A0A3Q0KUJ7_SCHMA Loading...

Non-specific serine/threonine protein kinase

AlphaFold DB , UniProt , Accession A0A3Q0KUJ7, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 869 aa.

						>A0A3Q0KUJ7_SCHMA|A0A3Q0KUJ7
MLPVPPSCDKGTPSWSSLKRKSWLYPNSLNCARENVYESHLLKTKKAAEQEPILLPNCIPHSCVPPVRILTMKTLGTTEYQFPLILYNNKMLKENFISPVSKLLHLPENNKVRKKLTSIQNIHLLKLPANCSTVPWENNDHNLNKLLSLDEIKSLTKFNLKTMKKVKQHSINLHLLKSHFLLNEQELSNKSNGYHQLLKLNQNNSNIKYQLSSNGKLLRLPYLCHPIERKFNHNKTDDKISNNNVTSKETYLSNYKGTKDYKLTSNENTLQMLTYPIHSEQHNNVDQHTLSDISWVLETTKENIKPNSVNNLKDYNVSQCKLNPSIQNDKKFYNDCGVQFNFVDYGEPKTQIGFNTFTNCENAAWPTDCIEQLLSNDVAHVTKQFLSIHTSDLIDWNNEDKCIVPCVPLHINTSNMYEQNPCNSPVNKQPIEMNNTISPSKIVHNESSLVSKSQINNVTTTATENKPELFTTDLVTAKMLQNSNTINQDNKQSINNEIKSLLSCNKQGSSYFSLDVVKALSEIDNRLNVIDKVSVQLEQDHKRNQELLETIIQLNKKESQVNLSCQLDEPNKSEATYQQQKLQLPDELDFKGDQVQNEKLIDSKINLNVQDQRHDCTIVKQQIKSPKPIERSHSITGHYTDEREKLRKERREASMTRRCNEAKQFINEILSDSVLPKQSSPRLDQSIIPKHSNTPIKRGRSLTRSRGTSRVLNQRNLPNTYITPSSPKPPTPVRFHYNGRIGFTARGARNISGNRRQQTKIVQKPSVVSHSHPDIPKHLTYEDDLQTTILSDWSLESNVRRILYGDEEDRFRSPSRQQSGSGISNFDQESQIPQSPHSMPETDLLTEIGGVPSTSFIDWDEIDELIGDL
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	36.9	Very low	31.8	Very low	240 Å²	240	136.5 Å²	136.5	100%	1.182	80%	0.804	S	S	*	*				0	115.9	0	-67.6	176.4	78.2	0	0	106.6
2	L	28.7	Very low	31.6	Very low	167 Å²	167	136.1 Å²	136.1	87%	0.874	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-68.4	136.8	176.4	-79.8	160.4	0	0	0	108.6	V4	L2-V4 PolarHBondContact O-N 2.98Å
3	P	31	Very low	31.5	Very low	117 Å²	117	134.1 Å²	134.1	76%	0.76	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-63.7	122.5	-178.8	24	-30	0	0	0	109.5
4	V	29	Very low	31.4	Very low	134 Å²	134	128.9 Å²	128.9	81%	0.812	77%	0.771	S	S	*	*	P	Polyproline II helix	trans	-64.2	126.3	173.4	178.9	0	0	0	0	107.3	L2	L2-V4 PolarHBondContact O-N 2.98Å
5	P	31.4	Very low	31.1	Very low	105 Å²	105	135.9 Å²	135.9	68%	0.682	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-58	141.1	176.9	22.4	-31.3	0	0	0	109.8	S7	P5-S7 PolarHBondContact O-N 2.8Å
6	P	32.5	Very low	31	Very low	119 Å²	119	133.5 Å²	133.5	77%	0.773	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-55.5	127.7	-178.4	21.8	-31.2	0	0	0	109.5	C8	P6-C8 PolarHBondContact O-N 3.15Å
7	S	29.5	Very low	30.8	Very low	88 Å²	88	131.4 Å²	131.4	62%	0.615	77%	0.767	S	S	*	*	P	Polyproline II helix	trans	-51.9	132	175.8	50.7	0	0	0	0	109.3	P5 D9	P5-S7 PolarHBondContact O-N 2.8Å; S7-D9 PolarHBondContact O-N 2.96Å
8	C	33.3	Very low	30.7	Very low	131 Å²	131	131.3 Å²	131.3	89%	0.885	76%	0.762	S	S	*	*	S	Bend	trans	-68.9	16.6	177	-73.3	0	0	0	0	113.2	P6 K10	P6-C8 PolarHBondContact O-N 3.15Å; C8-K10 PolarHBondContact O-N 3.44Å; C8-K10 VanDerWaalsContact O-N 3.14Å
9	D	34.4	Very low	30.6	Very low	142 Å²	142	134.4 Å²	134.4	76%	0.759	77%	0.766	S	S	*	*			trans	-87.6	37.5	178.8	-63.6	-32.4	0	0	0	111.8	S7 G11	S7-D9 PolarHBondContact O-N 2.96Å; D9-G11 PolarHBondContact O-N 2.82Å
10	K	35.5	Very low	30.5	Very low	197 Å²	197	139.6 Å²	139.6	86%	0.857	77%	0.772	S	S	*	*			trans	-73.2	83.1	158.4	-75.2	-171.6	-179.7	179.3	0	106.7	C8 T12	C8-K10 PolarHBondContact O-N 3.44Å; C8-K10 VanDerWaalsContact O-N 3.14Å; K10-T12 PolarHBondContact O-N 2.79Å
11	G	27.5	Very low	30.2	Very low	62 Å²	62	140.2 Å²	140.2	64%	0.639	77%	0.767	S	S	*	*			trans	-42.6	126.9	168.7	0	0	0	0	0	108.7	D9 P13	D9-G11 PolarHBondContact O-N 2.82Å; G11-P13 VanDerWaalsContact O-N 3.13Å
12	T	30.2	Very low	29.8	Very low	131 Å²	131	133.3 Å²	133.3	80%	0.804	74%	0.742	S	S	*	*			trans	-40.3	123	175.3	29	0	0	0	0	108.7	K10 S14	K10-T12 PolarHBondContact O-N 2.79Å; T12-S14 PolarHBondContact O-N 3.27Å
13	P	30.3	Very low	29.7	Very low	110 Å²	110	137.2 Å²	137.2	71%	0.714	75%	0.746	S	S	*	*			trans	-50.9	117.9	-177.1	17	-29	0	0	0	107.9	G11 W15	G11-P13 VanDerWaalsContact O-N 3.13Å; P13-W15 PolarHBondContact O-N 3.4Å
14	S	29	Very low	29.4	Very low	62 Å²	62	138.8 Å²	138.8	43%	0.434	75%	0.747	S	S	.	*			trans	-58.4	119.9	179.1	113.9	0	0	0	0	106.4	T12 S16 S17	T12-S14 PolarHBondContact O-N 3.27Å; S14-S16 PolarHBondContact O-N 2.87Å; S14-S16 PolarHBondContact OG-N 2.82Å; S14-S16 PolarHBondContact OG-OG 3.09Å; S14-S17 PolarHBondContact O-N 2.99Å
15	W	27.5	Very low	29.1	Very low	233 Å²	233	141.4 Å²	141.4	88%	0.883	74%	0.744	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61	-3.6	177.4	-77.3	78.3	0	0	0	112.9	P13	P13-W15 PolarHBondContact O-N 3.4Å
16	S	29.2	Very low	28.9	Very low	98 Å²	98	141.6 Å²	141.6	69%	0.685	75%	0.745	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.2	-17.1	172.7	77.7	0	0	0	0	113.9	S14	S14-S16 PolarHBondContact O-N 2.87Å; S14-S16 PolarHBondContact OG-N 2.82Å; S14-S16 PolarHBondContact OG-OG 3.09Å
17	S	28.4	Very low	28.7	Very low	98 Å²	98	141.6 Å²	141.6	69%	0.685	74%	0.738	S	S	*	*	S	Bend	trans	-83.8	-16.1	179.3	-55.1	0	0	0	0	113.3	S14 K19	S14-S17 PolarHBondContact O-N 2.99Å; S17-K19 PolarHBondContact O-N 2.89Å
18	L	27.6	Very low	28.5	Very low	130 Å²	130	141.6 Å²	141.6	68%	0.681	74%	0.738	S	S	*	*	S	Bend	trans	-73.2	80	158.2	-97.8	104.1	0	0	0	107.6	R20	L18-R20 VanDerWaalsContact C-N 3.28Å; L18-R20 PolarHBondContact O-N 3.36Å
19	K	29.8	Very low	28.2	Very low	190 Å²	190	141.5 Å²	141.5	83%	0.826	73%	0.728	S	S	*	*			trans	-48.7	106.8	150.7	-78.1	-174.3	176.9	-179.7	0	104.9	S17 K21	S17-K19 PolarHBondContact O-N 2.89Å; K19-K21 PolarHBondContact O-N 3.38Å
20	R	28	Very low	27.7	Very low	238 Å²	238	140 Å²	140	90%	0.898	72%	0.721	S	S	*	*			trans	-60	90.2	173.1	-67.8	-177.4	-161.5	170	4.9	105.6	L18 S22	L18-R20 VanDerWaalsContact C-N 3.28Å; L18-R20 PolarHBondContact O-N 3.36Å; R20-S22 PolarHBondContact O-N 2.96Å
21	K	25.7	Very low	27.2	Very low	152 Å²	152	135.9 Å²	135.9	66%	0.661	72%	0.715	S	S	*	*			trans	-53.7	112	160.1	-79.9	-174.8	174.1	-176.4	0	103.5	K19 W23	K19-K21 PolarHBondContact O-N 3.38Å; K21-W23 PolarHBondContact O-N 2.97Å
22	S	26.7	Very low	27.1	Very low	95 Å²	95	135.5 Å²	135.5	66%	0.664	71%	0.706	S	S	*	*			trans	-51.5	109	171.5	41.6	0	0	0	0	107.3	R20 L24	R20-S22 PolarHBondContact O-N 2.96Å; S22-L24 PolarHBondContact O-N 3Å
23	W	27	Very low	26.8	Very low	250 Å²	250	139 Å²	139	95%	0.947	71%	0.705	S	S	*	*			trans	-71.1	39.2	171.5	-77.8	70.7	0	0	0	111.2	K21 Y25	K21-W23 PolarHBondContact O-N 2.97Å; W23-Y25 VanDerWaalsContact C-N 3.34Å
24	L	25.5	Very low	26.5	Very low	149 Å²	149	141.5 Å²	141.5	78%	0.78	71%	0.707	S	S	*	*			trans	-100.5	63.6	167	-71	168.6	0	0	0	106.9	S22 P26	S22-L24 PolarHBondContact O-N 3Å; L24-P26 VanDerWaalsContact O-CD 3.31Å; L24-P26 WeakPolarHBondContact O-CD 3.34Å
25	Y	23	Very low	26.3	Very low	190 Å²	190	144.8 Å²	144.8	75%	0.745	72%	0.719	S	S	*	*			trans	-78.9	111	152.9	-114.3	-86.6	0	0	0	105.4	W23 N27	W23-Y25 VanDerWaalsContact C-N 3.34Å; Y25-N27 PolarHBondContact O-N 2.86Å
26	P	27.4	Very low	26.3	Very low	108 Å²	108	138.4 Å²	138.4	70%	0.701	71%	0.706	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.4	-3.1	-173.9	-18.6	32.2	0	0	0	114.2	L24	L24-P26 VanDerWaalsContact O-CD 3.31Å; L24-P26 WeakPolarHBondContact O-CD 3.34Å
27	N	27	Very low	26.1	Very low	119 Å²	119	144 Å²	144	64%	0.636	71%	0.713	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.8	-5.7	-170.9	-70	-9.4	0	0	0	115.1	Y25	Y25-N27 PolarHBondContact O-N 2.86Å
28	S	26.2	Very low	25.8	Very low	89 Å²	89	146.3 Å²	146.3	62%	0.622	71%	0.713	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.5	-13.8	177.4	59.2	0	0	0	0	114.1
29	L	25.8	Very low	25.5	Very low	128 Å²	128	144.5 Å²	144.5	67%	0.67	71%	0.711	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.3	-9.3	176.7	-93.4	159.7	0	0	0	114.4	C31 A32	L29-C31 VanDerWaalsContact C-N 3.32Å; L29-A32 PolarHBondContact O-N 2.81Å
30	N	25.2	Very low	25.2	Very low	112 Å²	112	142.2 Å²	142.2	60%	0.599	70%	0.703	S	S	*	*	H	α-helix	trans	-76.6	-18.1	172.6	-82	-9.1	0	0	0	113.2	A32	N30-A32 VanDerWaalsContact C-N 3.3Å; N30-A32 PolarHBondContact O-N 2.87Å
31	C	23.3	Very low	25	Very low	110 Å²	110	138.5 Å²	138.5	74%	0.743	70%	0.701	S	S	*	*	H	α-helix	trans	-80.3	-7.7	173.8	-71.2	0	0	0	0	114.2	L29	L29-C31 VanDerWaalsContact C-N 3.32Å
32	A	25.7	Very low	24.9	Very low	54 Å²	54	137.6 Å²	137.6	45%	0.446	70%	0.702	S	S	.	*	H	α-helix	trans	-106.2	-14.1	179	0	0	0	0	0	114.1	L29 N30 V36	L29-A32 PolarHBondContact O-N 2.81Å; N30-A32 VanDerWaalsContact C-N 3.3Å; N30-A32 PolarHBondContact O-N 2.87Å; A32-V36 WeakPolarHBondContact O-CG2 3.45Å
