondContact O-CB 3.47Å; A661-I664 PolarHBondContact O-N 3.25Å; A661-D665 PolarHBondContact O-N 3.24Å; A661-D665 VanDerWaalsContact O-OD2 3.11Å
662	H	66.9	Low	55.4	Low	19 Å²	19	67.8 Å²	67.8	9%	0.088	35%	0.353	C	S	.	.	H	α-helix	trans	-53.7	-36.7	174	172.8	77.5	0	0	0	113.6	C646 C649 F653 H658 I664 D665 D666 H667	C646-H662 VanDerWaalsContact SG-CD2 3.52Å; C649-H662 PolarHBondContact SG-NE2 3.05Å; F653-H662 HydrophobicContact CE1-CB 3.95Å; F653-H662 HydrophobicContact CE2-CB 4.03Å; F653-H662 AromaticContact CE2-CD2 3.59Å; F653-H662 AromaticContact CE2-CG 3.8Å; F653-H662 HydrophobicContact CZ-CB 3.47Å; F653-H662 VanDerWaalsContact CZ-CB 3.47Å; F653-H662 AromaticContact CZ-CD2 3.51Å; F653-H662 AromaticContact CZ-CG 3.26Å; F653-H662 AromaticContact CZ-ND1 3.72Å; H658-H662 VanDerWaalsContact O-CB 3.26Å; H658-H662 WeakPolarHBondContact O-CB 3.32Å; H658-H662 PolarHBondContact O-N 2.88Å; H662-I664 VanDerWaalsContact C-N 3.34Å; H662-I664 PolarHBondContact O-N 2.93Å; H662-D665 PolarHBondContact O-N 3.13Å; H662-D666 IonicContact CE1-OD2 3.19Å; H662-D666 PolarHBondContact CE1-OD2 3.21Å; H662-D666 IonicContact CG-OD2 2.77Å; H662-D666 IonicContact ND1-OD2 3.56Å; H662-D666 PolarHBondContact ND1-OD2 2.91Å; H662-D666 PolarHBondContact O-N 3.38Å; H662-H667 AromaticContact CD2-CD2 3.92Å; H662-H667 AromaticContact CD2-NE2 3.76Å; H662-H667 AromaticContact CE1-NE2 3.52Å; H662-H667 AromaticContact NE2-CD2 3.61Å; H662-H667 AromaticContact NE2-NE2 2.99Å; H662-H667 PolarHBondContact NE2-NE2 3.35Å; H662-H667 PolarHBondContact O-CD2 3.06Å
663	L	57.1	Low	53.5	Low	24 Å²	24	67.9 Å²	67.9	13%	0.126	36%	0.357	C	S	.	.	H	α-helix	trans	-65.9	-32.8	174	-174.3	66.6	0	0	0	112.8	P647 V648 A659 I660 A661 H667 G669 F713	P647-L663 HydrophobicContact CG-CD1 4.17Å; P647-L663 HydrophobicContact CG-CD2 4.41Å; V648-L663 HydrophobicContact CG2-CD1 3.7Å; A659-L663 VanDerWaalsContact O-CB 3.25Å; A659-L663 WeakPolarHBondContact O-CB 3Å; A659-L663 PolarHBondContact O-N 2.74Å; I660-L663 PolarHBondContact O-N 3.39Å; A661-L663 PolarHBondContact O-N 2.74Å; A661-L663 VanDerWaalsContact O-N 3.16Å; L663-H667 HydrophobicContact CD1-CB 4.25Å; L663-G669 VanDerWaalsContact O-CA 3.23Å; L663-G669 WeakPolarHBondContact O-CA 3.32Å; L663-G669 PolarHBondContact O-N 3.23Å; L663-F713 HydrophobicContact CD2-CD1 4.2Å; L663-F713 HydrophobicContact CD2-CE1 4.11Å
664	I	54.5	Low	51.4	Low	66 Å²	66	69.2 Å²	69.2	34%	0.338	37%	0.366	S	S	.	.	H	α-helix	trans	-70.8	-58.8	169.2	-59.3	156	0	0	0	109.6	I660 A661 H662 G668 G669 I671	I660-I664 WeakPolarHBondContact O-CG1 3.45Å; I660-I664 PolarHBondContact O-N 3.26Å; I660-I664 VanDerWaalsContact O-N 3.16Å; A661-I664 CarbonylContact O-C 3.56Å; A661-I664 WeakPolarHBondContact O-CA 3.23Å; A661-I664 VanDerWaalsContact O-CB 3.31Å; A661-I664 WeakPolarHBondContact O-CB 3.47Å; A661-I664 PolarHBondContact O-N 3.25Å; H662-I664 VanDerWaalsContact C-N 3.34Å; H662-I664 PolarHBondContact O-N 2.93Å; I664-G668 VanDerWaalsContact O-CA 3.26Å; I664-G668 WeakPolarHBondContact O-CA 3.35Å; I664-G668 PolarHBondContact O-N 3.21Å; I664-G669 WeakPolarHBondContact CA-O 3.44Å; I664-G669 WeakPolarHBondContact CG1-O 3.25Å; I664-I671 HydrophobicContact CD1-CD1 3.47Å; I664-I671 VanDerWaalsContact CD1-CD1 3.47Å; I664-I671 HydrophobicContact CD1-CG1 3.85Å; I664-I671 HydrophobicContact CG1-CD1 4.03Å; I664-I671 HydrophobicContact CG1-CG1 3.88Å
665	D	63.3	Low	49.6	Very low	115 Å²	115	65.4 Å²	65.4	62%	0.615	35%	0.351	S	S	*	.	H	α-helix	trans	-72.2	-43.6	-159.6	-56.3	-31.1	0	0	0	111.5	A661 H662	A661-D665 PolarHBondContact O-N 3.24Å; A661-D665 VanDerWaalsContact O-OD2 3.11Å; H662-D665 PolarHBondContact O-N 3.13Å
666	D	70.7	Confident	48.2	Very low	114 Å²	114	67.7 Å²	67.7	61%	0.61	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102	-9.8	-174.5	-62.4	-40.3	0	0	0	113.7	H662	H662-D666 IonicContact CE1-OD2 3.19Å; H662-D666 PolarHBondContact CE1-OD2 3.21Å; H662-D666 IonicContact CG-OD2 2.77Å; H662-D666 IonicContact ND1-OD2 3.56Å; H662-D666 PolarHBondContact ND1-OD2 2.91Å; H662-D666 PolarHBondContact O-N 3.38Å
667	H	59.6	Low	47.2	Very low	32 Å²	32	70 Å²	70	15%	0.148	37%	0.374	C	S	.	.	T	Hydrogen-bonded Turn	trans	-128.2	-1	-178.9	-57	-78.4	0	0	0	115.2	V648 H662 L663 G669 Q714	V648-H667 HydrophobicContact CB-CB 4.49Å; V648-H667 VanDerWaalsContact CG1-ND1 3.27Å; V648-H667 WeakPolarHBondContact CG1-ND1 3.4Å; V648-H667 HydrophobicContact CG2-CB 4.4Å; H662-H667 AromaticContact CD2-CD2 3.92Å; H662-H667 AromaticContact CD2-NE2 3.76Å; H662-H667 AromaticContact CE1-NE2 3.52Å; H662-H667 AromaticContact NE2-CD2 3.61Å; H662-H667 AromaticContact NE2-NE2 2.99Å; H662-H667 PolarHBondContact NE2-NE2 3.35Å; H662-H667 PolarHBondContact O-CD2 3.06Å; L663-H667 HydrophobicContact CD1-CB 4.25Å; H667-G669 VanDerWaalsContact C-N 3.29Å; H667-G669 PolarHBondContact O-N 3.5Å; H667-Q714 PolarHBondContact O-NE2 3.35Å
668	G	42.4	Very low	45.7	Very low	45 Å²	45	67.1 Å²	67.1	46%	0.464	38%	0.376	S	S	.	.			trans	71.4	17.7	-179	0	0	0	0	0	114.6	I664 T670	I664-G668 VanDerWaalsContact O-CA 3.26Å; I664-G668 WeakPolarHBondContact O-CA 3.35Å; I664-G668 PolarHBondContact O-N 3.21Å; G668-T670 PolarHBondContact O-N 2.78Å; G668-T670 VanDerWaalsContact O-N 3.13Å
669	G	43.6	Very low	44	Very low	5 Å²	5	67.4 Å²	67.4	5%	0.052	39%	0.386	C	S	.	.			trans	-69.7	103.3	-174.7	0	0	0	0	0	113.1	L663 I664 H667 I671	L663-G669 VanDerWaalsContact O-CA 3.23Å; L663-G669 WeakPolarHBondContact O-CA 3.32Å; L663-G669 PolarHBondContact O-N 3.23Å; I664-G669 WeakPolarHBondContact CA-O 3.44Å; I664-G669 WeakPolarHBondContact CG1-O 3.25Å; H667-G669 VanDerWaalsContact C-N 3.29Å; H667-G669 PolarHBondContact O-N 3.5Å; G669-I671 PolarHBondContact O-N 3.28Å