33	R	24.6	Very low	24.7	Very low	205 Å²	205	141.9 Å²	141.9	77%	0.774	71%	0.709	S	S	*	*	H	α-helix	trans	-83.1	-26.4	-177.8	-90.1	-174.2	172.3	176.1	-1.8	114.6
34	E	24.8	Very low	24.5	Very low	162 Å²	162	134.3 Å²	134.3	76%	0.757	69%	0.69	S	S	*	*	S	Bend	trans	-96.8	-23	-176.3	-77.9	-179.6	161	0	0	114.8
35	N	23.7	Very low	24.5	Very low	130 Å²	130	136.9 Å²	136.9	70%	0.695	70%	0.695	S	S	*	*	S	Bend	trans	-99.1	-1.3	-175.4	-74.8	-13.3	0	0	0	116
36	V	27.7	Very low	24.7	Very low	99 Å²	99	138.2 Å²	138.2	60%	0.6	71%	0.705	S	S	*	*	S	Bend	trans	-84.1	-22.7	178.6	-178.4	0	0	0	0	112.3	A32	A32-V36 WeakPolarHBondContact O-CG2 3.45Å
37	Y	24.3	Very low	24.6	Very low	217 Å²	217	136.3 Å²	136.3	85%	0.851	70%	0.699	S	S	*	*	S	Bend	trans	-95	-6.8	179.8	-85.4	-78.4	0	0	0	115.8
38	E	23.7	Very low	24.6	Very low	145 Å²	145	134.4 Å²	134.4	68%	0.678	70%	0.699	S	S	*	*			trans	-111.5	15.2	172.6	-72	-153	161.7	0	0	114.4	H40	E38-H40 PolarHBondContact O-CD2 2.94Å; E38-H40 PolarHBondContact O-N 3.42Å
39	S	21.3	Very low	24.6	Very low	92 Å²	92	138.2 Å²	138.2	64%	0.643	71%	0.707	S	S	*	*	S	Bend	trans	-64.9	90.7	149	67.8	0	0	0	0	106.1	L41	S39-L41 PolarHBondContact O-N 2.93Å
40	H	22.9	Very low	24.6	Very low	142 Å²	142	140.3 Å²	140.3	66%	0.657	71%	0.714	S	S	*	*			trans	-38.8	118.5	172.7	-63.5	-72.1	0	0	0	106.1	E38 L42	E38-H40 PolarHBondContact O-CD2 2.94Å; E38-H40 PolarHBondContact O-N 3.42Å; H40-L42 HydrophobicContact CB-CG 4.47Å; H40-L42 PolarHBondContact O-N 3.29Å
41	L	23.2	Very low	24.4	Very low	161 Å²	161	143.9 Å²	143.9	84%	0.843	73%	0.726	S	S	*	*			trans	-52.2	79.4	142.6	-130.1	149.1	0	0	0	103.8	S39 K43	S39-L41 PolarHBondContact O-N 2.93Å; L41-K43 PolarHBondContact O-N 3.22Å
42	L	22.9	Very low	24.5	Very low	132 Å²	132	142.5 Å²	142.5	69%	0.691	72%	0.716	S	S	*	*			trans	-57	94.5	166.7	-110.8	147.3	0	0	0	99.7	H40 T44	H40-L42 HydrophobicContact CB-CG 4.47Å; H40-L42 PolarHBondContact O-N 3.29Å; L42-T44 HydrophobicContact CB-CG2 4.33Å; L42-T44 HydrophobicContact CD2-CG2 4.27Å; L42-T44 PolarHBondContact O-N 3.17Å; L42-T44 PolarHBondContact O-OG1 3.22Å
43	K	23.9	Very low	24.4	Very low	186 Å²	186	146.9 Å²	146.9	81%	0.809	73%	0.731	S	S	*	*			trans	-62.5	71.7	162.1	-73.3	178.3	178.3	174.2	0	103.9	L41 K45	L41-K43 PolarHBondContact O-N 3.22Å; K43-K45 PolarHBondContact O-N 3.47Å
44	T	23.2	Very low	24.4	Very low	91 Å²	91	144.3 Å²	144.3	56%	0.558	73%	0.731	S	S	*	*			trans	-61	101.3	164.4	39.2	0	0	0	0	103.3	L42 K46	L42-T44 HydrophobicContact CB-CG2 4.33Å; L42-T44 HydrophobicContact CD2-CG2 4.27Å; L42-T44 PolarHBondContact O-N 3.17Å; L42-T44 PolarHBondContact O-OG1 3.22Å; T44-K46 PolarHBondContact O-N 2.94Å
45	K	25.4	Very low	24.5	Very low	203 Å²	203	142.2 Å²	142.2	88%	0.883	73%	0.725	S	S	*	*	T	Hydrogen-bonded Turn	trans	-42.9	109.3	169.8	-70.8	173.7	175.3	174.6	0	107.1	K43 A47	K43-K45 PolarHBondContact O-N 3.47Å; K45-A47 PolarHBondContact O-N 3.05Å
46	K	27.5	Very low	24.5	Very low	217 Å²	217	141 Å²	141	94%	0.943	72%	0.724	S	S	*	*	T	Hydrogen-bonded Turn	trans	54.5	38	166.4	-59.7	-177.3	174	-178.6	0	116.1	T44	T44-K46 PolarHBondContact O-N 2.94Å
47	A	23.8	Very low	24.4	Very low	69 Å²	69	140.9 Å²	140.9	57%	0.57	72%	0.72	S	S	*	*			trans	-79.1	122.2	164	0	0	0	0	0	108.9	K45	K45-A47 PolarHBondContact O-N 3.05Å
48	A	27.4	Very low	24.5	Very low	78 Å²	78	136.3 Å²	136.3	65%	0.645	72%	0.719	S	S	*	*			trans	-53.3	143.1	-177.3	0	0	0	0	0	112	Q50	A48-Q50 PolarHBondContact O-N 3.05Å
49	E	26.9	Very low	24.6	Very low	169 Å²	169	134.7 Å²	134.7	79%	0.79	71%	0.713	S	S	*	*	S	Bend	trans	-60.7	44.9	-178.4	-57.8	-178.7	164.7	0	0	115.4	K73	E49-K73 IonicContact OE2-NZ 2.9Å; E49-K73 PolarHBondContact OE2-NZ 3.09Å
50	Q	24.8	Very low	25.1	Very low	173 Å²	173	136.1 Å²	136.1	81%	0.808	72%	0.72	S	S	*	*			trans	-124.4	6.5	-169.5	-73.4	-170	-0.7	0	0	115.7	A48	A48-Q50 PolarHBondContact O-N 3.05Å
51	E	22	Very low	25.5	Very low	186 Å²	186	137.6 Å²	137.6	87%	0.869	73%	0.727	S	S	*	*			trans	-92.1	123.8	175.4	-76.3	-168.5	161.7	0	0	113
52	P	24.4	Very low	25.7	Very low	81 Å²	81	131.7 Å²	131.7	53%	0.526	70%	0.699	S	S	.	*			trans	-76.4	138.1	-177.2	29.5	-33.3	0	0	0	112.4	L54	P52-L54 PolarHBondContact O-N 3.25Å
53	I	23.5	Very low	26.1	Very low	147 Å²	147	131.5 Å²	131.5	75%	0.754	71%	0.708	S	S	*	*			trans	-76.5	114.8	175.2	-59.1	168.6	0	0	0	108.6	L55	I53-L55 PolarHBondContact O-N 3.06Å
54	L	24.8	Very low	26.4	Very low	151 Å²	151	125.5 Å²	125.5	79%	0.791	69%	0.686	S	S	*	*			trans	-79.5	109.9	169.5	-81.1	158.3	0	0	0	108.8	P52	P52-L54 PolarHBondContact O-N 3.25Å
55	L	26.5	Very low	26.7	Very low	117 Å²	117	125.2 Å²	125.2	61%	0.613	69%	0.686	S	S	*	*			trans	-79.1	140.3	171.1	-77.9	166.4	0	0	0	110.4	I53 I69	I53-L55 PolarHBondContact O-N 3.06Å; L55-I69 HydrophobicContact CD1-CD1 4.3Å
56	P	24.6	Very low	26.7	Very low	105 Å²	105	117.9 Å²	117.9	68%	0.682	66%	0.659	S	S	*	*			trans	-65	141.3	176	24.3	-30.4	0	0	0	111.6	C58	P56-C58 PolarHBondContact O-N 3.33Å; P56-C58 PolarHBondContact O-SG 3.28Å; P56-C58 VanDerWaalsContact O-SG 3.4Å
57	N	24.9	Very low	27.1	Very low	97 Å²	97	111.3 Å²	111.3	52%	0.519	64%	0.637	S	S	.	*			trans	-50.2	108.2	179	-85.7	-19.4	0	0	0	112.1	I59 P66	N57-I59 VanDerWaalsContact C-N 3.27Å; N57-I59 PolarHBondContact O-N 3.26Å; N57-P66 WeakPolarHBondContact OD1-CD 3.47Å
58	C	27.6	Very low	27.2	Very low	121 Å²	121	116.6 Å²	116.6	82%	0.818	64%	0.642	S	S	*	*	S	Bend	trans	-83.4	9.4	177.3	-60.2	0	0	0	0	114.5	P56	P56-C58 PolarHBondContact O-N 3.33Å; P56-C58 PolarHBondContact O-SG 3.28Å; P56-C58 VanDerWaalsContact O-SG 3.4Å
59	I	26.2	Very low	27.3	Very low	111 Å²	111	115.2 Å²	115.2	57%	0.569	62%	0.623	S	S	*	*			trans	-123.9	107.4	178.5	-53	174.1	0	0	0	108	N57 H61 S62	N57-I59 VanDerWaalsContact C-N 3.27Å; N57-I59 PolarHBondContact O-N 3.26Å; I59-H61 PolarHBondContact O-N 3.37Å; I59-S62 PolarHBondContact O-N 3.24Å; I59-S62 VanDerWaalsContact O-N 3.07Å
60	P	29.9	Very low	27.4	Very low	121 Å²	121	112.1 Å²	112.1	79%	0.786	61%	0.612	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.6	-9.2	-177.4	-23	31.4	0	0	0	115.3
61	H	32	Very low	27.6	Very low	174 Å²	174	109.1 Å²	109.1	81%	0.806	61%	0.605	S	S	*	*	T	Hydrogen-bonded Turn	trans	-121.8	8	-179.4	-57	-41.8	0	0	0	113.8	I59 C63	I59-H61 PolarHBondContact O-N 3.37Å; H61-C63 PolarHBondContact O-N 2.95Å
62	S	27.9	Very low	27.7	Very low	36 Å²	36	105.3 Å²	105.3	25%	0.252	59%	0.589	S	S	.	*			trans	-87.8	100.1	173.1	177.2	0	0	0	0	109.6	I59 V64	I59-S62 PolarHBondContact O-N 3.24Å; I59-S62 VanDerWaalsContact O-N 3.07Å; S62-V64 PolarHBondContact O-N 3.17Å; S62-V64 VanDerWaalsContact O-N 3.11Å; S62-V64 WeakPolarHBondContact OG-CB 3.35Å; S62-V64 PolarHBondContact OG-N 3.17Å; S62-V64 PolarHBondContact OG-O 2.72Å
63	C	30.8	Very low	27.8	Very low	129 Å²	129	109.2 Å²	109.2	87%	0.872	60%	0.598	S	S	*	*			trans	-69.5	7.2	164.5	-62.7	0	0	0	0	112.8	H61 P65	H61-C63 PolarHBondContact O-N 2.95Å; C63-P65 VanDerWaalsContact O-CD 3.24Å; C63-P65 WeakPolarHBondContact O-CD 3.32Å
64	V	30	Very low	28	Very low	59 Å²	59	106 Å²	106	36%	0.358	59%	0.585	S	S	.	*			trans	-95.9	108.3	-177.5	-171.2	0	0	0	0	109.5	S62 Y87	S62-V64 PolarHBondContact O-N 3.17Å; S62-V64 VanDerWaalsContact O-N 3.11Å; S62-V64 WeakPolarHBondContact OG-CB 3.35Å; S62-V64 PolarHBondContact OG-N 3.17Å; S62-V64 PolarHBondContact OG-O 2.72Å; V64-Y87 HydrophobicContact CG1-CD1 4.36Å
65	P	29.5	Very low	28.2	Very low	86 Å²	86	107.3 Å²	107.3	56%	0.558	59%	0.592	S	S	*	*			trans	-68.1	129.7	169.8	25.6	-31	0	0	0	109.9	C63 V67	C63-P65 VanDerWaalsContact O-CD 3.24Å; C63-P65 WeakPolarHBondContact O-CD 3.32Å; P65-V67 PolarHBondContact O-N 2.8Å
66	P	26.6	Very low	28.5	Very low	48 Å²	48	105.6 Å²	105.6	31%	0.312	60%	0.602	S	S	.	*			trans	-64.2	125.5	172.7	24.6	-31.1	0	0	0	109.6	N57	N57-P66 WeakPolarHBondContact OD1-CD 3.47Å
67	V	34.6	Very low	28.6	Very low	79 Å²	79	104 Å²	104	48%	0.479	59%	0.59	S	S	.	*			trans	-81.9	-23.4	-166.7	175.9	0	0	0	0	113.6	P65	P65-V67 PolarHBondContact O-N 2.8Å
68	R	26.8	Very low	28.7	Very low	181 Å²	181	106.8 Å²	106.8	68%	0.683	61%	0.611	S	S	*	*			trans	175.9	141.2	167.3	-93.3	137.3	-159.5	-149.9	7.8	109.9
69	I	29.4	Very low	28.6	Very low	49 Å²	49	107.6 Å²	107.6	25%	0.251	60%	0.603	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-98.2	123.9	164.3	-59.7	173.1	0	0	0	107.7	L55 P83	L55-I69 HydrophobicContact CD1-CD1 4.3Å; I69-P83 HydrophobicContact CG2-CB 3.72Å
70	L	27.8	Very low	28.6	Very low	103 Å²	103	111.7 Å²	111.7	54%	0.539	61%	0.613	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-92.8	105.2	169.8	-80.2	163.2	0	0	0	108.7	M72 L86	L70-M72 PolarHBondContact O-N 3.46Å; L70-L86 HydrophobicContact CD1-CD1 4Å
71	T	29.3	Very low	28.4	Very low	111 Å²	111	113.1 Å²	113.1	68%	0.681	61%	0.609	S	S	*	*			trans	-74.2	105.3	168	27.5	0	0	0	0	109.5	K73	T71-K73 PolarHBondContact O-N 3.17Å
72	M	25.3	Very low	28.1	Very low	106 Å²	106	112.9 Å²	112.9	52%	0.522	61%	0.606	S	S	.	*			trans	-79.6	115.1	173.7	-70.1	-90.5	-73.9	0	0	109	L70 T74 V112	L70-M72 PolarHBondContact O-N 3.46Å; M72-T74 PolarHBondContact O-N 2.99Å; M72-V112 HydrophobicContact CE-CG2 3.99Å
73	K	26.2	Very low	28	Very low	163 Å²	163	114.9 Å²	114.9	71%	0.709	62%	0.618	S	S	*	*			trans	-75	97.7	167.1	-71.9	-175.7	179.8	-179.7	0	108.3	E49 T71 L75	E49-K73 IonicContact OE2-NZ 2.9Å; E49-K73 PolarHBondContact OE2-NZ 3.09Å; T71-K73 PolarHBondContact O-N 3.17Å; K73-L75 PolarHBondContact O-N 3.11Å
74	T	26.3	Very low	27.8	Very low	80 Å²	80	112.7 Å²	112.7	49%	0.491	60%	0.597	S	S	.	*			trans	-78.4	111.6	164.9	38.7	0	0	0	0	108.4	M72 G76	M72-T74 PolarHBondContact O-N 2.99Å; T74-G76 PolarHBondContact O-N 3.36Å; T74-G76 VanDerWaalsContact O-N 3.16Å
75	L	29.6	Very low	27.7	Very low	178 Å²	178	113.7 Å²	113.7	93%	0.932	60%	0.6	S	S	*	*	S	Bend	trans	-71.7	104.9	172.4	-82.8	154.4	0	0	0	108.2	K73	K73-L75 PolarHBondContact O-N 3.11Å
76	G	33.6	Very low	27.6	Very low	81 Å²	81	113.2 Å²	113.2	84%	0.835	59%	0.592	S	S	*	*	S	Bend	trans	98.3	10.3	157.7	0	0	0	0	0	117.9	T74	T74-G76 PolarHBondContact O-N 3.36Å; T74-G76 VanDerWaalsContact O-N 3.16Å
77	T	26.2	Very low	27.6	Very low	70 Å²	70	117.2 Å²	117.2	43%	0.429	60%	0.602	S	S	.	*			trans	-114.5	130.2	166.5	59.1	0	0	0	0	109.6	E79	T77-E79 PolarHBondContact O-N 3.46Å
78	T	27.4	Very low	27.2	Very low	156 Å²	156	118.1 Å²	118.1	96%	0.957	60%	0.604	S	S	*	*			trans	-70.1	21.4	169.8	41.9	0	0	0	0	112.1
79	E	24.8	Very low	27.4	Very low	139 Å²	139	115.4 Å²	115.4	65%	0.65	60%	0.603	S	S	*	*			trans	-83.8	124.6	-177.4	-74.5	175	160.7	0	0	109.8	T77 Q81	T77-E79 PolarHBondContact O-N 3.46Å; E79-Q81 PolarHBondContact O-N 3.47Å
80	Y	27.4	Very low	27.4	Very low	197 Å²	197	121.4 Å²	121.4	77%	0.773	63%	0.628	S	S	*	*			trans	-25.7	117.7	176.6	-68.5	-93.1	0	0	0	114.9	F82	Y80-F82 WeakPolarHBondContact O-CD2 3.49Å; Y80-F82 PolarHBondContact O-N 3.2Å
81	Q	25.6	Very low	27.6	Very low	150 Å²	150	121.5 Å²	121.5	70%	0.701	63%	0.627	S	S	*	*			trans	-65.9	98.2	166.7	-86.5	-178.6	-23.6	0	0	109.5	E79 P83	E79-Q81 PolarHBondContact O-N 3.47Å; Q81-P83 WeakPolarHBondContact O-CD 3.42Å
82	F	24.6	Very low	27.6	Very low	169 Å²	169	119.1 Å²	119.1	74%	0.741	61%	0.609	S	S	*	*			trans	-84.8	119.1	163.7	-67.4	-78.4	0	0	0	109.4	Y80 L84	Y80-F82 WeakPolarHBondContact O-CD2 3.49Å; Y80-F82 PolarHBondContact O-N 3.2Å; F82-L84 PolarHBondContact O-N 3.16Å
83	P	26.8	Very low	27.9	Very low	78 Å²	78	122.8 Å²	122.8	51%	0.506	62%	0.622	S	S	.	*			trans	-66.2	117.4	170.7	24.7	-29.7	0	0	0	109.3	I69 Q81 I85	I69-P83 HydrophobicContact CG2-CB 3.72Å; Q81-P83 WeakPolarHBondContact O-CD 3.42Å; P83-I85 PolarHBondContact O-N 3.17Å
84	L	25.8	Very low	28	Very low	83 Å²	83	122.2 Å²	122.2	44%	0.435	62%	0.622	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-73.7	112.7	170.3	-125.2	95.7	0	0	0	108.6	F82	F82-L84 PolarHBondContact O-N 3.16Å
85	I	28.1	Very low	28.1	Very low	80 Å²	80	123.5 Å²	123.5	41%	0.41	63%	0.626	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-94.4	113.2	174.6	-55.9	174.6	0	0	0	108.2	P83 Y87	P83-I85 PolarHBondContact O-N 3.17Å; I85-Y87 HydrophobicContact CB-CE2 4.22Å; I85-Y87 HydrophobicContact CG2-CD2 4.32Å; I85-Y87 HydrophobicContact CG2-CE1 4.17Å; I85-Y87 HydrophobicContact CG2-CE2 3.7Å
86	L	27.3	Very low	27.9	Very low	77 Å²	77	121.1 Å²	121.1	40%	0.403	61%	0.608	S	S	.	*			trans	-92	121.1	176.9	-72.8	161.5	0	0	0	110.2	L70	L70-L86 HydrophobicContact CD1-CD1 4Å
87	Y	26	Very low	27.7	Very low	132 Å²	132	125.8 Å²	125.8	52%	0.518	61%	0.612	S	S	.	*			trans	-98.2	149.8	173.4	-63.5	-83.5	0	0	0	111.3	V64 I85 N89	V64-Y87 HydrophobicContact CG1-CD1 4.36Å; I85-Y87 HydrophobicContact CB-CE2 4.22Å; I85-Y87 HydrophobicContact CG2-CD2 4.32Å; I85-Y87 HydrophobicContact CG2-CE1 4.17Å; I85-Y87 HydrophobicContact CG2-CE2 3.7Å; Y87-N89 PolarHBondContact O-N 3.42Å
88	N	27.9	Very low	27.6	Very low	97 Å²	97	126.5 Å²	126.5	52%	0.519	62%	0.62	S	S	.	*			trans	-75.1	113.1	174.9	-170.3	-10.7	0	0	0	110.4	K90 M91 L92	N88-K90 PolarHBondContact O-N 3.14Å; N88-K90 VanDerWaalsContact O-N 3.13Å; N88-K90 PolarHBondContact OD1-N 3.15Å; N88-M91 PolarHBondContact O-N 2.83Å; N88-L92 PolarHBondContact O-N 2.86Å
89	N	29.4	Very low	27.6	Very low	124 Å²	124	124.2 Å²	124.2	66%	0.663	61%	0.608	S	S	*	*	H	α-helix	trans	-58.2	-27.6	-175	-111.4	-12.4	0	0	0	114.4	Y87 M91	Y87-N89 PolarHBondContact O-N 3.42Å; N89-M91 VanDerWaalsContact C-N 3.34Å
90	K	30.8	Very low	27.5	Very low	176 Å²	176	123.2 Å²	123.2	77%	0.765	61%	0.611	S	S	*	*	H	α-helix	trans	-64.7	-37.6	176.6	-90.2	-172.7	175.2	-177	0	112.1	N88	N88-K90 PolarHBondContact O-N 3.14Å; N88-K90 VanDerWaalsContact O-N 3.13Å; N88-K90 PolarHBondContact OD1-N 3.15Å
91	M	31	Very low	27.3	Very low	105 Å²	105	119 Å²	119	52%	0.517	61%	0.61	S	S	.	*	H	α-helix	trans	-86.1	-21.5	-176.9	-73.2	-148.3	136.8	0	0	114.2	N88 N89 K93 E94 N95	N88-M91 PolarHBondContact O-N 2.83Å; N89-M91 VanDerWaalsContact C-N 3.34Å; M91-K93 VanDerWaalsContact C-N 3.25Å; M91-K93 PolarHBondContact O-N 3.3Å; M91-E94 PolarHBondContact O-N 3.24Å; M91-N95 PolarHBondContact O-N 2.82Å
92	L	30	Very low	27.2	Very low	61 Å²	61	120.7 Å²	120.7	32%	0.319	62%	0.615	S	S	.	*	H	α-helix	trans	-63.5	-34.2	170.5	-80.2	171.4	0	0	0	111.7	N88 E94 F96	N88-L92 PolarHBondContact O-N 2.86Å; L92-E94 VanDerWaalsContact C-N 3.32Å; L92-E94 PolarHBondContact O-N 2.91Å; L92-F96 HydrophobicContact CD2-CD2 3.56Å; L92-F96 HydrophobicContact CD2-CE2 3.73Å; L92-F96 PolarHBondContact O-N 3.48Å; L92-F96 VanDerWaalsContact O-N 3.08Å
93	K	30.7	Very low	27.1	Very low	183 Å²	183	120.2 Å²	120.2	80%	0.796	62%	0.62	S	S	*	*	H	α-helix	trans	-66.4	-31.4	177.2	-77.3	-171.3	174.7	-173.5	0	113.8	M91	M91-K93 VanDerWaalsContact C-N 3.25Å; M91-K93 PolarHBondContact O-N 3.3Å
94	E	29.4	Very low	26.8	Very low	150 Å²	150	123.4 Å²	123.4	70%	0.701	63%	0.632	S	S	*	*	H	α-helix	trans	-83.2	-29.8	-177.9	-75.5	178.3	170.3	0	0	112.5	M91 L92	M91-E94 PolarHBondContact O-N 3.24Å; L92-E94 VanDerWaalsContact C-N 3.32Å; L92-E94 PolarHBondContact O-N 2.91Å
95	N	27.8	Very low	26.6	Very low	107 Å²	107	127.7 Å²	127.7	57%	0.572	65%	0.649	S	S	*	*	H	α-helix	trans	-105.5	-12.8	-173.2	-68	-38.9	0	0	0	115.1	M91	M91-N95 PolarHBondContact O-N 2.82Å
96	F	26.3	Very low	26.4	Very low	128 Å²	128	129.2 Å²	129.2	56%	0.561	66%	0.658	S	S	*	*			trans	-124	112.8	179.2	-67.5	-86.9	0	0	0	111.1	L92 S98	L92-F96 HydrophobicContact CD2-CD2 3.56Å; L92-F96 HydrophobicContact CD2-CE2 3.73Å; L92-F96 PolarHBondContact O-N 3.48Å; L92-F96 VanDerWaalsContact O-N 3.08Å; F96-S98 PolarHBondContact O-N 2.93Å
97	I	28.8	Very low	26.2	Very low	180 Å²	180	130.2 Å²	130.2	92%	0.923	67%	0.669	S	S	*	*	S	Bend	trans	-73.8	-8.9	174.4	-61.3	172.9	0	0	0	111.4
98	S	24.7	Very low	26.2	Very low	84 Å²	84	132.8 Å²	132.8	59%	0.587	69%	0.686	S	S	*	*	S	Bend	trans	-107.2	119.6	178.2	-169.2	0	0	0	0	111.3	F96 V100	F96-S98 PolarHBondContact O-N 2.93Å; S98-V100 PolarHBondContact O-N 3.31Å
99	P	25.9	Very low	26.3	Very low	109 Å²	109	133.6 Å²	133.6	71%	0.708	69%	0.69	S	S	*	*			trans	-65.7	107.2	171.3	26.3	-29.9	0	0	0	108.5	S101	P99-S101 VanDerWaalsContact C-N 3.25Å; P99-S101 PolarHBondContact O-N 3.49Å
100	V	24.1	Very low	26.2	Very low	117 Å²	117	133.5 Å²	133.5	71%	0.709	69%	0.689	S	S	*	*			trans	-66.4	86.9	172.4	-176.9	0	0	0	0	108.3	S98 K102	S98-V100 PolarHBondContact O-N 3.31Å; V100-K102 PolarHBondContact O-N 2.92Å; V100-K102 VanDerWaalsContact O-N 3.14Å