670	T	35.8	Very low	42.4	Very low	68 Å²	68	74.2 Å²	74.2	42%	0.417	42%	0.417	S	S	.	.			trans	-75.2	110.5	-173.8	57.9	0	0	0	0	113.5	G668 H672	G668-T670 PolarHBondContact O-N 2.78Å; G668-T670 VanDerWaalsContact O-N 3.13Å; T670-H672 PolarHBondContact O-N 3.02Å
671	I	37.8	Very low	41.2	Very low	98 Å²	98	78 Å²	78	50%	0.503	45%	0.445	S	S	.	.			trans	-71.8	98.2	166.6	-54.7	-178.6	0	0	0	109.5	I660 I664 G669 S673	I660-I671 HydrophobicContact CG2-CD1 3.35Å; I660-I671 HydrophobicContact CG2-CG1 4.29Å; I664-I671 HydrophobicContact CD1-CD1 3.47Å; I664-I671 VanDerWaalsContact CD1-CD1 3.47Å; I664-I671 HydrophobicContact CD1-CG1 3.85Å; I664-I671 HydrophobicContact CG1-CD1 4.03Å; I664-I671 HydrophobicContact CG1-CG1 3.88Å; G669-I671 PolarHBondContact O-N 3.28Å; I671-S673 PolarHBondContact O-N 3.35Å
672	H	32.4	Very low	39.8	Very low	74 Å²	74	80 Å²	80	34%	0.343	47%	0.469	S	S	.	.			trans	-66.7	123.7	165.6	-72.3	-2.6	0	0	0	110.6	T670 L674 T717	T670-H672 PolarHBondContact O-N 3.02Å; H672-L674 PolarHBondContact O-N 3.27Å; H672-L674 VanDerWaalsContact O-N 3.15Å; H672-T717 PolarHBondContact NE2-OG1 2.95Å
673	S	30.7	Very low	38	Very low	91 Å²	91	83.6 Å²	83.6	64%	0.636	50%	0.495	S	S	*	.			trans	-61.3	116.5	-179.8	-166.1	0	0	0	0	111.1	I671 Q675	I671-S673 PolarHBondContact O-N 3.35Å; S673-Q675 PolarHBondContact O-N 3.24Å
674	L	27	Very low	36.6	Very low	68 Å²	68	87 Å²	87	36%	0.356	52%	0.52	S	S	.	.			trans	-80.2	65.6	-169.6	-79.8	135.2	0	0	0	113	H672 F721 F733	H672-L674 PolarHBondContact O-N 3.27Å; H672-L674 VanDerWaalsContact O-N 3.15Å; L674-F721 HydrophobicContact CD2-CB 4.29Å; L674-F733 HydrophobicContact CB-CZ 4.26Å; L674-F733 HydrophobicContact CD1-CE1 3.75Å; L674-F733 HydrophobicContact CD1-CZ 3.56Å; L674-F733 HydrophobicContact CD2-CE1 4.1Å; L674-F733 HydrophobicContact CG-CE1 4.31Å; L674-F733 HydrophobicContact CG-CZ 4.3Å
675	Q	26.9	Very low	35.4	Very low	106 Å²	106	90.1 Å²	90.1	50%	0.495	54%	0.538	S	S	.	.			trans	-103.7	92.1	-179.3	-64.3	-155.3	46.2	0	0	113.6	S673 T677	S673-Q675 PolarHBondContact O-N 3.24Å; Q675-T677 PolarHBondContact O-N 2.99Å
676	K	28.3	Very low	33.7	Very low	140 Å²	140	89.1 Å²	89.1	61%	0.609	54%	0.536	S	S	*	.			trans	45.8	43	150.6	-65.2	-162.6	170.3	-161.4	0	117.9	K105	K105-K676 VanDerWaalsContact CE-O 3.23Å; K105-K676 WeakPolarHBondContact CE-O 3.09Å; K105-K676 PolarHBondContact NZ-O 3.32Å
677	T	27.7	Very low	32	Very low	84 Å²	84	89.7 Å²	89.7	52%	0.515	54%	0.539	S	S	.	.	P	Polyproline II helix	trans	-69.2	142.3	156.4	43.2	0	0	0	0	109.7	Q675 R723	Q675-T677 PolarHBondContact O-N 2.99Å; T677-R723 PolarHBondContact OG1-NE 2.75Å; T677-R723 PolarHBondContact OG1-NH1 2.73Å
678	S	25.7	Very low	31	Very low	85 Å²	85	89.2 Å²	89.2	59%	0.594	54%	0.538	S	S	*	.	P	Polyproline II helix	trans	-95.4	132	-179.7	29.3	0	0	0	0	108.5	K105	K105-S678 PolarHBondContact NZ-OG 3.43Å
679	C	26.4	Very low	30.8	Very low	87 Å²	87	91 Å²	91	59%	0.588	54%	0.536	S	S	*	.	P	Polyproline II helix	trans	-65.3	135.1	168.6	-53.4	0	0	0	0	109.1
680	Q	26.4	Very low	30.9	Very low	151 Å²	151	93.3 Å²	93.3	71%	0.706	55%	0.546	S	S	*	.	P	Polyproline II helix	trans	-71.1	142.4	156.2	-78.9	170	-58	0	0	108	G682	Q680-G682 PolarHBondContact O-N 2.68Å
681	P	26.5	Very low	31.5	Very low	133 Å²	133	93.6 Å²	93.6	86%	0.864	54%	0.544	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.2	119.3	156.6	29.9	-29.9	0	0	0	107.2
682	G	26.1	Very low	32.5	Very low	76 Å²	76	91 Å²	91	78%	0.784	54%	0.542	S	S	*	.	T	Hydrogen-bonded Turn	trans	126.2	-6.1	-178.2	0	0	0	0	0	116.1	Q680 S684	Q680-G682 PolarHBondContact O-N 2.68Å; G682-S684 PolarHBondContact O-N 3.46Å
683	C	29.2	Very low	34.5	Very low	93 Å²	93	90.2 Å²	90.2	63%	0.628	54%	0.542	S	S	*	.			trans	-69.7	112.7	165.6	-59.8	0	0	0	0	109.1
684	S	28.2	Very low	36.3	Very low	95 Å²	95	88.3 Å²	88.3	66%	0.664	53%	0.526	S	S	*	.			trans	-62.8	153.2	178.4	46.8	0	0	0	0	112.6	G682 T686	G682-S684 PolarHBondContact O-N 3.46Å; S684-T686 PolarHBondContact O-N 3.19Å
685	D	28.7	Very low	38.6	Very low	133 Å²	133	85 Å²	85	71%	0.711	51%	0.509	S	S	*	.			trans	-72.5	69.9	-179.6	-80.6	-73.7	0	0	0	112.5	L687 R722	D685-L687 PolarHBondContact O-N 3.1Å; D685-R722 IonicContact OD1-NH2 3.61Å
686	T	28.8	Very low	40.4	Very low	93 Å²	93	83.4 Å²	83.4	57%	0.571	51%	0.51	S	S	*	.			trans	-71.5	81.1	167.2	59.7	0	0	0	0	109.7	S684 V688	S684-T686 PolarHBondContact O-N 3.19Å; T686-V688 PolarHBondContact O-N 2.74Å
687	L	34.1	Very low	42.2	Very low	127 Å²	127	78.2 Å²	78.2	67%	0.665	49%	0.491	S	S	*	.			trans	-55.8	117.6	164.5	-74	167.2	0	0	0	108.6	D685 N689	D685-L687 PolarHBondContact O-N 3.1Å; L687-N689 PolarHBondContact O-N 3.16Å
688	V	39	Very low	44.4	Very low	21 Å²	21	76.7 Å²	76.7	13%	0.127	48%	0.483	C	S	.	.			trans	-78.2	111.9	169	-177.4	0	0	0	0	106.5	T686 F690 M712 K719 L720	T686-V688 PolarHBondContact O-N 2.74Å; V688-F690 HydrophobicContact CB-CE2 4.22Å; V688-F690 HydrophobicContact CG1-CE2 4.35Å; V688-F690 VanDerWaalsContact O-CD2 3.24Å; V688-F690 WeakPolarHBondContact O-CD2 3.14Å; V688-F690 PolarHBondContact O-N 2.91Å; V688-M712 HydrophobicContact CG1-CE 4.32Å; V688-M712 HydrophobicContact CG1-SD 3.86Å; V688-K719 HydrophobicContact CG2-CB 3.66Å; V688-K719 HydrophobicContact CG2-CD 4.37Å; V688-L720 HydrophobicContact CG1-CD2 3.92Å