101	S	22.1	Very low	26.2	Very low	109 Å²	109	133.6 Å²	133.6	76%	0.762	69%	0.69	S	S	*	*			trans	-84	56.5	174.3	55.4	0	0	0	0	110.9	P99	P99-S101 VanDerWaalsContact C-N 3.25Å; P99-S101 PolarHBondContact O-N 3.49Å
102	K	24	Very low	26.2	Very low	185 Å²	185	130.4 Å²	130.4	80%	0.804	68%	0.676	S	S	*	*			trans	-101.7	104.3	164.8	-76.2	-171	176.6	-175.7	0	108.5	V100 L104	V100-K102 PolarHBondContact O-N 2.92Å; V100-K102 VanDerWaalsContact O-N 3.14Å; K102-L104 PolarHBondContact O-N 3.21Å
103	L	22.1	Very low	26	Very low	160 Å²	160	136.7 Å²	136.7	84%	0.838	70%	0.695	S	S	*	*			trans	-54.5	116.3	175.7	-80.9	106.1	0	0	0	110.4	H105	L103-H105 PolarHBondContact O-N 3.04Å
104	L	21.7	Very low	26	Very low	144 Å²	144	136.4 Å²	136.4	75%	0.754	69%	0.694	S	S	*	*			trans	-80.1	102.6	165.2	-88.5	155.3	0	0	0	108.5	K102 L106	K102-L104 PolarHBondContact O-N 3.21Å; L104-L106 PolarHBondContact O-N 2.97Å
105	H	20.9	Very low	26	Very low	173 Å²	173	137.4 Å²	137.4	80%	0.801	70%	0.696	S	S	*	*			trans	-69.9	111.2	166.3	-98.8	-87.7	0	0	0	109.1	L103	L103-H105 PolarHBondContact O-N 3.04Å
106	L	23.4	Very low	25.8	Very low	112 Å²	112	135.4 Å²	135.4	59%	0.586	69%	0.685	S	S	*	*			trans	-81.1	130.2	165.4	-106.5	100.5	0	0	0	108.9	L104 E108	L104-L106 PolarHBondContact O-N 2.97Å; L106-E108 PolarHBondContact O-N 3.47Å
107	P	23.3	Very low	25.9	Very low	98 Å²	98	134.9 Å²	134.9	64%	0.636	69%	0.693	S	S	*	*			trans	-61.5	134.5	170.8	22.2	-29.2	0	0	0	110	N109	P107-N109 PolarHBondContact O-N 2.85Å
108	E	26.8	Very low	25.8	Very low	187 Å²	187	131 Å²	131	87%	0.874	68%	0.682	S	S	*	*			trans	-66.9	29.8	-176.4	-69.9	-164.5	134.7	0	0	114.6	L106 N110	L106-E108 PolarHBondContact O-N 3.47Å; E108-N110 PolarHBondContact O-N 2.95Å
109	N	28.2	Very low	25.8	Very low	113 Å²	113	131.3 Å²	131.3	60%	0.604	68%	0.676	S	S	*	*			trans	-75.2	104.1	-177	-134.5	-28.5	0	0	0	110	P107 K111 V112	P107-N109 PolarHBondContact O-N 2.85Å; N109-K111 PolarHBondContact O-N 2.78Å; N109-V112 PolarHBondContact O-N 3.01Å
110	N	28.6	Very low	25.6	Very low	123 Å²	123	134.8 Å²	134.8	66%	0.658	68%	0.682	S	S	*	*	H	α-helix	trans	-51.3	-21.3	-172	-89.5	-35.9	0	0	0	115.7	E108	E108-N110 PolarHBondContact O-N 2.95Å
111	K	31.5	Very low	25.6	Very low	178 Å²	178	136.2 Å²	136.2	77%	0.774	69%	0.686	S	S	*	*	H	α-helix	trans	-73.6	-28.6	177	-74.2	-178.5	179	175.2	0	113.4	N109	N109-K111 PolarHBondContact O-N 2.78Å
112	V	31	Very low	25.5	Very low	38 Å²	38	135.5 Å²	135.5	23%	0.23	67%	0.673	C	S	.	*	H	α-helix	trans	-73.3	-36.7	179.7	-173.8	0	0	0	0	110.5	M72 N109 K114 K115 L116	M72-V112 HydrophobicContact CE-CG2 3.99Å; N109-V112 PolarHBondContact O-N 3.01Å; V112-K114 VanDerWaalsContact C-N 3.35Å; V112-K114 PolarHBondContact O-N 3.41Å; V112-K115 PolarHBondContact O-N 2.67Å; V112-L116 HydrophobicContact CG1-CD1 3.87Å; V112-L116 PolarHBondContact O-N 2.78Å
113	R	25.3	Very low	25.4	Very low	192 Å²	192	135.3 Å²	135.3	73%	0.725	68%	0.675	S	S	*	*	H	α-helix	trans	-57.8	-42.2	174.8	-98.2	-174.4	176.1	173.8	2.6	113.2	K115 L116 T117	R113-K115 VanDerWaalsContact C-N 3.32Å; R113-K115 PolarHBondContact O-N 3.38Å; R113-L116 PolarHBondContact O-N 3Å; R113-T117 PolarHBondContact O-N 3.2Å
114	K	29.1	Very low	25.3	Very low	177 Å²	177	134.2 Å²	134.2	77%	0.77	67%	0.669	S	S	*	*	H	α-helix	trans	-68.7	-27.3	-179.3	-76.6	-170.8	176.5	-177.1	0	113.7	V112 T117	V112-K114 VanDerWaalsContact C-N 3.35Å; V112-K114 PolarHBondContact O-N 3.41Å; K114-T117 PolarHBondContact O-OG1 3Å; K114-T117 VanDerWaalsContact O-OG1 3.08Å
115	K	29.4	Very low	25.2	Very low	172 Å²	172	135.3 Å²	135.3	75%	0.748	67%	0.674	S	S	*	*	H	α-helix	trans	-84.2	-24.8	176.9	-76.3	-168.6	174.8	-173.9	0	113.4	V112 R113 S118	V112-K115 PolarHBondContact O-N 2.67Å; R113-K115 VanDerWaalsContact C-N 3.32Å; R113-K115 PolarHBondContact O-N 3.38Å; K115-S118 PolarHBondContact O-OG 3.48Å
116	L	25	Very low	25.2	Very low	64 Å²	64	136.3 Å²	136.3	34%	0.335	68%	0.677	S	S	.	*	H	α-helix	trans	-79.2	-24.2	178	-85.6	155.6	0	0	0	113.7	V112 R113 S118 I119 I122	V112-L116 HydrophobicContact CG1-CD1 3.87Å; V112-L116 PolarHBondContact O-N 2.78Å; R113-L116 PolarHBondContact O-N 3Å; L116-S118 PolarHBondContact O-N 2.99Å; L116-I119 PolarHBondContact O-N 2.71Å; L116-I122 HydrophobicContact CD2-CD1 4.04Å
117	T	27.4	Very low	25	Very low	117 Å²	117	137.8 Å²	137.8	72%	0.718	68%	0.684	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.8	-17.5	178.5	38.7	0	0	0	0	114.4	R113 K114 I119	R113-T117 PolarHBondContact O-N 3.2Å; K114-T117 PolarHBondContact O-OG1 3Å; K114-T117 VanDerWaalsContact O-OG1 3.08Å; T117-I119 VanDerWaalsContact C-N 3.27Å; T117-I119 PolarHBondContact O-N 3.12Å
118	S	27.4	Very low	24.9	Very low	100 Å²	100	138.2 Å²	138.2	70%	0.699	69%	0.687	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.8	-4.5	176.8	64.3	0	0	0	0	113.9	K115 L116	K115-S118 PolarHBondContact O-OG 3.48Å; L116-S118 PolarHBondContact O-N 2.99Å
119	I	24.7	Very low	24.7	Very low	90 Å²	90	134 Å²	134	46%	0.462	68%	0.684	S	S	.	*			trans	-106.8	89.3	-177.4	-52.4	175.3	0	0	0	107.7	L116 T117 N121 I122	L116-I119 PolarHBondContact O-N 2.71Å; T117-I119 VanDerWaalsContact C-N 3.27Å; T117-I119 PolarHBondContact O-N 3.12Å; I119-N121 PolarHBondContact O-N 2.84Å; I119-I122 HydrophobicContact CG2-CD1 4.29Å; I119-I122 HydrophobicContact CG2-CG1 4.24Å
120	Q	22.7	Very low	24.4	Very low	181 Å²	181	135.3 Å²	135.3	85%	0.846	69%	0.691	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.4	1.5	-174.8	-77.9	-177.9	-25.3	0	0	115.8
121	N	22.5	Very low	24	Very low	148 Å²	148	134.8 Å²	134.8	79%	0.791	70%	0.696	S	S	*	*	T	Hydrogen-bonded Turn	trans	-115.2	7.9	-173.4	-70.4	-14.8	0	0	0	115.5	I119	I119-N121 PolarHBondContact O-N 2.84Å
122	I	21.3	Very low	23.4	Very low	93 Å²	93	130.7 Å²	130.7	48%	0.477	69%	0.689	S	S	.	*			trans	-104.2	90.7	172.6	-52.8	176.4	0	0	0	108.8	L116 I119 L124	L116-I122 HydrophobicContact CD2-CD1 4.04Å; I119-I122 HydrophobicContact CG2-CD1 4.29Å; I119-I122 HydrophobicContact CG2-CG1 4.24Å; I122-L124 VanDerWaalsContact C-N 3.3Å; I122-L124 PolarHBondContact O-N 3.35Å
123	H	21.2	Very low	22.8	Very low	182 Å²	182	135.5 Å²	135.5	84%	0.843	72%	0.719	S	S	*	*			trans	-67.8	91.3	165.1	-78.8	-82	0	0	0	108.8	L125	H123-L125 PolarHBondContact O-N 3.34Å
124	L	20.4	Very low	22.6	Very low	137 Å²	137	131.1 Å²	131.1	72%	0.717	71%	0.714	S	S	*	*			trans	-58.5	117.2	155.2	-97.2	119.1	0	0	0	106.6	I122 K126	I122-L124 VanDerWaalsContact C-N 3.3Å; I122-L124 PolarHBondContact O-N 3.35Å; L124-K126 PolarHBondContact O-N 3Å
125	L	19.8	Very low	22.1	Very low	166 Å²	166	128 Å²	128	87%	0.869	71%	0.712	S	S	*	*			trans	-60	87	167.8	-82.8	156.3	0	0	0	107.7	H123 L127	H123-L125 PolarHBondContact O-N 3.34Å; L125-L127 PolarHBondContact O-N 3.5Å; L125-L127 VanDerWaalsContact O-N 3.12Å
126	K	21.3	Very low	21.6	Very low	195 Å²	195	130.9 Å²	130.9	85%	0.848	72%	0.718	S	S	*	*			trans	-69.1	105.3	175.1	-148.3	177.6	-173.1	-178.4	0	105.4	L124	L124-K126 PolarHBondContact O-N 3Å
127	L	19.4	Very low	21.4	Very low	142 Å²	142	135.5 Å²	135.5	74%	0.743	74%	0.738	S	S	*	*			trans	-49.9	131	169.8	-94.9	99.4	0	0	0	108.1	L125 A129	L125-L127 PolarHBondContact O-N 3.5Å; L125-L127 VanDerWaalsContact O-N 3.12Å; L127-A129 PolarHBondContact O-N 2.92Å
128	P	20.1	Very low	21.2	Very low	107 Å²	107	136.8 Å²	136.8	70%	0.695	74%	0.74	S	S	*	*			trans	-57.7	124.3	175.7	-18.6	29.7	0	0	0	108.8	N130	P128-N130 PolarHBondContact O-N 3.11Å
129	A	22.4	Very low	20.9	Very low	98 Å²	98	138.7 Å²	138.7	81%	0.81	74%	0.743	S	S	*	*	S	Bend	trans	-68.3	22.2	-171.8	0	0	0	0	0	115.6	L127	L127-A129 PolarHBondContact O-N 2.92Å
130	N	22.3	Very low	20.9	Very low	142 Å²	142	141.4 Å²	141.4	76%	0.759	76%	0.758	S	S	*	*			trans	-125.6	37.8	179.9	-73.6	0.4	0	0	0	112.5	P128 S132	P128-N130 PolarHBondContact O-N 3.11Å; N130-S132 PolarHBondContact O-N 3.09Å
131	C	20	Very low	21	Very low	111 Å²	111	140.7 Å²	140.7	75%	0.75	75%	0.754	S	S	*	*			trans	-67.9	85.4	147.9	-71.2	0	0	0	0	106.1	T133	C131-T133 PolarHBondContact O-N 3Å; C131-T133 VanDerWaalsContact O-N 3.15Å
132	S	18.8	Very low	21	Very low	92 Å²	92	139.9 Å²	139.9	64%	0.643	75%	0.75	S	S	*	*			trans	-50.6	121.7	167.3	53.3	0	0	0	0	106.9	N130 V134	N130-S132 PolarHBondContact O-N 3.09Å; S132-V134 PolarHBondContact O-N 3.44Å