689	N	37.1	Very low	46.9	Very low	82 Å²	82	83.3 Å²	83.3	44%	0.439	50%	0.495	S	S	.	.			trans	-75.6	105.2	178.7	-171.2	11.2	0	0	0	109.4	L687 L691 Y708	L687-N689 PolarHBondContact O-N 3.16Å; N689-L691 VanDerWaalsContact CG-O 3.29Å; N689-L691 PolarHBondContact ND2-O 2.59Å; N689-L691 VanDerWaalsContact ND2-O 3.14Å; N689-L691 PolarHBondContact O-N 2.82Å; N689-L691 PolarHBondContact OD1-N 3.36Å; N689-L691 PolarHBondContact OD1-O 2.86Å; N689-Y708 PolarHBondContact O-OH 3.46Å
690	F	47.2	Very low	49.4	Very low	55 Å²	55	82.1 Å²	82.1	24%	0.241	49%	0.485	C	S	.	.			trans	-75.6	-6.1	178.5	-73.5	-92.9	0	0	0	113.2	V688 L709 L720	V688-F690 HydrophobicContact CB-CE2 4.22Å; V688-F690 HydrophobicContact CG1-CE2 4.35Å; V688-F690 VanDerWaalsContact O-CD2 3.24Å; V688-F690 WeakPolarHBondContact O-CD2 3.14Å; V688-F690 PolarHBondContact O-N 2.91Å; F690-L709 HydrophobicContact CD1-CD2 4.06Å; F690-L720 HydrophobicContact CE1-CD1 4.34Å; F690-L720 HydrophobicContact CE1-CD2 3.83Å; F690-L720 HydrophobicContact CE1-CG 4.45Å; F690-L720 HydrophobicContact CZ-CB 4.06Å; F690-L720 HydrophobicContact CZ-CD2 3.65Å; F690-L720 HydrophobicContact CZ-CG 4.26Å
691	L	47.1	Very low	52.1	Low	74 Å²	74	79.7 Å²	79.7	39%	0.387	48%	0.477	S	S	.	.	S	Bend	trans	-99.7	138.3	175.4	-61.5	176.1	0	0	0	110.6	N689 L738	N689-L691 VanDerWaalsContact CG-O 3.29Å; N689-L691 PolarHBondContact ND2-O 2.59Å; N689-L691 VanDerWaalsContact ND2-O 3.14Å; N689-L691 PolarHBondContact O-N 2.82Å; N689-L691 PolarHBondContact OD1-N 3.36Å; N689-L691 PolarHBondContact OD1-O 2.86Å; L691-L738 HydrophobicContact CD1-CB 3.75Å; L691-L738 HydrophobicContact CD1-CD1 4.38Å; L691-L738 HydrophobicContact CG-CB 4.33Å
692	G	59.8	Low	54.8	Low	44 Å²	44	75.6 Å²	75.6	45%	0.454	45%	0.446	S	S	.	.	S	Bend	trans	101.2	-173.3	-175.9	0	0	0	0	0	113.6	Y708	G692-Y708 WeakPolarHBondContact O-CD1 3.13Å
693	T	73	Confident	57.3	Low	57 Å²	57	80 Å²	80	35%	0.35	45%	0.451	S	S	.	.	S	Bend	trans	-113.5	-13	-177.2	38.7	0	0	0	0	113.3	F702	T693-F702 WeakPolarHBondContact CB-O 3.32Å; T693-F702 WeakPolarHBondContact CG2-O 3.15Å; T693-F702 WeakPolarHBondContact O-CD2 3.49Å; T693-F702 PolarHBondContact O-N 3.24Å
694	T	70.2	Confident	59.4	Low	50 Å²	50	77.5 Å²	77.5	31%	0.307	44%	0.435	S	S	.	.	S	Bend	trans	-90.4	128.4	-175	-48.8	0	0	0	0	113.1	S696 D701	T694-S696 PolarHBondContact O-N 2.91Å; T694-S696 VanDerWaalsContact O-N 3.08Å; T694-D701 WeakPolarHBondContact CA-OD1 3.27Å; T694-D701 WeakPolarHBondContact CB-OD1 3.26Å; T694-D701 WeakPolarHBondContact CG2-OD1 3.13Å; T694-D701 PolarHBondContact OG1-OD1 2.89Å
695	C	75.5	Confident	61	Low	0 Å²	0	77.5 Å²	77.5	0%	0	43%	0.425	C	S	.	.			trans	-70.1	97.4	171.4	179.1	0	0	0	0	113.1	S697 C698 R699 T700 F702 H711 M712 H716	C695-S697 PolarHBondContact O-N 3.08Å; C695-C698 HydrophobicContact CB-CB 4.35Å; C695-C698 WeakPolarHBondContact CB-SG 3.38Å; C695-C698 PolarHBondContact O-N 3.43Å; C695-C698 VanDerWaalsContact O-N 3.16Å; C695-C698 VanDerWaalsContact SG-CA 3.57Å; C695-C698 WeakPolarHBondContact SG-CB 3.3Å; C695-C698 PolarHBondContact SG-N 3.44Å; C695-C698 CovalentContact SG-SG 2.05Å; C695-C698 PolarHBondContact SG-SG 2.6Å; C695-R699 VanDerWaalsContact O-CA 3.32Å; C695-R699 WeakPolarHBondContact O-CA 3.48Å; C695-R699 PolarHBondContact O-N 3.23Å; C695-T700 WeakPolarHBondContact CB-O 3.46Å; C695-T700 PolarHBondContact N-O 2.96Å; C695-F702 HydrophobicContact CB-CE2 4.26Å; C695-H711 PolarHBondContact SG-NE2 2.81Å; C695-M712 HydrophobicContact CB-CE 4.16Å; C695-H716 PolarHBondContact SG-NE2 3.06Å
696	S	64.3	Low	62.8	Low	72 Å²	72	74 Å²	74	50%	0.503	41%	0.409	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.1	-15	173.4	73	0	0	0	0	114.7	T694	T694-S696 PolarHBondContact O-N 2.91Å; T694-S696 VanDerWaalsContact O-N 3.08Å
697	S	64.7	Low	64.9	Low	31 Å²	31	71.4 Å²	71.4	22%	0.217	39%	0.393	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98	-12.9	-176.7	-69.9	0	0	0	0	115.4	C695 H716 K719	C695-S697 PolarHBondContact O-N 3.08Å; S697-H716 VanDerWaalsContact CB-NE2 3.32Å; S697-H716 WeakPolarHBondContact CB-NE2 3.46Å; S697-K719 VanDerWaalsContact CB-NZ 3.29Å; S697-K719 VanDerWaalsContact OG-CD 3.28Å; S697-K719 WeakPolarHBondContact OG-CD 3.49Å; S697-K719 WeakPolarHBondContact OG-CE 3.4Å; S697-K719 PolarHBondContact OG-NZ 3.43Å
698	C	75.3	Confident	66.8	Low	51 Å²	51	65.4 Å²	65.4	35%	0.345	36%	0.362	S	S	.	.	T	Hydrogen-bonded Turn	trans	-155	-4.1	-168.8	68	0	0	0	0	114.4	C695 T700 H711 H716	C695-C698 HydrophobicContact CB-CB 4.35Å; C695-C698 WeakPolarHBondContact CB-SG 3.38Å; C695-C698 PolarHBondContact O-N 3.43Å; C695-C698 VanDerWaalsContact O-N 3.16Å; C695-C698 VanDerWaalsContact SG-CA 3.57Å; C695-C698 WeakPolarHBondContact SG-CB 3.3Å; C695-C698 PolarHBondContact SG-N 3.44Å; C695-C698 CovalentContact SG-SG 2.05Å; C695-C698 PolarHBondContact SG-SG 2.6Å; C698-T700 PolarHBondContact O-N 3.24Å; C698-T700 PolarHBondContact SG-OG1 3.4Å; C698-H711 PolarHBondContact SG-CE1 3.19Å; C698-H711 PolarHBondContact SG-NE2 3.34Å; C698-H716 PolarHBondContact SG-NE2 2.79Å
699	R	77.2	Confident	67.8	Low	225 Å²	225	65.4 Å²	65.4	85%	0.849	36%	0.361	S	S	*	.			trans	59.3	18.4	176.1	-55.4	-176.5	-179.6	-177.2	-0.9	116.2	C695	C695-R699 VanDerWaalsContact O-CA 3.32Å; C695-R699 WeakPolarHBondContact O-CA 3.48Å; C695-R699 PolarHBondContact O-N 3.23Å
700	T	79.9	Confident	69.1	Low	62 Å²	62	66.7 Å²	66.7	38%	0.38	36%	0.36	S	S	.	.			trans	-83.5	130.8	166.4	58.5	0	0	0	0	110.5	C695 C698 F702	C695-T700 WeakPolarHBondContact CB-O 3.46Å; C695-T700 PolarHBondContact N-O 2.96Å; C698-T700 PolarHBondContact O-N 3.24Å; C698-T700 PolarHBondContact SG-OG1 3.4Å; T700-F702 WeakPolarHBondContact O-CE2 3.21Å; T700-F702 WeakPolarHBondContact OG1-CE2 3.45Å; T700-F702 VanDerWaalsContact OG1-CZ 3.24Å; T700-F702 WeakPolarHBondContact OG1-CZ 3.47Å
701	D	81.5	Confident	70.4	Confident	100 Å²	100	64.8 Å²	64.8	54%	0.535	35%	0.351	S	S	.	.			trans	-83.9	163.6	166.6	-61.8	-63.9	0	0	0	111.1	T694	T694-D701 WeakPolarHBondContact CA-OD1 3.27Å; T694-D701 WeakPolarHBondContact CB-OD1 3.26Å; T694-D701 WeakPolarHBondContact CG2-OD1 3.13Å; T694-D701 PolarHBondContact OG1-OD1 2.89Å
702	F	83.4	Confident	71.3	Confident	47 Å²	47	61.3 Å²	61.3	21%	0.206	33%	0.333	C	S	.	.			trans	-143.1	141.8	-178.7	-67.1	-80.1	0	0	0	110.4	T693 C695 T700 S704 Y708 H711	T693-F702 WeakPolarHBondContact CB-O 3.32Å; T693-F702 WeakPolarHBondContact CG2-O 3.15Å; T693-F702 WeakPolarHBondContact O-CD2 3.49Å; T693-F702 PolarHBondContact O-N 3.24Å; C695-F702 HydrophobicContact CB-CE2 4.26Å; T700-F702 WeakPolarHBondContact O-CE2 3.21Å; T700-F702 WeakPolarHBondContact OG1-CE2 3.45Å; T700-F702 VanDerWaalsContact OG1-CZ 3.24Å; T700-F702 WeakPolarHBondContact OG1-CZ 3.47Å; F702-S704 PolarHBondContact O-N 3.14Å; F702-Y708 AromaticContact CD2-CD2 3.89Å; F702-Y708 HydrophobicContact CD2-CD2 3.89Å; F702-Y708 HydrophobicContact CE2-CD2 4.37Å; F702-H711 HydrophobicContact CD1-CB 4.48Å; F702-H711 HydrophobicContact CE1-CB 3.79Å; F702-H711 HydrophobicContact CE2-CB 3.8Å; F702-H711 AromaticContact CE2-CD2 3.57Å; F702-H711 AromaticContact CE2-CG 3.49Å; F702-H711 VanDerWaalsContact CE2-CG 3.49Å; F702-H711 AromaticContact CE2-ND1 3.98Å; F702-H711 HydrophobicContact CZ-CB 3.42Å; F702-H711 VanDerWaalsContact CZ-CB 3.42Å; F702-H711 AromaticContact CZ-CD2 3.75Å; F702-H711 AromaticContact CZ-CE1 3.94Å; F702-H711 AromaticContact CZ-CG 3.18Å; F702-H711 AromaticContact CZ-ND1 3.35Å; F702-H711 WeakPolarHBondContact CZ-ND1 3.17Å
703	D	78.2	Confident	71.4	Confident	167 Å²	167	60.6 Å²	60.6	89%	0.893	32%	0.317	S	S	*	.	S	Bend	trans	-67.7	-12.6	-172.5	-34.4	-71.5	0	0	0	113.8
704	S	73.7	Confident	70.7	Confident	42 Å²	42	62.7 Å²	62.7	29%	0.294	32%	0.323	S	S	.	.	S	Bend	trans	-153.3	155.2	-177	78.9	0	0	0	0	112.8	F702 P706 T707 Y708	F702-S704 PolarHBondContact O-N 3.14Å; S704-P706 WeakPolarHBondContact OG-CD 3.41Å; S704-T707 PolarHBondContact N-OG1 3.23Å; S704-T707 PolarHBondContact O-N 3.12Å; S704-T707 PolarHBondContact O-OG1 3.41Å; S704-T707 PolarHBondContact OG-N 3.13Å; S704-T707 VanDerWaalsContact OG-N 3.13Å; S704-T707 PolarHBondContact OG-OG1 3.31Å; S704-Y708 PolarHBondContact O-N 3.1Å
705	Q	63	Low	70.4	Confident	95 Å²	95	69.8 Å²	69.8	44%	0.444	35%	0.345	S	S	.	.	H	α-helix	trans	-61.1	-38.2	173.7	-165.1	-177.8	18.6	0	0	112.9	T707 Y708 L709	Q705-T707 PolarHBondContact O-N 2.95Å; Q705-Y708 PolarHBondContact O-N 3.17Å; Q705-L709 HydrophobicContact CG-CD1 4.05Å; Q705-L709 HydrophobicContact CG-CG 4.3Å; Q705-L709 WeakPolarHBondContact O-CB 3.17Å; Q705-L709 VanDerWaalsContact O-CG 3.3Å; Q705-L709 WeakPolarHBondContact O-CG 3.44Å; Q705-L709 PolarHBondContact O-N 3.47Å
706	P	66.3	Low	69.8	Low	60 Å²	60	71.2 Å²	71.2	39%	0.39	35%	0.351	S	S	.	.	H	α-helix	trans	-60.8	-39.5	171.5	-28.2	37.2	0	0	0	114.6	S704 R710	S704-P706 WeakPolarHBondContact OG-CD 3.41Å; P706-R710 VanDerWaalsContact O-CB 3.24Å; P706-R710 WeakPolarHBondContact O-CB 3.28Å; P706-R710 PolarHBondContact O-N 3.25Å
707	T	71.5	Confident	69.1	Low	38 Å²	38	68.1 Å²	68.1	23%	0.233	33%	0.329	C	S	.	.	H	α-helix	trans	-69.9	-39.8	175.6	42.9	0	0	0	0	111.7	S704 Q705 R710 H711	S704-T707 PolarHBondContact N-OG1 3.23Å; S704-T707 PolarHBondContact O-N 3.12Å; S704-T707 PolarHBondContact O-OG1 3.41Å; S704-T707 PolarHBondContact OG-N 3.13Å; S704-T707 VanDerWaalsContact OG-N 3.13Å; S704-T707 PolarHBondContact OG-OG1 3.31Å; Q705-T707 PolarHBondContact O-N 2.95Å; T707-R710 PolarHBondContact O-N 2.8Å; T707-H711 WeakPolarHBondContact O-CB 3.25Å; T707-H711 PolarHBondContact O-N 2.79Å
708	Y	75.1	Confident	68	Low	1 Å²	1	75.7 Å²	75.7	0%	0.004	35%	0.353	C	S	.	.	H	α-helix	trans	-58.3	-49	171.1	172.1	-117.1	0	0	0	112.9	N689 G692 F702 S704 Q705 H711 M712	N689-Y708 PolarHBondContact O-OH 3.46Å; G692-Y708 WeakPolarHBondContact O-CD1 3.13Å; F702-Y708 AromaticContact CD2-CD2 3.89Å; F702-Y708 HydrophobicContact CD2-CD2 3.89Å; F702-Y708 HydrophobicContact CE2-CD2 4.37Å; S704-Y708 PolarHBondContact O-N 3.1Å; Q705-Y708 PolarHBondContact O-N 3.17Å; Y708-H711 WeakPolarHBondContact O-CB 3.33Å; Y708-H711 PolarHBondContact O-N 3.04Å; Y708-M712 HydrophobicContact CD2-CG 4.37Å; Y708-M712 HydrophobicContact CE1-CG 4.42Å; Y708-M712 HydrophobicContact CE2-CE 3.57Å; Y708-M712 HydrophobicContact CE2-CG 3.78Å; Y708-M712 PolarHBondContact O-N 3.41Å; Y708-M712 WeakPolarHBondContact OH-CE 3.26Å
709	L	60.7	Low	66.6	Low	20 Å²	20	77.6 Å²	77.6	11%	0.105	36%	0.355	C	S	.	.	H	α-helix	trans	-66.3	-42.1	178.7	-71.4	173.6	0	0	0	111.4	P647 F690 Q705 H711 M712 F713	P647-L709 VanDerWaalsContact O-CD1 3.28Å; P647-L709 WeakPolarHBondContact O-CD1 3.3Å; F690-L709 HydrophobicContact CD1-CD2 4.06Å; Q705-L709 HydrophobicContact CG-CD1 4.05Å; Q705-L709 HydrophobicContact CG-CG 4.3Å; Q705-L709 WeakPolarHBondContact O-CB 3.17Å; Q705-L709 VanDerWaalsContact O-CG 3.3Å; Q705-L709 WeakPolarHBondContact O-CG 3.44Å; Q705-L709 PolarHBondContact O-N 3.47Å; L709-H711 VanDerWaalsContact C-N 3.34Å; L709-H711 PolarHBondContact O-N 3.09Å; L709-M712 PolarHBondContact O-N 3.34Å; L709-M712 VanDerWaalsContact O-N 3.15Å; L709-F713 HydrophobicContact CB-CD2 4.44Å; L709-F713 HydrophobicContact CB-CE2 4.5Å; L709-F713 WeakPolarHBondContact O-CD2 3.5Å; L709-F713 PolarHBondContact O-N 2.86Å