133	T	19.2	Very low	21.1	Very low	140 Å²	140	144 Å²	144	86%	0.859	77%	0.772	S	S	*	*			trans	-56.5	80.8	163.5	45.1	0	0	0	0	108.2	C131	C131-T133 PolarHBondContact O-N 3Å; C131-T133 VanDerWaalsContact O-N 3.15Å
134	V	19.5	Very low	21.2	Very low	100 Å²	100	142.6 Å²	142.6	61%	0.606	77%	0.771	S	S	*	*			trans	-71.9	122.9	155.1	-176.3	0	0	0	0	103.6	S132 W136	S132-V134 PolarHBondContact O-N 3.44Å; V134-W136 VanDerWaalsContact C-N 3.29Å; V134-W136 PolarHBondContact O-N 3.36Å
135	P	19.6	Very low	21.3	Very low	112 Å²	112	144.4 Å²	144.4	73%	0.727	77%	0.773	S	S	*	*			trans	-64.8	96.6	-179.7	26.6	-30.4	0	0	0	106.6	E137	P135-E137 PolarHBondContact O-N 3.12Å
136	W	19.7	Very low	21.5	Very low	232 Å²	232	144.4 Å²	144.4	88%	0.879	77%	0.773	S	S	*	*			trans	-80.6	104	176.9	-153.3	-61.3	0	0	0	106.3	V134 N138	V134-W136 VanDerWaalsContact C-N 3.29Å; V134-W136 PolarHBondContact O-N 3.36Å; W136-N138 PolarHBondContact O-N 3.19Å
137	E	20.8	Very low	21.6	Very low	161 Å²	161	140.3 Å²	140.3	75%	0.752	76%	0.76	S	S	*	*			trans	-54.9	132.2	178.3	-70.7	176.7	147.6	0	0	110.8	P135 N139	P135-E137 PolarHBondContact O-N 3.12Å; E137-N139 PolarHBondContact O-N 2.86Å; E137-N139 VanDerWaalsContact O-N 3.09Å
138	N	22.2	Very low	22	Very low	144 Å²	144	136.3 Å²	136.3	77%	0.77	74%	0.744	S	S	*	*			trans	-31.2	106.9	170.1	-62.5	-13.1	0	0	0	112.3	W136	W136-N138 PolarHBondContact O-N 3.19Å
139	N	21.9	Very low	22.5	Very low	140 Å²	140	136.8 Å²	136.8	75%	0.749	74%	0.74	S	S	*	*			trans	-144.7	92.8	159	-83.7	-46.2	0	0	0	106.7	E137 H141	E137-N139 PolarHBondContact O-N 2.86Å; E137-N139 VanDerWaalsContact O-N 3.09Å; N139-H141 PolarHBondContact O-N 3.47Å
140	D	23.8	Very low	23.1	Very low	146 Å²	146	137.8 Å²	137.8	78%	0.781	73%	0.731	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.2	29.7	-171.9	-69.7	-45.5	0	0	0	115.5
141	H	24.3	Very low	23.5	Very low	167 Å²	167	135.4 Å²	135.4	77%	0.773	72%	0.716	S	S	*	*	T	Hydrogen-bonded Turn	trans	-129.6	13.6	-169.4	-68.2	-36.6	0	0	0	117.1	N139	N139-H141 PolarHBondContact O-N 3.47Å
142	N	22.6	Very low	24	Very low	131 Å²	131	134.2 Å²	134.2	70%	0.701	70%	0.701	S	S	*	*			trans	-149.3	62.2	177.2	-79	-56.5	0	0	0	114.5	N144	N142-N144 VanDerWaalsContact C-N 3.3Å; N142-N144 PolarHBondContact O-N 3.4Å
143	L	23	Very low	24.6	Very low	178 Å²	178	135.7 Å²	135.7	93%	0.932	70%	0.696	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.5	-5.5	172.9	-84.5	168.3	0	0	0	114.8
144	N	23.3	Very low	25.2	Very low	153 Å²	153	132.4 Å²	132.4	82%	0.818	68%	0.679	S	S	*	*	T	Hydrogen-bonded Turn	trans	-122.7	32.8	-173.6	-69.6	-28.7	0	0	0	114.4	N142 L146	N142-N144 VanDerWaalsContact C-N 3.3Å; N142-N144 PolarHBondContact O-N 3.4Å; N144-L146 PolarHBondContact O-N 3.13Å; N144-L146 VanDerWaalsContact O-N 3.08Å
145	K	23	Very low	25.7	Very low	175 Å²	175	133.5 Å²	133.5	76%	0.761	68%	0.68	S	S	*	*			trans	-79.3	99.2	177.3	-142	175.1	-172.8	179	0	110.5	L147	K145-L147 PolarHBondContact O-N 3.37Å
146	L	23.9	Very low	26.2	Very low	167 Å²	167	133.8 Å²	133.8	87%	0.874	68%	0.68	S	S	*	*	P	Polyproline II helix	trans	-53.8	120	168.2	-74.9	158	0	0	0	109.4	N144	N144-L146 PolarHBondContact O-N 3.13Å; N144-L146 VanDerWaalsContact O-N 3.08Å
147	L	24.7	Very low	26.6	Very low	109 Å²	109	131.2 Å²	131.2	57%	0.571	68%	0.675	S	S	*	*	P	Polyproline II helix	trans	-63	136.1	174.4	-77.2	158.2	0	0	0	109.9	K145 E151 I152	K145-L147 PolarHBondContact O-N 3.37Å; L147-E151 HydrophobicContact CD2-CB 4.16Å; L147-I152 HydrophobicContact CB-CG1 4.31Å
148	S	27.1	Very low	26.8	Very low	58 Å²	58	132.3 Å²	132.3	41%	0.406	68%	0.678	S	S	.	*	P	Polyproline II helix	trans	-68.4	152	175.4	68.6	0	0	0	0	110.8	D150 E151 I152	S148-D150 PolarHBondContact O-N 3.49Å; S148-D150 VanDerWaalsContact O-N 3.14Å; S148-E151 PolarHBondContact N-OE2 2.77Å; S148-E151 WeakPolarHBondContact O-CB 3.48Å; S148-E151 PolarHBondContact O-N 2.89Å; S148-E151 WeakPolarHBondContact OG-CG 3.46Å; S148-E151 PolarHBondContact OG-OE2 2.95Å; S148-I152 PolarHBondContact O-N 2.78Å
149	L	29.8	Very low	26.9	Very low	117 Å²	117	132 Å²	132	61%	0.613	68%	0.676	S	S	*	*	H	α-helix	trans	-59.2	-28.6	-178.6	-161.8	74.3	0	0	0	112.4	I152 K153	L149-I152 PolarHBondContact O-N 3.12Å; L149-K153 WeakPolarHBondContact O-CG 3.3Å; L149-K153 PolarHBondContact O-N 3.44Å
150	D	35.3	Very low	27	Very low	119 Å²	119	132.9 Å²	132.9	64%	0.636	68%	0.68	S	S	*	*	H	α-helix	trans	-71.8	-35.4	177.4	-71.5	-24.8	0	0	0	112.4	S148 K153 S154	S148-D150 PolarHBondContact O-N 3.49Å; S148-D150 VanDerWaalsContact O-N 3.14Å; D150-K153 PolarHBondContact O-N 3.34Å; D150-S154 PolarHBondContact O-N 2.99Å
151	E	31.8	Very low	27.1	Very low	92 Å²	92	135.4 Å²	135.4	43%	0.43	68%	0.684	S	S	.	*	H	α-helix	trans	-65.7	-41.9	172.6	-74.1	167.6	135.6	0	0	110.9	L147 S148 K153 S154 L155	L147-E151 HydrophobicContact CD2-CB 4.16Å; S148-E151 PolarHBondContact N-OE2 2.77Å; S148-E151 WeakPolarHBondContact O-CB 3.48Å; S148-E151 PolarHBondContact O-N 2.89Å; S148-E151 WeakPolarHBondContact OG-CG 3.46Å; S148-E151 PolarHBondContact OG-OE2 2.95Å; E151-K153 VanDerWaalsContact C-N 3.34Å; E151-K153 PolarHBondContact O-N 3.16Å; E151-S154 PolarHBondContact O-N 3.47Å; E151-S154 VanDerWaalsContact O-N 3.16Å; E151-S154 PolarHBondContact O-OG 3.05Å; E151-L155 PolarHBondContact O-N 3.14Å; E151-L155 VanDerWaalsContact O-N 3.13Å
152	I	28.7	Very low	27.1	Very low	86 Å²	86	133.5 Å²	133.5	44%	0.441	68%	0.684	S	S	.	*	H	α-helix	trans	-62.7	-40.6	175.1	-59.9	173.3	0	0	0	110.9	L147 S148 L149 S154 L155 T156	L147-I152 HydrophobicContact CB-CG1 4.31Å; S148-I152 PolarHBondContact O-N 2.78Å; L149-I152 PolarHBondContact O-N 3.12Å; I152-S154 VanDerWaalsContact C-N 3.34Å; I152-L155 WeakPolarHBondContact O-CB 3.48Å; I152-L155 PolarHBondContact O-N 2.98Å; I152-T156 PolarHBondContact O-N 3.08Å
153	K	32.3	Very low	27.1	Very low	123 Å²	123	135.3 Å²	135.3	54%	0.535	69%	0.691	S	S	.	*	H	α-helix	trans	-66.9	-34.1	175	-76.8	176.9	-177.7	172.2	0	112.3	L149 D150 E151 L155 T156	L149-K153 WeakPolarHBondContact O-CG 3.3Å; L149-K153 PolarHBondContact O-N 3.44Å; D150-K153 PolarHBondContact O-N 3.34Å; E151-K153 VanDerWaalsContact C-N 3.34Å; E151-K153 PolarHBondContact O-N 3.16Å; K153-L155 VanDerWaalsContact C-N 3.33Å; K153-L155 PolarHBondContact O-N 3.29Å; K153-T156 PolarHBondContact O-N 3.32Å; K153-T156 PolarHBondContact O-OG1 3.45Å
154	S	32.3	Very low	27.1	Very low	71 Å²	71	136.3 Å²	136.3	50%	0.497	69%	0.687	S	S	.	*	H	α-helix	trans	-65.7	-36.4	176.3	79.7	0	0	0	0	112.3	D150 E151 I152 T156 K157	D150-S154 PolarHBondContact O-N 2.99Å; E151-S154 PolarHBondContact O-N 3.47Å; E151-S154 VanDerWaalsContact O-N 3.16Å; E151-S154 PolarHBondContact O-OG 3.05Å; I152-S154 VanDerWaalsContact C-N 3.34Å; S154-T156 VanDerWaalsContact C-N 3.33Å; S154-T156 PolarHBondContact O-N 3.24Å; S154-K157 PolarHBondContact O-N 3.07Å
155	L	30.2	Very low	27.1	Very low	122 Å²	122	138.9 Å²	138.9	64%	0.639	69%	0.691	S	S	*	*	H	α-helix	trans	-63.4	-35.1	177.2	-97.3	136.4	0	0	0	113.1	E151 I152 K153 K157 F158	E151-L155 PolarHBondContact O-N 3.14Å; E151-L155 VanDerWaalsContact O-N 3.13Å; I152-L155 WeakPolarHBondContact O-CB 3.48Å; I152-L155 PolarHBondContact O-N 2.98Å; K153-L155 VanDerWaalsContact C-N 3.33Å; K153-L155 PolarHBondContact O-N 3.29Å; L155-K157 VanDerWaalsContact C-N 3.26Å; L155-K157 PolarHBondContact O-N 3.22Å; L155-F158 PolarHBondContact O-N 2.87Å
156	T	29.5	Very low	27.1	Very low	119 Å²	119	137.4 Å²	137.4	73%	0.73	70%	0.697	S	S	*	*	H	α-helix	trans	-72.1	-17.2	178.1	52	0	0	0	0	113.7	I152 K153 S154	I152-T156 PolarHBondContact O-N 3.08Å; K153-T156 PolarHBondContact O-N 3.32Å; K153-T156 PolarHBondContact O-OG1 3.45Å; S154-T156 VanDerWaalsContact C-N 3.33Å; S154-T156 PolarHBondContact O-N 3.24Å
157	K	28.2	Very low	27	Very low	178 Å²	178	138.6 Å²	138.6	77%	0.774	70%	0.695	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.9	0.5	176.6	-77.2	-176.2	177.8	177.2	0	114.3	S154 L155 N159	S154-K157 PolarHBondContact O-N 3.07Å; L155-K157 VanDerWaalsContact C-N 3.26Å; L155-K157 PolarHBondContact O-N 3.22Å; K157-N159 PolarHBondContact O-N 3.38Å
158	F	24.6	Very low	26.8	Very low	183 Å²	183	142.7 Å²	142.7	80%	0.803	71%	0.711	S	S	*	*			trans	-75	100.5	-178	-139.1	-96.8	0	0	0	111.1	L155	L155-F158 PolarHBondContact O-N 2.87Å