710	R	64.3	Low	64.9	Low	110 Å²	110	67.5 Å²	67.5	42%	0.415	32%	0.318	S	S	.	.	H	α-helix	trans	-55.2	-48.9	172.4	-177.6	-173.4	-64.1	158.5	0.9	110.9	V648 P706 T707 M712 F713 Q714	V648-R710 HydrophobicContact CG1-CB 4.26Å; P706-R710 VanDerWaalsContact O-CB 3.24Å; P706-R710 WeakPolarHBondContact O-CB 3.28Å; P706-R710 PolarHBondContact O-N 3.25Å; T707-R710 PolarHBondContact O-N 2.8Å; R710-M712 PolarHBondContact O-N 3.35Å; R710-F713 CarbonylContact O-C 3.4Å; R710-F713 PolarHBondContact O-N 3.21Å; R710-Q714 WeakPolarHBondContact O-CB 3.32Å; R710-Q714 VanDerWaalsContact O-CG 3.28Å; R710-Q714 WeakPolarHBondContact O-CG 3.46Å; R710-Q714 PolarHBondContact O-N 3.43Å
711	H	73.4	Confident	63	Low	15 Å²	15	67.4 Å²	67.4	7%	0.069	31%	0.313	C	S	.	.	H	α-helix	trans	-57.8	-46.6	174.8	162.1	86.2	0	0	0	111.9	C695 C698 F702 T707 Y708 L709 F713 Q714 R715 H716	C695-H711 PolarHBondContact SG-NE2 2.81Å; C698-H711 PolarHBondContact SG-CE1 3.19Å; C698-H711 PolarHBondContact SG-NE2 3.34Å; F702-H711 HydrophobicContact CD1-CB 4.48Å; F702-H711 HydrophobicContact CE1-CB 3.79Å; F702-H711 HydrophobicContact CE2-CB 3.8Å; F702-H711 AromaticContact CE2-CD2 3.57Å; F702-H711 AromaticContact CE2-CG 3.49Å; F702-H711 VanDerWaalsContact CE2-CG 3.49Å; F702-H711 AromaticContact CE2-ND1 3.98Å; F702-H711 HydrophobicContact CZ-CB 3.42Å; F702-H711 VanDerWaalsContact CZ-CB 3.42Å; F702-H711 AromaticContact CZ-CD2 3.75Å; F702-H711 AromaticContact CZ-CE1 3.94Å; F702-H711 AromaticContact CZ-CG 3.18Å; F702-H711 AromaticContact CZ-ND1 3.35Å; F702-H711 WeakPolarHBondContact CZ-ND1 3.17Å; T707-H711 WeakPolarHBondContact O-CB 3.25Å; T707-H711 PolarHBondContact O-N 2.79Å; Y708-H711 WeakPolarHBondContact O-CB 3.33Å; Y708-H711 PolarHBondContact O-N 3.04Å; L709-H711 VanDerWaalsContact C-N 3.34Å; L709-H711 PolarHBondContact O-N 3.09Å; H711-F713 VanDerWaalsContact C-N 3.35Å; H711-F713 PolarHBondContact O-N 2.86Å; H711-Q714 PolarHBondContact O-N 3.33Å; H711-Q714 VanDerWaalsContact O-N 3.14Å; H711-R715 PolarHBondContact O-N 3.24Å; H711-H716 AromaticContact NE2-CD2 3.32Å; H711-H716 PolarHBondContact NE2-CD2 3.15Å; H711-H716 VanDerWaalsContact NE2-CD2 3.32Å; H711-H716 AromaticContact NE2-NE2 3.51Å
712	M	66.8	Low	60.9	Low	0 Å²	0	69.3 Å²	69.3	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-61	-41.4	177.5	-80.2	-68.8	162.7	0	0	112.2	V688 C695 Y708 L709 R710 Q714 H716 T717 L720	V688-M712 HydrophobicContact CG1-CE 4.32Å; V688-M712 HydrophobicContact CG1-SD 3.86Å; C695-M712 HydrophobicContact CB-CE 4.16Å; Y708-M712 HydrophobicContact CD2-CG 4.37Å; Y708-M712 HydrophobicContact CE1-CG 4.42Å; Y708-M712 HydrophobicContact CE2-CE 3.57Å; Y708-M712 HydrophobicContact CE2-CG 3.78Å; Y708-M712 PolarHBondContact O-N 3.41Å; Y708-M712 WeakPolarHBondContact OH-CE 3.26Å; L709-M712 PolarHBondContact O-N 3.34Å; L709-M712 VanDerWaalsContact O-N 3.15Å; R710-M712 PolarHBondContact O-N 3.35Å; M712-Q714 VanDerWaalsContact C-N 3.3Å; M712-Q714 PolarHBondContact O-N 3.14Å; M712-H716 CarbonylContact O-C 3.18Å; M712-H716 VanDerWaalsContact O-CA 3.32Å; M712-H716 WeakPolarHBondContact O-CA 3.24Å; M712-H716 PolarHBondContact O-N 2.75Å; M712-H716 HydrophobicContact SD-CB 3.61Å; M712-T717 PolarHBondContact O-N 3.28Å; M712-T717 VanDerWaalsContact O-N 3.08Å; M712-L720 HydrophobicContact CB-CD1 4.35Å; M712-L720 HydrophobicContact CB-CD2 4.19Å; M712-L720 HydrophobicContact SD-CD2 4.12Å
713	F	60.4	Low	58.5	Low	29 Å²	29	73.5 Å²	73.5	13%	0.127	33%	0.327	C	S	.	.	H	α-helix	trans	-75.4	-10.1	176.1	-75.6	-65.1	0	0	0	114.8	P647 V648 L663 L709 R710 H711 T717 L720	P647-F713 HydrophobicContact CB-CE2 3.89Å; P647-F713 HydrophobicContact CB-CZ 4.31Å; P647-F713 HydrophobicContact CG-CD2 4.35Å; P647-F713 HydrophobicContact CG-CE2 3.47Å; P647-F713 VanDerWaalsContact CG-CE2 3.47Å; P647-F713 HydrophobicContact CG-CZ 3.67Å; V648-F713 HydrophobicContact CG2-CD2 4.14Å; L663-F713 HydrophobicContact CD2-CD1 4.2Å; L663-F713 HydrophobicContact CD2-CE1 4.11Å; L709-F713 HydrophobicContact CB-CD2 4.44Å; L709-F713 HydrophobicContact CB-CE2 4.5Å; L709-F713 WeakPolarHBondContact O-CD2 3.5Å; L709-F713 PolarHBondContact O-N 2.86Å; R710-F713 CarbonylContact O-C 3.4Å; R710-F713 PolarHBondContact O-N 3.21Å; H711-F713 VanDerWaalsContact C-N 3.35Å; H711-F713 PolarHBondContact O-N 2.86Å; F713-T717 WeakPolarHBondContact O-CG2 3.41Å; F713-L720 HydrophobicContact CD1-CD1 3.6Å; F713-L720 HydrophobicContact CE1-CD1 3.65Å; F713-L720 HydrophobicContact CG-CD1 4.18Å; F713-L720 HydrophobicContact CZ-CD1 4.27Å
714	Q	60.1	Low	56.2	Low	102 Å²	102	69.7 Å²	69.7	48%	0.477	31%	0.306	S	S	.	.	H	α-helix	trans	-103.5	-52.2	175.7	-71.7	175.1	-8.9	0	0	112.3	H667 R710 H711 M712	H667-Q714 PolarHBondContact O-NE2 3.35Å; R710-Q714 WeakPolarHBondContact O-CB 3.32Å; R710-Q714 VanDerWaalsContact O-CG 3.28Å; R710-Q714 WeakPolarHBondContact O-CG 3.46Å; R710-Q714 PolarHBondContact O-N 3.43Å; H711-Q714 PolarHBondContact O-N 3.33Å; H711-Q714 VanDerWaalsContact O-N 3.14Å; M712-Q714 VanDerWaalsContact C-N 3.3Å; M712-Q714 PolarHBondContact O-N 3.14Å
715	R	63	Low	54.2	Low	199 Å²	199	72.7 Å²	72.7	75%	0.751	32%	0.324	S	S	*	.	H	α-helix	trans	-94.4	-20.1	-176.1	-66.5	-166.1	174.9	-161.7	-1.9	114.5	H711	H711-R715 PolarHBondContact O-N 3.24Å
716	H	63	Low	52.6	Low	30 Å²	30	71.5 Å²	71.5	14%	0.139	32%	0.324	C	S	.	.			trans	-129.6	12.8	-167.3	-66.7	-28.1	0	0	0	116.7	C695 S697 C698 H711 M712 R718 K719 L720	C695-H716 PolarHBondContact SG-NE2 3.06Å; S697-H716 VanDerWaalsContact CB-NE2 3.32Å; S697-H716 WeakPolarHBondContact CB-NE2 3.46Å; C698-H716 PolarHBondContact SG-NE2 2.79Å; H711-H716 AromaticContact NE2-CD2 3.32Å; H711-H716 PolarHBondContact NE2-CD2 3.15Å; H711-H716 VanDerWaalsContact NE2-CD2 3.32Å; H711-H716 AromaticContact NE2-NE2 3.51Å; M712-H716 CarbonylContact O-C 3.18Å; M712-H716 VanDerWaalsContact O-CA 3.32Å; M712-H716 WeakPolarHBondContact O-CA 3.24Å; M712-H716 PolarHBondContact O-N 2.75Å; M712-H716 HydrophobicContact SD-CB 3.61Å; H716-R718 PolarHBondContact O-N 3.26Å; H716-K719 PolarHBondContact O-N 2.88Å; H716-L720 PolarHBondContact O-N 3.36Å
717	T	50.3	Low	50.8	Low	6 Å²	6	74.5 Å²	74.5	4%	0.037	34%	0.335	C	S	.	.	H	α-helix	trans	-42.4	-40.4	173.7	56.4	0	0	0	0	114.1	H672 M712 F713 K719 L720 F721	H672-T717 PolarHBondContact NE2-OG1 2.95Å; M712-T717 PolarHBondContact O-N 3.28Å; M712-T717 VanDerWaalsContact O-N 3.08Å; F713-T717 WeakPolarHBondContact O-CG2 3.41Å; T717-K719 PolarHBondContact O-N 3.29Å; T717-L720 PolarHBondContact O-N 3.47Å; T717-L720 VanDerWaalsContact O-N 3.11Å; T717-F721 VanDerWaalsContact O-CD2 3.25Å; T717-F721 WeakPolarHBondContact O-CD2 3.47Å; T717-F721 PolarHBondContact O-N 3.33Å
718	R	41.4	Very low	48.7	Very low	191 Å²	191	80.7 Å²	80.7	72%	0.721	36%	0.361	S	S	*	.	H	α-helix	trans	-57.9	-25.6	177.6	-68.7	179.9	176.4	-166.9	-0.7	114.7	H716	H716-R718 PolarHBondContact O-N 3.26Å
719	K	45.4	Very low	46.4	Very low	90 Å²	90	86.7 Å²	86.7	39%	0.391	40%	0.404	S	S	.	.	H	α-helix	trans	-92.8	-31.9	174.5	-61.8	-169.7	-179.5	-171.4	0	112.4	V688 S697 H716 T717 F721	V688-K719 HydrophobicContact CG2-CB 3.66Å; V688-K719 HydrophobicContact CG2-CD 4.37Å; S697-K719 VanDerWaalsContact CB-NZ 3.29Å; S697-K719 VanDerWaalsContact OG-CD 3.28Å; S697-K719 WeakPolarHBondContact OG-CD 3.49Å; S697-K719 WeakPolarHBondContact OG-CE 3.4Å; S697-K719 PolarHBondContact OG-NZ 3.43Å; H716-K719 PolarHBondContact O-N 2.88Å; T717-K719 PolarHBondContact O-N 3.29Å; K719-F721 VanDerWaalsContact C-N 3.34Å; K719-F721 PolarHBondContact O-N 3.1Å
720	L	41.5	Very low	44.8	Very low	14 Å²	14	92.5 Å²	92.5	7%	0.073	43%	0.428	C	S	.	.	H	α-helix	trans	-64	-37.6	-178.5	-45.9	-172.6	0	0	0	112.4	V688 F690 M712 F713 H716 T717 R722	V688-L720 HydrophobicContact CG1-CD2 3.92Å; F690-L720 HydrophobicContact CE1-CD1 4.34Å; F690-L720 HydrophobicContact CE1-CD2 3.83Å; F690-L720 HydrophobicContact CE1-CG 4.45Å; F690-L720 HydrophobicContact CZ-CB 4.06Å; F690-L720 HydrophobicContact CZ-CD2 3.65Å; F690-L720 HydrophobicContact CZ-CG 4.26Å; M712-L720 HydrophobicContact CB-CD1 4.35Å; M712-L720 HydrophobicContact CB-CD2 4.19Å; M712-L720 HydrophobicContact SD-CD2 4.12Å; F713-L720 HydrophobicContact CD1-CD1 3.6Å; F713-L720 HydrophobicContact CE1-CD1 3.65Å; F713-L720 HydrophobicContact CG-CD1 4.18Å; F713-L720 HydrophobicContact CZ-CD1 4.27Å; H716-L720 PolarHBondContact O-N 3.36Å; T717-L720 PolarHBondContact O-N 3.47Å; T717-L720 VanDerWaalsContact O-N 3.11Å; L720-R722 PolarHBondContact O-N 3.21Å
721	F	40.3	Very low	43.1	Very low	60 Å²	60	89.2 Å²	89.2	26%	0.263	42%	0.418	S	S	.	.	S	Bend	trans	-88	88.2	-177.1	-64.1	-65.8	0	0	0	113	L674 T717 K719 R723	L674-F721 HydrophobicContact CD2-CB 4.29Å; T717-F721 VanDerWaalsContact O-CD2 3.25Å; T717-F721 WeakPolarHBondContact O-CD2 3.47Å; T717-F721 PolarHBondContact O-N 3.33Å; K719-F721 VanDerWaalsContact C-N 3.34Å; K719-F721 PolarHBondContact O-N 3.1Å; F721-R723 PolarHBondContact O-N 3.07Å
722	R	37.4	Very low	40.9	Very low	139 Å²	139	92 Å²	92	53%	0.525	43%	0.433	S	S	.	.			trans	-54.1	121	172.6	-123.8	177.1	178.3	175.4	-1.4	110.5	D685 L720 L724	D685-R722 IonicContact OD1-NH2 3.61Å; L720-R722 PolarHBondContact O-N 3.21Å; R722-L724 PolarHBondContact O-N 3.22Å
723	R	32.8	Very low	39.3	Very low	135 Å²	135	93.4 Å²	93.4	51%	0.509	44%	0.439	S	S	.	.			trans	-78.7	77	-169.1	-64.7	-179.8	-177.3	168.5	0.6	113.3	T677 F721	T677-R723 PolarHBondContact OG1-NE 2.75Å; T677-R723 PolarHBondContact OG1-NH1 2.73Å; F721-R723 PolarHBondContact O-N 3.07Å
724	L	30.7	Very low	37.8	Very low	88 Å²	88	92.8 Å²	92.8	46%	0.461	44%	0.441	S	S	.	.			trans	-68.2	137.6	174.9	-74.6	169.4	0	0	0	112.4	R722 V726 I732	R722-L724 PolarHBondContact O-N 3.22Å; L724-V726 PolarHBondContact O-N 2.87Å; L724-I732 HydrophobicContact CD1-CG2 4.44Å; L724-I732 VanDerWaalsContact CD1-O 3.25Å; L724-I732 WeakPolarHBondContact CD1-O 3.4Å
725	P	31.8	Very low	36.7	Very low	104 Å²	104	89.7 Å²	89.7	68%	0.675	43%	0.429	S	S	*	.			trans	-74	122.5	-176.6	28.6	-34.1	0	0	0	112	I727	P725-I727 PolarHBondContact O-N 3.42Å
726	V	28.4	Very low	35	Very low	71 Å²	71	82.1 Å²	82.1	43%	0.43	41%	0.405	S	S	.	.			trans	-70.1	91.9	178.5	-174.6	0	0	0	0	111.3	L724 L731	L724-V726 PolarHBondContact O-N 2.87Å; V726-L731 HydrophobicContact CG2-CG 4.37Å
727	I	27.5	Very low	33.4	Very low	122 Å²	122	84.2 Å²	84.2	63%	0.626	42%	0.42	S	S	*	.			trans	-79.5	147.3	166	-58.6	175.6	0	0	0	108.8	P725 S729 K730	P725-I727 PolarHBondContact O-N 3.42Å; I727-S729 PolarHBondContact O-N 2.81Å; I727-K730 PolarHBondContact O-N 2.86Å
728	Q	27.5	Very low	32.3	Very low	168 Å²	168	87.6 Å²	87.6	79%	0.785	44%	0.437	S	S	*	.	T	Hydrogen-bonded Turn	trans	-18.4	110	-179	-67.1	173.9	-43.5	0	0	116	K730	Q728-K730 PolarHBondContact O-N 2.81Å