159	N	25.4	Very low	26.5	Very low	137 Å²	137	148.6 Å²	148.6	73%	0.733	73%	0.732	S	S	*	*			trans	-76.1	135.9	-162.7	-127.5	-39.5	0	0	0	113.2	K157 K161	K157-N159 PolarHBondContact O-N 3.38Å; N159-K161 PolarHBondContact O-N 3.29Å
160	L	24.3	Very low	26	Very low	159 Å²	159	148.7 Å²	148.7	83%	0.832	74%	0.742	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.5	12.4	-168.5	-156.1	77.4	0	0	0	117.2
161	K	24.3	Very low	25.1	Very low	200 Å²	200	150.2 Å²	150.2	87%	0.87	75%	0.749	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.4	-11.6	-168.6	-84.5	-174.8	176.9	178	0	116.4	N159 M163	N159-K161 PolarHBondContact O-N 3.29Å; K161-M163 PolarHBondContact O-N 2.92Å
162	T	25.8	Very low	24.5	Very low	126 Å²	126	153.5 Å²	153.5	77%	0.773	77%	0.77	S	S	*	*			trans	-102.7	60.3	-179.8	34.9	0	0	0	0	112.4
163	M	22	Very low	24.1	Very low	170 Å²	170	157 Å²	157	84%	0.837	79%	0.788	S	S	*	*			trans	-127	68.7	170.9	-91.5	-162.9	143.8	0	0	110.9	K161	K161-M163 PolarHBondContact O-N 2.92Å
164	K	22.4	Very low	23.4	Very low	199 Å²	199	160.1 Å²	160.1	87%	0.865	80%	0.804	S	S	*	*			trans	-142.5	120.4	160.6	-77.2	-169.6	178.6	177.1	0	109.6
165	K	24.2	Very low	22.9	Very low	206 Å²	206	164.7 Å²	164.7	90%	0.896	82%	0.822	S	S	*	*			trans	89.6	118.3	173.9	-53.2	173.4	-179.9	-179.1	0	114.7
166	V	23.3	Very low	22.4	Very low	145 Å²	145	166.3 Å²	166.3	88%	0.879	83%	0.831	S	S	*	*			trans	-176.7	138.7	133	157.1	0	0	0	0	109
167	K	21.5	Very low	22.1	Very low	192 Å²	192	170.2 Å²	170.2	84%	0.835	84%	0.838	S	S	*	*			trans	-86.3	154.8	-171.9	-75	177	172.7	180	0	112.5
168	Q	20.6	Very low	21.8	Very low	195 Å²	195	165.4 Å²	165.4	91%	0.911	83%	0.826	S	S	*	*			trans	-70.7	134.8	179.8	-67.9	161.6	-35.3	0	0	112.7
169	H	20.3	Very low	21.7	Very low	181 Å²	181	165.4 Å²	165.4	84%	0.838	83%	0.828	S	S	*	*			trans	-121.3	130.9	164.4	-76.7	-62	0	0	0	110.1
170	S	18.6	Very low	21.5	Very low	120 Å²	120	168.3 Å²	168.3	84%	0.839	84%	0.835	S	S	*	*			trans	-90.4	128.3	176.4	49.8	0	0	0	0	110.5
171	I	17.8	Very low	21.3	Very low	150 Å²	150	167.9 Å²	167.9	77%	0.769	83%	0.833	S	S	*	*			trans	-107.2	124.1	-179.8	-60.2	170.7	0	0	0	108.9
172	N	18.9	Very low	21.1	Very low	162 Å²	162	165.4 Å²	165.4	87%	0.866	83%	0.828	S	S	*	*			trans	-87.2	127.2	171.6	-86.4	-28.1	0	0	0	109.4
173	L	18.7	Very low	20.9	Very low	160 Å²	160	167.3 Å²	167.3	84%	0.838	83%	0.834	S	S	*	*			trans	-104.4	118.2	175.9	-81	157.3	0	0	0	110.2
174	H	19.2	Very low	20.9	Very low	188 Å²	188	168.4 Å²	168.4	87%	0.87	84%	0.837	S	S	*	*			trans	-80.1	112.8	172.9	-111.7	-89	0	0	0	109.1	L176	H174-L176 PolarHBondContact O-N 3.31Å
175	L	21.2	Very low	20.8	Very low	166 Å²	166	167.4 Å²	167.4	87%	0.869	84%	0.835	S	S	*	*			trans	-73.2	118	167.6	-86.4	109.1	0	0	0	109.7
176	L	19.5	Very low	20.7	Very low	157 Å²	157	166.4 Å²	166.4	82%	0.822	83%	0.834	S	S	*	*			trans	-70.9	129.4	173.5	-86.1	152.5	0	0	0	110.2	H174	H174-L176 PolarHBondContact O-N 3.31Å
177	K	22.6	Very low	20.7	Very low	200 Å²	200	168.4 Å²	168.4	87%	0.87	84%	0.838	S	S	*	*			trans	-99	24.7	-165.1	-145.3	178.7	-174.1	-176.4	0	113
178	S	22.5	Very low	20.6	Very low	77 Å²	77	164 Å²	164	54%	0.538	83%	0.832	S	S	.	*			trans	-107.6	9.4	-157.2	50.6	0	0	0	0	117.9
179	H	21.9	Very low	20.7	Very low	183 Å²	183	161.7 Å²	161.7	85%	0.847	83%	0.826	S	S	*	*			trans	-108.7	18.1	177.9	-66.8	-74.3	0	0	0	115.2
180	F	21.2	Very low	20.8	Very low	199 Å²	199	162.6 Å²	162.6	87%	0.873	83%	0.827	S	S	*	*			trans	-104.4	68.1	168.4	-77.1	-77.3	0	0	0	110.5
181	L	21.1	Very low	20.8	Very low	149 Å²	149	161.7 Å²	161.7	78%	0.78	82%	0.821	S	S	*	*			trans	-147.7	127.6	167.6	-95.4	167.8	0	0	0	109.3
182	L	20.5	Very low	21	Very low	148 Å²	148	162.1 Å²	162.1	78%	0.775	83%	0.825	S	S	*	*			trans	84.2	87.1	157.6	-57	158.1	0	0	0	116.8
183	N	20.9	Very low	21.1	Very low	166 Å²	166	157.4 Å²	157.4	89%	0.888	82%	0.815	S	S	*	*				-151.8	67.3	120.6	-93.5	-18.5	0	0	0	108.1	Q185	N183-Q185 PolarHBondContact O-N 2.91Å
184	E	21	Very low	21.3	Very low	193 Å²	193	160.2 Å²	160.2	90%	0.902	82%	0.816	S	S	*	*			trans	-85.6	86.3	158.8	-76.5	-158	167.3	0	0	107.9
185	Q	21.7	Very low	21.2	Very low	178 Å²	178	160.6 Å²	160.6	83%	0.832	82%	0.817	S	S	*	*			trans	-151.1	128.2	161.8	-108.7	164.2	23.2	0	0	108.2	N183	N183-Q185 PolarHBondContact O-N 2.91Å
186	E	22.7	Very low	21.2	Very low	186 Å²	186	160.8 Å²	160.8	87%	0.869	81%	0.814	S	S	*	*	S	Bend	trans	89.5	28.8	172.3	-54	-164.1	154.3	0	0	120.9
187	L	22.1	Very low	21.2	Very low	186 Å²	186	161.6 Å²	161.6	97%	0.974	82%	0.818	S	S	*	*			trans	-108.5	50.3	154.1	-90.3	137.8	0	0	0	111.7
188	S	20.3	Very low	21	Very low	101 Å²	101	159.2 Å²	159.2	71%	0.706	81%	0.814	S	S	*	*			trans	-93.7	86.9	164.4	156.6	0	0	0	0	108.1
189	N	21.7	Very low	20.8	Very low	146 Å²	146	165 Å²	165	78%	0.781	83%	0.829	S	S	*	*	S	Bend	trans	166.6	125.9	137.9	-84.5	-34.5	0	0	0	111.9
190	K	22.2	Very low	20.7	Very low	199 Å²	199	164 Å²	164	87%	0.865	83%	0.83	S	S	*	*			trans	82.9	81.1	170.7	-60.5	-179.4	179.6	175.3	0	116.9
191	S	19.8	Very low	20.6	Very low	101 Å²	101	161.7 Å²	161.7	71%	0.706	83%	0.827	S	S	*	*			trans	-23.8	122.8	139.1	56.4	0	0	0	0	115.4
192	N	21.5	Very low	20.6	Very low	160 Å²	160	162.3 Å²	162.3	86%	0.856	83%	0.825	S	S	*	*				157.3	115.3	116.5	-82.8	-21.7	0	0	0	111.2
193	G	21.7	Very low	20.6	Very low	63 Å²	63	162 Å²	162	65%	0.649	83%	0.825	S	S	*	*			trans	119.4	110.2	147.9	0	0	0	0	0	116.4
194	Y	21	Very low	20.6	Very low	219 Å²	219	161.8 Å²	161.8	86%	0.859	82%	0.823	S	S	*	*			trans	88.6	59.9	152.8	-55.8	-79.8	0	0	0	119.1
195	H	18.4	Very low	20.6	Very low	195 Å²	195	157.2 Å²	157.2	90%	0.903	81%	0.813	S	S	*	*			trans	-92.6	96.4	140.4	-74.2	-75.7	0	0	0	109.2
196	Q	20.3	Very low	20.6	Very low	170 Å²	170	156.2 Å²	156.2	79%	0.794	81%	0.813	S	S	*	*			trans	-131.7	96.5	159.7	-90.4	-174.3	-4.9	0	0	109.2	L198	Q196-L198 PolarHBondContact O-N 3.43Å
197	L	19.2	Very low	20.5	Very low	174 Å²	174	153.5 Å²	153.5	91%	0.911	80%	0.803	S	S	*	*			trans	-54.2	103.1	161.1	-86.5	135	0	0	0	109.1	K199	L197-K199 PolarHBondContact O-N 2.95Å
198	L	18.7	Very low	20.4	Very low	150 Å²	150	154.7 Å²	154.7	79%	0.785	80%	0.801	S	S	*	*			trans	-69.3	92.6	172	-96.4	143.8	0	0	0	109.7	Q196 L200	Q196-L198 PolarHBondContact O-N 3.43Å; L198-L200 VanDerWaalsContact C-N 3.35Å; L198-L200 PolarHBondContact O-N 3.24Å
199	K	19	Very low	20.5	Very low	198 Å²	198	159.1 Å²	159.1	86%	0.861	80%	0.803	S	S	*	*			trans	-62.4	96.5	155.7	-92.1	178.4	174.3	174.1	0	107.8	L197 N201	L197-K199 PolarHBondContact O-N 2.95Å; K199-N201 PolarHBondContact O-N 3.34Å
200	L	19.5	Very low	20.4	Very low	163 Å²	163	161.5 Å²	161.5	85%	0.853	81%	0.81	S	S	*	*			trans	-71.1	81.8	168.9	-75.1	166.3	0	0	0	108.8	L198	L198-L200 VanDerWaalsContact C-N 3.35Å; L198-L200 PolarHBondContact O-N 3.24Å
201	N	19.9	Very low	20.3	Very low	151 Å²	151	160.1 Å²	160.1	81%	0.807	81%	0.811	S	S	*	*			trans	-86.6	129.9	170.2	-145.5	1.5	0	0	0	108.8	K199	K199-N201 PolarHBondContact O-N 3.34Å
202	Q	20	Very low	20.4	Very low	161 Å²	161	160.3 Å²	160.3	75%	0.752	81%	0.812	S	S	*	*			trans	-60.4	149.3	178.7	-71.8	165.7	-20.3	0	0	110.7
203	N	20.6	Very low	20.4	Very low	143 Å²	143	158 Å²	158	77%	0.765	81%	0.808	S	S	*	*			trans	88.6	87.5	166.7	-45.3	-28.6	0	0	0	115.8
204	N	22.1	Very low	20.5	Very low	161 Å²	161	161.8 Å²	161.8	86%	0.861	81%	0.814	S	S	*	*				-175.6	134.5	116.4	-91.4	-25.3	0	0	0	111.7
205	S	21.1	Very low	20.4	Very low	97 Å²	97	154.6 Å²	154.6	68%	0.678	81%	0.806	S	S	*	*			trans	-59.3	146.8	173.5	46.8	0	0	0	0	113.5
206	N	20.8	Very low	20.5	Very low	157 Å²	157	155.3 Å²	155.3	84%	0.84	81%	0.807	S	S	*	*			trans	67.9	69.2	155.3	-60.9	-20.6	0	0	0	117.8
207	I	20.3	Very low	20.5	Very low	128 Å²	128	155.2 Å²	155.2	66%	0.656	81%	0.811	S	S	*	*			trans	-120.7	111.3	154.8	-59.4	178.3	0	0	0	108.4	Y209	I207-Y209 HydrophobicContact CB-CE2 4.35Å; I207-Y209 HydrophobicContact CG2-CE2 4.2Å; I207-Y209 WeakPolarHBondContact O-CD2 3.49Å; I207-Y209 PolarHBondContact O-N 2.97Å
208	K	19.4	Very low	20.5	Very low	212 Å²	212	155.1 Å²	155.1	92%	0.922	81%	0.81	S	S	*	*			trans	-66.2	104.7	170.9	-75.4	176.3	176	177.1	0	108.2	Q210	K208-Q210 PolarHBondContact O-N 3.49Å