729	S	28.2	Very low	31.6	Very low	128 Å²	128	81.2 Å²	81.2	90%	0.895	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	51	17.5	167.7	47	0	0	0	0	117.7	I727	I727-S729 PolarHBondContact O-N 2.81Å
730	K	26.1	Very low	31	Very low	142 Å²	142	81.9 Å²	81.9	62%	0.617	43%	0.433	S	S	*	.			trans	-128.6	117.5	172.4	-65.3	-176	-179.5	-177.1	0	109.5	I727 Q728	I727-K730 PolarHBondContact O-N 2.86Å; Q728-K730 PolarHBondContact O-N 2.81Å
731	L	29	Very low	30.3	Very low	40 Å²	40	90.1 Å²	90.1	21%	0.209	47%	0.465	C	S	.	.			trans	-107.4	103.6	179.3	-142.7	169.1	0	0	0	107.8	V726 F733 I751	V726-L731 HydrophobicContact CG2-CG 4.37Å; L731-F733 HydrophobicContact CD2-CD2 4.12Å; L731-F733 HydrophobicContact CD2-CE1 3.88Å; L731-F733 HydrophobicContact CD2-CE2 3.44Å; L731-F733 VanDerWaalsContact CD2-CE2 3.44Å; L731-F733 HydrophobicContact CD2-CZ 3.28Å; L731-I751 WeakPolarHBondContact CB-O 3.34Å; L731-I751 PolarHBondContact O-N 3.35Å
732	I	27.6	Very low	29.8	Very low	75 Å²	75	92.6 Å²	92.6	39%	0.385	49%	0.49	S	S	.	.	B	Isolated β-bridge	trans	-103	116.3	-178.8	-57.3	173.9	0	0	0	107.2	L724 R748	L724-I732 HydrophobicContact CD1-CG2 4.44Å; L724-I732 VanDerWaalsContact CD1-O 3.25Å; L724-I732 WeakPolarHBondContact CD1-O 3.4Å; I732-R748 HydrophobicContact CG2-CG 4.48Å
733	F	33.2	Very low	29.5	Very low	28 Å²	28	92.4 Å²	92.4	12%	0.123	50%	0.495	C	S	.	.			trans	-95.9	142	154.4	-61.4	-65	0	0	0	109.1	L674 L731 R748 I749 I751	L674-F733 HydrophobicContact CB-CZ 4.26Å; L674-F733 HydrophobicContact CD1-CE1 3.75Å; L674-F733 HydrophobicContact CD1-CZ 3.56Å; L674-F733 HydrophobicContact CD2-CE1 4.1Å; L674-F733 HydrophobicContact CG-CE1 4.31Å; L674-F733 HydrophobicContact CG-CZ 4.3Å; L731-F733 HydrophobicContact CD2-CD2 4.12Å; L731-F733 HydrophobicContact CD2-CE1 3.88Å; L731-F733 HydrophobicContact CD2-CE2 3.44Å; L731-F733 VanDerWaalsContact CD2-CE2 3.44Å; L731-F733 HydrophobicContact CD2-CZ 3.28Å; F733-R748 WeakPolarHBondContact O-CA 3.28Å; F733-I749 HydrophobicContact CB-CB 4.19Å; F733-I749 HydrophobicContact CD2-CB 4.31Å; F733-I749 HydrophobicContact CD2-CG2 4.48Å; F733-I749 PolarHBondContact N-O 3.44Å; F733-I749 VanDerWaalsContact N-O 3.08Å; F733-I749 PolarHBondContact O-N 2.92Å; F733-I751 HydrophobicContact CD2-CD1 4.39Å; F733-I751 HydrophobicContact CD2-CG1 4.31Å; F733-I751 HydrophobicContact CE2-CD1 3.76Å; F733-I751 HydrophobicContact CE2-CG1 3.98Å
734	G	29.3	Very low	29.3	Very low	17 Å²	17	91.5 Å²	91.5	18%	0.175	50%	0.497	C	S	.	.			trans	-127.2	118.5	157	0	0	0	0	0	106.8	L747	G734-L747 WeakPolarHBondContact CA-O 3.3Å
735	T	35.7	Very low	29.1	Very low	37 Å²	37	91.8 Å²	91.8	23%	0.227	50%	0.496	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	118.6	163.4	47.5	0	0	0	0	107.1	V737 L747	T735-V737 PolarHBondContact O-N 2.69Å; T735-L747 PolarHBondContact N-O 2.85Å; T735-L747 VanDerWaalsContact N-O 3.14Å; T735-L747 PolarHBondContact O-N 2.94Å; T735-L747 VanDerWaalsContact O-N 3.13Å
736	T	28	Very low	29.1	Very low	39 Å²	39	94.1 Å²	94.1	24%	0.239	49%	0.491	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	108.4	172.4	44.5	0	0	0	0	108.3	W746	T736-W746 HydrophobicContact CG2-CD2 4.47Å; T736-W746 HydrophobicContact CG2-CH2 4.48Å; T736-W746 HydrophobicContact CG2-CZ2 4.31Å
737	V	29.7	Very low	29.3	Very low	75 Å²	75	95.3 Å²	95.3	46%	0.455	49%	0.494	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	118.1	162.8	-177.1	0	0	0	0	105.7	T735 D739 Q745	T735-V737 PolarHBondContact O-N 2.69Å; V737-D739 PolarHBondContact O-N 3.2Å; V737-Q745 PolarHBondContact N-O 2.86Å; V737-Q745 VanDerWaalsContact N-O 3.1Å; V737-Q745 PolarHBondContact O-N 2.82Å; V737-Q745 VanDerWaalsContact O-N 3.15Å
738	L	27.1	Very low	29.5	Very low	76 Å²	76	97.1 Å²	97.1	40%	0.398	49%	0.493	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	111.4	167.2	-72	170	0	0	0	106.7	L691	L691-L738 HydrophobicContact CD1-CB 3.75Å; L691-L738 HydrophobicContact CD1-CD1 4.38Å; L691-L738 HydrophobicContact CG-CB 4.33Å
739	D	27.5	Very low	29.7	Very low	57 Å²	57	91.2 Å²	91.2	31%	0.305	47%	0.467	S	S	.	.			trans	-79.2	160.5	167.8	-157.2	-19.5	0	0	0	109.3	V737 Y741 S742 Q745	V737-D739 PolarHBondContact O-N 3.2Å; D739-Y741 PolarHBondContact O-N 2.94Å; D739-S742 PolarHBondContact O-N 3.26Å; D739-Q745 HydrophobicContact CB-CG 4.46Å; D739-Q745 PolarHBondContact OD2-NE2 3Å
740	S	31.2	Very low	29.8	Very low	104 Å²	104	88.4 Å²	88.4	73%	0.727	44%	0.44	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.7	-15	-179.8	-32	0	0	0	0	115
741	Y	26.6	Very low	30.2	Very low	187 Å²	187	85.6 Å²	85.6	73%	0.733	43%	0.43	S	S	*	.	T	Hydrogen-bonded Turn	trans	-112.4	17.7	-169.9	-67.7	-79.2	0	0	0	113.9	D739 E743	D739-Y741 PolarHBondContact O-N 2.94Å; Y741-E743 PolarHBondContact O-N 3.09Å
742	S	31.5	Very low	30.1	Very low	113 Å²	113	92 Å²	92	79%	0.79	45%	0.452	S	S	*	.	S	Bend	trans	63.1	-1.2	179.3	71.9	0	0	0	0	116.9	D739	D739-S742 PolarHBondContact O-N 3.26Å
743	E	29.4	Very low	30.2	Very low	135 Å²	135	96 Å²	96	63%	0.631	47%	0.473	S	S	*	.			trans	-71.5	126.8	168.2	-62.9	-164.8	149.3	0	0	111.2	Y741 Q745	Y741-E743 PolarHBondContact O-N 3.09Å; E743-Q745 PolarHBondContact O-N 3.45Å
744	E	29.6	Very low	29.9	Very low	116 Å²	116	101.6 Å²	101.6	54%	0.542	50%	0.504	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.2	102.2	169.9	-71.7	-166.6	142.5	0	0	110.3	W746	E744-W746 VanDerWaalsContact O-CD1 3.27Å; E744-W746 PolarHBondContact O-N 3.34Å; E744-W746 WeakPolarHBondContact OE2-CZ2 3.47Å; E744-W746 PolarHBondContact OE2-NE1 3.14Å