209	Y	22.4	Very low	20.5	Very low	194 Å²	194	158.2 Å²	158.2	76%	0.761	81%	0.812	S	S	*	*			trans	-79	109.7	167.7	-72.6	-82.6	0	0	0	109.2	I207 L211	I207-Y209 HydrophobicContact CB-CE2 4.35Å; I207-Y209 HydrophobicContact CG2-CE2 4.2Å; I207-Y209 WeakPolarHBondContact O-CD2 3.49Å; I207-Y209 PolarHBondContact O-N 2.97Å; Y209-L211 PolarHBondContact O-N 3.15Å
210	Q	20.4	Very low	20.5	Very low	196 Å²	196	155.9 Å²	155.9	92%	0.916	81%	0.808	S	S	*	*			trans	-68.9	101.3	164.3	-131	169.9	-6	0	0	106.6	K208 S212	K208-Q210 PolarHBondContact O-N 3.49Å; Q210-S212 PolarHBondContact O-N 3.22Å
211	L	21.1	Very low	20.6	Very low	169 Å²	169	153.5 Å²	153.5	89%	0.885	80%	0.802	S	S	*	*			trans	-64.2	103.5	175.4	-85.7	148.7	0	0	0	108.8	Y209 S213	Y209-L211 PolarHBondContact O-N 3.15Å; L211-S213 PolarHBondContact O-N 3.04Å
212	S	21.1	Very low	20.7	Very low	106 Å²	106	155.3 Å²	155.3	74%	0.741	80%	0.799	S	S	*	*			trans	-61.8	129.8	170.2	179.9	0	0	0	0	110	Q210 N214	Q210-S212 PolarHBondContact O-N 3.22Å; S212-N214 VanDerWaalsContact C-N 3.35Å; S212-N214 PolarHBondContact O-N 3Å
213	S	22	Very low	20.8	Very low	111 Å²	111	155.6 Å²	155.6	78%	0.776	81%	0.805	S	S	*	*	S	Bend	trans	-82.5	35	-154.1	52.4	0	0	0	0	116.6	L211	L211-S213 PolarHBondContact O-N 3.04Å
214	N	22.3	Very low	20.8	Very low	143 Å²	143	154 Å²	154	77%	0.765	80%	0.803	S	S	*	*			trans	-115.3	8.6	-171.2	-72.2	-2.4	0	0	0	116.2	S212 K216	S212-N214 VanDerWaalsContact C-N 3.35Å; S212-N214 PolarHBondContact O-N 3Å; N214-K216 PolarHBondContact O-N 3.45Å
215	G	19.7	Very low	20.7	Very low	68 Å²	68	154.2 Å²	154.2	70%	0.701	80%	0.799	S	S	*	*			trans	-83.8	100.2	170.3	0	0	0	0	0	111.4	L217	G215-L217 VanDerWaalsContact C-N 3.29Å; G215-L217 PolarHBondContact O-N 2.86Å
216	K	21.5	Very low	20.8	Very low	210 Å²	210	155.3 Å²	155.3	91%	0.913	80%	0.804	S	S	*	*			trans	-63.9	89	168.2	-73.1	179.3	179.4	176.9	0	109.1	N214 L218	N214-K216 PolarHBondContact O-N 3.45Å; K216-L218 PolarHBondContact O-N 3.49Å
217	L	19.7	Very low	20.8	Very low	168 Å²	168	153.9 Å²	153.9	88%	0.88	80%	0.795	S	S	*	*			trans	-63.5	119	165.6	-83.2	157.8	0	0	0	108.1	G215 R219	G215-L217 VanDerWaalsContact C-N 3.29Å; G215-L217 PolarHBondContact O-N 2.86Å; L217-R219 PolarHBondContact O-N 3.2Å
218	L	18.7	Very low	20.9	Very low	172 Å²	172	156.4 Å²	156.4	90%	0.901	80%	0.804	S	S	*	*			trans	-55.2	105.2	170.6	-82	152.5	0	0	0	108.6	K216 L220	K216-L218 PolarHBondContact O-N 3.49Å; L218-L220 PolarHBondContact O-N 3.25Å; L218-L220 VanDerWaalsContact O-N 3.16Å
219	R	19.5	Very low	21	Very low	215 Å²	215	155.5 Å²	155.5	81%	0.811	80%	0.795	S	S	*	*			trans	-73.1	102	179.3	-171.6	175.6	-174.3	172.3	0.7	108	L217 Y222	L217-R219 PolarHBondContact O-N 3.2Å; R219-Y222 HydrophobicContact CG-CE2 4.49Å
220	L	18.6	Very low	21	Very low	149 Å²	149	155.8 Å²	155.8	78%	0.78	80%	0.8	S	S	*	*			trans	-55.8	138.7	168.6	-78.2	158.4	0	0	0	109.4	L218 Y222	L218-L220 PolarHBondContact O-N 3.25Å; L218-L220 VanDerWaalsContact O-N 3.16Å; L220-Y222 PolarHBondContact O-N 3.32Å; L220-Y222 VanDerWaalsContact O-N 3.11Å
221	P	21.5	Very low	21.2	Very low	113 Å²	113	155.4 Å²	155.4	73%	0.734	80%	0.795	S	S	*	*			trans	-63.4	115.5	-178.6	24	-30.3	0	0	0	109.2	L223	P221-L223 PolarHBondContact O-N 3.31Å
222	Y	22.3	Very low	21.4	Very low	188 Å²	188	154.4 Å²	154.4	74%	0.737	79%	0.791	S	S	*	*			trans	-61.5	105.5	169.8	-79.8	-95	0	0	0	107.9	R219 L220 C224	R219-Y222 HydrophobicContact CG-CE2 4.49Å; L220-Y222 PolarHBondContact O-N 3.32Å; L220-Y222 VanDerWaalsContact O-N 3.11Å; Y222-C224 PolarHBondContact O-N 3.45Å
223	L	21.7	Very low	21.5	Very low	168 Å²	168	158 Å²	158	88%	0.88	80%	0.796	S	S	*	*			trans	-65.2	81.1	159.2	-77.8	162.1	0	0	0	107.2	P221 H225	P221-L223 PolarHBondContact O-N 3.31Å; L223-H225 PolarHBondContact O-N 3.04Å
224	C	20.3	Very low	21.7	Very low	108 Å²	108	159.9 Å²	159.9	73%	0.73	80%	0.797	S	S	*	*			trans	-65.2	108.8	170.2	-92.9	0	0	0	0	108.4	Y222	Y222-C224 PolarHBondContact O-N 3.45Å
225	H	20	Very low	21.7	Very low	166 Å²	166	162.3 Å²	162.3	77%	0.769	80%	0.801	S	S	*	*			trans	-77.8	127.2	151.6	-77.8	3.8	0	0	0	108.2	L223 I227	L223-H225 PolarHBondContact O-N 3.04Å; H225-I227 PolarHBondContact O-N 3.08Å
226	P	23.2	Very low	22.1	Very low	121 Å²	121	165.2 Å²	165.2	79%	0.786	81%	0.805	S	S	*	*			trans	-70.5	99.3	-178.3	27.8	-31.5	0	0	0	109.1	E228	P226-E228 PolarHBondContact O-N 2.82Å
227	I	22.2	Very low	22.4	Very low	127 Å²	127	162.6 Å²	162.6	65%	0.651	80%	0.801	S	S	*	*			trans	-83.9	101.3	162.3	-58.8	177.2	0	0	0	105.7	H225 R229	H225-I227 PolarHBondContact O-N 3.08Å; I227-R229 HydrophobicContact CG2-CG 3.98Å; I227-R229 PolarHBondContact O-N 3.32Å
228	E	20.8	Very low	22.5	Very low	181 Å²	181	162 Å²	162	85%	0.846	80%	0.799	S	S	*	*			trans	-59.9	83.8	167.6	-70.9	-175.2	159.4	0	0	110	P226	P226-E228 PolarHBondContact O-N 2.82Å
229	R	21.9	Very low	22.8	Very low	192 Å²	192	163.1 Å²	163.1	73%	0.725	80%	0.796	S	S	*	*			trans	-97.3	102.1	163.2	-83.5	177.8	-168.7	165.8	4.4	108.1	I227 F231	I227-R229 HydrophobicContact CG2-CG 3.98Å; I227-R229 PolarHBondContact O-N 3.32Å; R229-F231 PolarHBondContact O-N 2.87Å
230	K	23.1	Very low	23.2	Very low	201 Å²	201	160.5 Å²	160.5	87%	0.874	80%	0.797	S	S	*	*			trans	-55.5	99.3	167.1	-67.2	-179.4	179	178.7	0	108.6	N232	K230-N232 PolarHBondContact O-N 3.28Å
231	F	24.5	Very low	23.5	Very low	187 Å²	187	158.4 Å²	158.4	82%	0.82	80%	0.795	S	S	*	*			trans	-76.3	109.7	168.4	-90.1	-86.8	0	0	0	108.2	R229 H233	R229-F231 PolarHBondContact O-N 2.87Å; F231-H233 PolarHBondContact O-N 3.06Å
232	N	25	Very low	23.4	Very low	148 Å²	148	160.1 Å²	160.1	79%	0.791	80%	0.798	S	S	*	*			trans	-66.2	120.5	165.6	-90.7	-14.9	0	0	0	108.9	K230 N234	K230-N232 PolarHBondContact O-N 3.28Å; N232-N234 PolarHBondContact O-N 3.36Å
233	H	23	Very low	23.6	Very low	183 Å²	183	158.7 Å²	158.7	85%	0.847	80%	0.803	S	S	*	*			trans	-62.1	97.3	173.1	-76.1	-52.5	0	0	0	111.3	F231	F231-H233 PolarHBondContact O-N 3.06Å
234	N	26	Very low	23.6	Very low	149 Å²	149	157.9 Å²	157.9	80%	0.797	80%	0.799	S	S	*	*			trans	-111.6	95.4	158.5	-78.1	-8.5	0	0	0	108.7	N232 T236	N232-N234 PolarHBondContact O-N 3.36Å; N234-T236 PolarHBondContact O-N 2.73Å
235	K	23.5	Very low	23.8	Very low	194 Å²	194	158.7 Å²	158.7	84%	0.843	80%	0.801	S	S	*	*			trans	-54.9	120.8	160.4	-71.8	174.7	174.6	178.3	0	107.8
236	T	27.8	Very low	23.8	Very low	130 Å²	130	157.8 Å²	157.8	80%	0.798	81%	0.807	S	S	*	*			trans	-128.4	117.1	156.9	23.5	0	0	0	0	106.5	N234 D238	N234-T236 PolarHBondContact O-N 2.73Å; T236-D238 PolarHBondContact O-N 3Å
237	D	27	Very low	23.8	Very low	155 Å²	155	156.2 Å²	156.2	83%	0.829	80%	0.799	S	S	*	*			trans	-64.8	126.1	-174.7	-66.9	-57.1	0	0	0	110.7	K239	D237-K239 PolarHBondContact O-N 2.75Å
238	D	22.7	Very low	23.7	Very low	155 Å²	155	160.1 Å²	160.1	83%	0.829	81%	0.812	S	S	*	*			trans	-58.6	120	162	-73.5	-46.9	0	0	0	109.5	T236	T236-D238 PolarHBondContact O-N 3Å
239	K	25.3	Very low	23.8	Very low	195 Å²	195	158.6 Å²	158.6	85%	0.848	80%	0.804	S	S	*	*			trans	-175.1	148.3	149.6	-103.3	157.6	-169.8	-177.2	0	110.6	D237	D237-K239 PolarHBondContact O-N 2.75Å
240	I	27.7	Very low	23.8	Very low	160 Å²	160	155.5 Å²	155.5	82%	0.821	81%	0.807	S	S	*	*			trans	92.3	86.5	170.7	-50.4	164.2	0	0	0	112.1
241	S	23.7	Very low	23.7	Very low	106 Å²	106	155.1 Å²	155.1	74%	0.741	80%	0.801	S	S	*	*				101.7	121.5	69.8	77.8	0	0	0	0	111.6
242	N	20.6	Very low	23.6	Very low	149 Å²	149	152.8 Å²	152.8	80%	0.797	80%	0.797	S	S	*	*			trans	-35.3	136.1	164.7	-66.2	-30.6	0	0	0	113.8
243	N	26.1	Very low	23.4	Very low	157 Å²	157	149.8 Å²	149.8	84%	0.84	79%	0.787	S	S	*	*				-168.7	136.4	120.7	-90.3	-22	0	0	0	111.8
244	N	21.1	Very low	23.4	Very low	151 Å²	151	149.2 Å²	149.2	81%	0.807	79%	0.791	S	S	*	*			trans	-48.1	145.1	168.7	-58.4	-49.5	0	0	0	111.8
245	V	23.9	Very low	23.2	Very low	126 Å²	126	152.5 Å²	152.5	76%	0.764	79%	0.793	S	S	*	*				-169.5	129.1	120.9	165.3	0	0	0	0	108.2
246	T	20	Very low	23.2	Very low	147 Å²	147	153 Å²	153	90%	0.902	80%	0.796	S	S	*	*			trans	-83.4	114.9	172	-23.5	0	0	0	0	108
247	S	23.8	Very low	23.1	Very low	88 Å²	88	150.6 Å²	150.6	62%	0.615	80%	0.796	S	S	*	*			trans	-158.6	113.9	164.3	37.1	0	0	0	0	110.9	E249	S247-E249 PolarHBondContact O-N 3.29Å
248	K	20.2	Very low	22.8	Very low	209 Å²	209	149.8 Å²	149.8	91%	0.909	80%	0.797	S	S	*	*			trans	-49.1	114.7	158.3	-82.1	170.1	166.1	174.7	0	108.5