745	Q	27.2	Very low	30	Very low	94 Å²	94	106.4 Å²	106.4	44%	0.439	53%	0.531	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	103.5	170.7	-71.3	-170.2	29.4	0	0	110.7	V737 D739 E743 L747	V737-Q745 PolarHBondContact N-O 2.86Å; V737-Q745 VanDerWaalsContact N-O 3.1Å; V737-Q745 PolarHBondContact O-N 2.82Å; V737-Q745 VanDerWaalsContact O-N 3.15Å; D739-Q745 HydrophobicContact CB-CG 4.46Å; D739-Q745 PolarHBondContact OD2-NE2 3Å; E743-Q745 PolarHBondContact O-N 3.45Å; Q745-L747 PolarHBondContact O-N 3.3Å; Q745-L747 VanDerWaalsContact O-N 3.12Å
746	W	31.3	Very low	29.8	Very low	153 Å²	153	113.9 Å²	113.9	58%	0.58	56%	0.561	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-79.4	86.5	179	-73	77	0	0	0	111.5	T736 E744 R748	T736-W746 HydrophobicContact CG2-CD2 4.47Å; T736-W746 HydrophobicContact CG2-CH2 4.48Å; T736-W746 HydrophobicContact CG2-CZ2 4.31Å; E744-W746 VanDerWaalsContact O-CD1 3.27Å; E744-W746 PolarHBondContact O-N 3.34Å; E744-W746 WeakPolarHBondContact OE2-CZ2 3.47Å; E744-W746 PolarHBondContact OE2-NE1 3.14Å; W746-R748 PolarHBondContact O-N 2.82Å
747	L	31.5	Very low	30	Very low	96 Å²	96	121.6 Å²	121.6	50%	0.503	61%	0.611	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-66.3	103.2	173.6	-175.2	77.5	0	0	0	109.9	G734 T735 Q745 I749	G734-L747 WeakPolarHBondContact CA-O 3.3Å; T735-L747 PolarHBondContact N-O 2.85Å; T735-L747 VanDerWaalsContact N-O 3.14Å; T735-L747 PolarHBondContact O-N 2.94Å; T735-L747 VanDerWaalsContact O-N 3.13Å; Q745-L747 PolarHBondContact O-N 3.3Å; Q745-L747 VanDerWaalsContact O-N 3.12Å; L747-I749 HydrophobicContact CD2-CD1 4.26Å; L747-I749 HydrophobicContact CD2-CG1 4.44Å; L747-I749 HydrophobicContact CG-CG1 4.41Å
748	R	31.6	Very low	30	Very low	160 Å²	160	123.9 Å²	123.9	60%	0.604	62%	0.619	S	S	*	*			trans	-98.2	99.2	-174.6	-174.2	-179.5	173.4	-177	-2.9	112.4	I732 F733 W746	I732-R748 HydrophobicContact CG2-CG 4.48Å; F733-R748 WeakPolarHBondContact O-CA 3.28Å; W746-R748 PolarHBondContact O-N 2.82Å
749	I	32.9	Very low	30.2	Very low	43 Å²	43	126.4 Å²	126.4	22%	0.221	63%	0.631	C	S	.	*			trans	-91.7	113.7	175.6	-52.9	172.8	0	0	0	109.3	I660 F733 L747 I751	I660-I749 HydrophobicContact CD1-CD1 4.43Å; F733-I749 HydrophobicContact CB-CB 4.19Å; F733-I749 HydrophobicContact CD2-CB 4.31Å; F733-I749 HydrophobicContact CD2-CG2 4.48Å; F733-I749 PolarHBondContact N-O 3.44Å; F733-I749 VanDerWaalsContact N-O 3.08Å; F733-I749 PolarHBondContact O-N 2.92Å; L747-I749 HydrophobicContact CD2-CD1 4.26Å; L747-I749 HydrophobicContact CD2-CG1 4.44Å; L747-I749 HydrophobicContact CG-CG1 4.41Å; I749-I751 HydrophobicContact CG2-CG1 4.1Å
750	E	30.3	Very low	30.3	Very low	70 Å²	70	130.3 Å²	130.3	33%	0.327	65%	0.649	S	S	.	*	B	Isolated β-bridge	trans	-100.1	100.3	175.2	-167.2	-169.8	168.6	0	0	111.1	R752	E750-R752 VanDerWaalsContact CD-NE 3.25Å; E750-R752 VanDerWaalsContact CD-NH2 3.35Å; E750-R752 HydrophobicContact CG-CG 4.2Å; E750-R752 PolarHBondContact O-N 3.32Å; E750-R752 IonicContact OE1-CZ 3.44Å; E750-R752 IonicContact OE1-NE 2.76Å; E750-R752 PolarHBondContact OE1-NE 2.82Å; E750-R752 IonicContact OE1-NH2 3.26Å; E750-R752 PolarHBondContact OE1-NH2 3.03Å; E750-R752 IonicContact OE2-CZ 3.81Å; E750-R752 IonicContact OE2-NE 2.71Å; E750-R752 PolarHBondContact OE2-NE 3.21Å; E750-R752 IonicContact OE2-NH2 2.74Å; E750-R752 PolarHBondContact OE2-NH2 3.47Å
751	I	33.5	Very low	30.3	Very low	83 Å²	83	131.8 Å²	131.8	43%	0.426	64%	0.644	S	S	.	*			trans	-85.4	101.5	175.2	-55.8	-168.2	0	0	0	109.7	L731 F733 I749	L731-I751 WeakPolarHBondContact CB-O 3.34Å; L731-I751 PolarHBondContact O-N 3.35Å; F733-I751 HydrophobicContact CD2-CD1 4.39Å; F733-I751 HydrophobicContact CD2-CG1 4.31Å; F733-I751 HydrophobicContact CE2-CD1 3.76Å; F733-I751 HydrophobicContact CE2-CG1 3.98Å; I749-I751 HydrophobicContact CG2-CG1 4.1Å
752	R	28.1	Very low	30.5	Very low	174 Å²	174	128.4 Å²	128.4	66%	0.657	64%	0.639	S	S	*	*			trans	-87.4	110.5	172.8	-65.6	-172.8	-176.8	155.7	14.7	110.8	E750 L754	E750-R752 VanDerWaalsContact CD-NE 3.25Å; E750-R752 VanDerWaalsContact CD-NH2 3.35Å; E750-R752 HydrophobicContact CG-CG 4.2Å; E750-R752 PolarHBondContact O-N 3.32Å; E750-R752 IonicContact OE1-CZ 3.44Å; E750-R752 IonicContact OE1-NE 2.76Å; E750-R752 PolarHBondContact OE1-NE 2.82Å; E750-R752 IonicContact OE1-NH2 3.26Å; E750-R752 PolarHBondContact OE1-NH2 3.03Å; E750-R752 IonicContact OE2-CZ 3.81Å; E750-R752 IonicContact OE2-NE 2.71Å; E750-R752 PolarHBondContact OE2-NE 3.21Å; E750-R752 IonicContact OE2-NH2 2.74Å; E750-R752 PolarHBondContact OE2-NH2 3.47Å; R752-L754 PolarHBondContact O-N 3.26Å; R752-L754 VanDerWaalsContact O-N 3.1Å
753	L	29.7	Very low	30.5	Very low	159 Å²	159	129.4 Å²	129.4	83%	0.832	63%	0.629	S	S	*	*			trans	-70.8	99.2	163.5	-68.6	173.2	0	0	0	108.9
754	L	26.4	Very low	30.5	Very low	146 Å²	146	129 Å²	129	76%	0.764	63%	0.629	S	S	*	*	P	Polyproline II helix	trans	-68.3	142.4	167.5	-63.5	175.3	0	0	0	109.4	R752	R752-L754 PolarHBondContact O-N 3.26Å; R752-L754 VanDerWaalsContact O-N 3.1Å
755	P	30.3	Very low	30.6	Very low	117 Å²	117	130 Å²	130	76%	0.76	64%	0.635	S	S	*	*	P	Polyproline II helix	trans	-60.9	148.8	161.4	29.7	-33.7	0	0	0	109
756	K	33.1	Very low	30.9	Very low	195 Å²	195	133 Å²	133	85%	0.848	65%	0.652	S	S	*	*	P	Polyproline II helix	trans	-63.5	149.3	166	-69.7	-171.4	175.9	-171.2	0	109.4
757	P	31.7	Very low	30.8	Very low	200 Å²	200	131.2 Å²	131.2	100%	1.299	66%	0.658	S	S	*	*			trans	-60.7	0	163.2	31.1	-35.8	0	0	0	110.9

Retrieved 757 of 757 residues in 486.5 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).