249	E	23.9	Very low	23	Very low	148 Å²	148	151.4 Å²	151.4	69%	0.692	80%	0.797	S	S	*	*			trans	-130.6	105.6	160	-114.4	174.9	176.1	0	0	109.5	S247 Y251	S247-E249 PolarHBondContact O-N 3.29Å; E249-Y251 HydrophobicContact CB-CD2 4.27Å; E249-Y251 HydrophobicContact CG-CD2 4.22Å; E249-Y251 HydrophobicContact CG-CE2 4.02Å; E249-Y251 PolarHBondContact O-N 3.1Å
250	T	20.7	Very low	22.9	Very low	127 Å²	127	149.7 Å²	149.7	78%	0.779	80%	0.797	S	S	*	*			trans	-71.7	100.2	167.5	-47.1	0	0	0	0	106.7
251	Y	21.4	Very low	22.5	Very low	193 Å²	193	152.8 Å²	152.8	76%	0.757	80%	0.8	S	S	*	*			trans	-112.6	120.5	165.7	-92.4	-79.6	0	0	0	111.7	E249	E249-Y251 HydrophobicContact CB-CD2 4.27Å; E249-Y251 HydrophobicContact CG-CD2 4.22Å; E249-Y251 HydrophobicContact CG-CE2 4.02Å; E249-Y251 PolarHBondContact O-N 3.1Å
252	L	22.4	Very low	22.4	Very low	139 Å²	139	156.7 Å²	156.7	73%	0.728	80%	0.803	S	S	*	*			trans	-50.7	141.2	171.8	-102.8	70.9	0	0	0	113.2
253	S	21.1	Very low	22.4	Very low	84 Å²	84	157 Å²	157	59%	0.587	81%	0.805	S	S	*	*			trans	27.7	99.7	138.4	64.5	0	0	0	0	118
254	N	23.5	Very low	22.2	Very low	172 Å²	172	154.6 Å²	154.6	92%	0.92	80%	0.796	S	S	*	*			trans	-108.7	100.9	144.9	-89.1	-27.5	0	0	0	109.1
255	Y	20.1	Very low	22.3	Very low	217 Å²	217	152.4 Å²	152.4	85%	0.851	79%	0.792	S	S	*	*			trans	-62.2	159.3	163.3	-103.8	-102.7	0	0	0	110.9
256	K	24.8	Very low	22.3	Very low	206 Å²	206	153.3 Å²	153.3	90%	0.896	79%	0.792	S	S	*	*			trans	95	72.3	168.1	-59	-174.8	176.3	179.7	0	116.1
257	G	24.6	Very low	22.4	Very low	79 Å²	79	154.6 Å²	154.6	81%	0.814	79%	0.788	S	S	*	*			trans	-136	69.7	155.9	0	0	0	0	0	109.7	K259	G257-K259 PolarHBondContact O-N 3.47Å
258	T	21.5	Very low	22.3	Very low	138 Å²	138	158.2 Å²	158.2	85%	0.847	80%	0.801	S	S	*	*			trans	-60.5	112.5	167.1	39.1	0	0	0	0	109.5
259	K	26.3	Very low	22.4	Very low	188 Å²	188	154.4 Å²	154.4	82%	0.817	80%	0.795	S	S	*	*			trans	-157.9	121.6	147.2	-105.2	172	-168.2	-173.8	0	108.6	G257 Y261	G257-K259 PolarHBondContact O-N 3.47Å; K259-Y261 PolarHBondContact O-N 3.02Å
260	D	22.8	Very low	22.2	Very low	159 Å²	159	155.2 Å²	155.2	85%	0.85	80%	0.803	S	S	*	*			trans	-59.6	111.9	-168.7	-56.6	-66.9	0	0	0	112.3	K262	D260-K262 VanDerWaalsContact C-N 3.28Å; D260-K262 PolarHBondContact O-N 3.44Å
261	Y	19.3	Very low	22.1	Very low	226 Å²	226	157.9 Å²	157.9	89%	0.886	81%	0.807	S	S	*	*			trans	-73.8	87.6	159.4	-92.6	-95.9	0	0	0	108.1	K259 L263	K259-Y261 PolarHBondContact O-N 3.02Å; Y261-L263 PolarHBondContact O-N 2.75Å
262	K	22	Very low	22	Very low	187 Å²	187	156.9 Å²	156.9	81%	0.813	81%	0.811	S	S	*	*			trans	-76.5	97.8	155.5	-103.6	-176.8	178	178.7	0	107.5	D260 T264	D260-K262 VanDerWaalsContact C-N 3.28Å; D260-K262 PolarHBondContact O-N 3.44Å; K262-T264 PolarHBondContact O-N 2.92Å
263	L	20.7	Very low	21.8	Very low	157 Å²	157	157.4 Å²	157.4	82%	0.822	81%	0.814	S	S	*	*			trans	-68.1	83.9	165.9	-147.1	92.2	0	0	0	107.5	Y261 S265	Y261-L263 PolarHBondContact O-N 2.75Å; L263-S265 PolarHBondContact O-N 3.49Å
264	T	22.6	Very low	21.8	Very low	106 Å²	106	159.4 Å²	159.4	65%	0.65	82%	0.823	S	S	*	*			trans	-82.8	100.3	166.1	48.7	0	0	0	0	107.5	K262 N266	K262-T264 PolarHBondContact O-N 2.92Å; T264-N266 PolarHBondContact O-N 2.88Å
265	S	22.6	Very low	21.5	Very low	105 Å²	105	160.7 Å²	160.7	73%	0.734	82%	0.816	S	S	*	*			trans	-60.8	80.6	158.8	53.3	0	0	0	0	109	L263	L263-S265 PolarHBondContact O-N 3.49Å
266	N	23.3	Very low	21.6	Very low	144 Å²	144	155.4 Å²	155.4	77%	0.77	81%	0.808	S	S	*	*			trans	-96.4	103.3	158.9	-84.1	3.6	0	0	0	106.4	T264 N268	T264-N266 PolarHBondContact O-N 2.88Å; N266-N268 PolarHBondContact O-N 3.06Å
267	E	23.6	Very low	21.4	Very low	174 Å²	174	153.2 Å²	153.2	81%	0.813	81%	0.805	S	S	*	*			trans	-45.8	132.7	167.2	-66.8	174.4	146.3	0	0	109.6	T269	E267-T269 PolarHBondContact O-N 3.04Å; E267-T269 PolarHBondContact O-OG1 2.98Å
268	N	22.2	Very low	21.2	Very low	164 Å²	164	157.8 Å²	157.8	88%	0.877	81%	0.805	S	S	*	*			trans	-53	92.3	164.5	-65.5	-38.9	0	0	0	108.4	N266 L270	N266-N268 PolarHBondContact O-N 3.06Å; N268-L270 PolarHBondContact O-N 2.94Å; N268-L270 VanDerWaalsContact O-N 3.12Å
269	T	21	Very low	21.3	Very low	129 Å²	129	156.5 Å²	156.5	79%	0.791	80%	0.801	S	S	*	*			trans	-72.1	101.9	166.9	-19	0	0	0	0	105.1	E267 Q271	E267-T269 PolarHBondContact O-N 3.04Å; E267-T269 PolarHBondContact O-OG1 2.98Å; T269-Q271 PolarHBondContact O-N 2.85Å; T269-Q271 VanDerWaalsContact O-N 3.12Å
270	L	19.3	Very low	21.2	Very low	165 Å²	165	156.6 Å²	156.6	86%	0.864	81%	0.805	S	S	*	*			trans	-52.9	118.8	167.4	-87.5	155.7	0	0	0	107.5	N268 M272	N268-L270 PolarHBondContact O-N 2.94Å; N268-L270 VanDerWaalsContact O-N 3.12Å; L270-M272 PolarHBondContact O-N 3.42Å
271	Q	19.9	Very low	21.2	Very low	183 Å²	183	157.1 Å²	157.1	86%	0.855	80%	0.802	S	S	*	*			trans	-57.8	106.4	176.7	-70.5	172.9	-18.1	0	0	108.6	T269 L273	T269-Q271 PolarHBondContact O-N 2.85Å; T269-Q271 VanDerWaalsContact O-N 3.12Å; Q271-L273 PolarHBondContact O-N 3.45Å
272	M	19.2	Very low	21.5	Very low	173 Å²	173	155.3 Å²	155.3	85%	0.852	80%	0.801	S	S	*	*			trans	-63.7	106.1	163.6	-87.1	176.5	58.6	0	0	107.5	L270 T274	L270-M272 PolarHBondContact O-N 3.42Å; M272-T274 VanDerWaalsContact C-N 3.32Å; M272-T274 PolarHBondContact O-N 3.25Å; M272-T274 PolarHBondContact O-OG1 2.97Å
273	L	18.5	Very low	21.5	Very low	149 Å²	149	153.6 Å²	153.6	78%	0.78	80%	0.801	S	S	*	*			trans	-68.5	94.6	166	-91.6	149.1	0	0	0	107.9	Q271 Y275	Q271-L273 PolarHBondContact O-N 3.45Å; L273-Y275 PolarHBondContact O-N 3.22Å
274	T	19.6	Very low	21.7	Very low	126 Å²	126	153.5 Å²	153.5	77%	0.773	80%	0.801	S	S	*	*			trans	-63.6	106.9	172	-47.1	0	0	0	0	109.1	M272	M272-T274 VanDerWaalsContact C-N 3.32Å; M272-T274 PolarHBondContact O-N 3.25Å; M272-T274 PolarHBondContact O-OG1 2.97Å
275	Y	18.2	Very low	21.8	Very low	200 Å²	200	154.5 Å²	154.5	78%	0.784	81%	0.807	S	S	*	*			trans	-78.3	127.9	162.8	-81	-87.8	0	0	0	108.8	L273 I277	L273-Y275 PolarHBondContact O-N 3.22Å; Y275-I277 PolarHBondContact O-N 3.38Å
276	P	20.9	Very low	22.1	Very low	105 Å²	105	155.7 Å²	155.7	68%	0.682	81%	0.805	S	S	*	*			trans	-74.4	108.8	-179.9	28.6	-30.5	0	0	0	109.3	H278	P276-H278 PolarHBondContact O-N 2.8Å
277	I	20.8	Very low	22.1	Very low	161 Å²	161	157.2 Å²	157.2	83%	0.826	81%	0.807	S	S	*	*			trans	-76.1	114.1	162.2	-62	175.7	0	0	0	105.7	Y275 S279	Y275-I277 PolarHBondContact O-N 3.38Å; I277-S279 PolarHBondContact O-N 2.99Å
278	H	21.5	Very low	22.2	Very low	175 Å²	175	157.2 Å²	157.2	81%	0.81	81%	0.807	S	S	*	*			trans	-52.5	111	175.1	-78.8	-81.2	0	0	0	109.9	P276 E280	P276-H278 PolarHBondContact O-N 2.8Å; H278-E280 PolarHBondContact O-N 2.93Å; H278-E280 VanDerWaalsContact O-N 3.16Å
279	S	22.5	Very low	22.4	Very low	111 Å²	111	154.6 Å²	154.6	78%	0.776	80%	0.797	S	S	*	*			trans	-73.2	94.2	170.4	53.3	0	0	0	0	108.9	I277	I277-S279 PolarHBondContact O-N 2.99Å
280	E	24.3	Very low	22.4	Very low	190 Å²	190	157.2 Å²	157.2	89%	0.888	81%	0.805	S	S	*	*			trans	-88.9	114.1	153.8	-82.1	-173	167.9	0	0	108.4	H278 H282	H278-E280 PolarHBondContact O-N 2.93Å; H278-E280 VanDerWaalsContact O-N 3.16Å; E280-H282 PolarHBondContact O-N 3.08Å
281	Q	23.3	Very low	22.6	Very low	170 Å²	170	153.5 Å²	153.5	79%	0.794	79%	0.793	S	S	*	*			trans	-58.9	115	176.7	-66.5	164.4	-24.6	0	0	109.9
282	H	25.8	Very low	22.9	Very low	187 Å²	187	151.8 Å²	151.8	87%	0.866	79%	0.79	S	S	*	*			trans	-139.9	111.6	143.4	-89.9	-64.2	0	0	0	109.5	E280 N284	E280-H282 PolarHBondContact O-N 3.08Å; H282-N284 PolarHBondContact O-N 3.12Å
283	N	21.8	Very low	23.1	Very low	151 Å²	151	150.3 Å²	150.3	81%	0.807	78%	0.784	S	S	*	*			trans	-51	125.9	170.1	-57.9	-49.8	0	0	0	110.3
284	N	24.4	Very low	23.3	Very low	155 Å²	155	147.7 Å²	147.7	83%	0.829	78%	0.778	S	S	*	*				-156.5	128.7	122.9	-116.6	-19.5	0	0	0	110.8	H282 D286	H282-N284 PolarHBondContact O-N 3.12Å; N284-D286 PolarHBondContact O-N 2.98Å
285	V	25.2	Very low	23.4	Very low	127 Å²	127	152.7 Å²	152.7	77%	0.77	78%	0.783	S	S	*	*			trans	-71.7	107.5	174.8	172.3	0	0	0	0	106.4
286	D	28.3	Very low	23.6	Very low	130 Å²	130	148.6 Å²	148.6	70%	0.695	78%	0.779	S	S	*	*			trans	-148.1	109.3	154.9	-84.5	-42.1	0	0	0	109.2	N284 H288	N284-D286 PolarHBondContact O-N 2.98Å; D286-H288 PolarHBondContact O-N 3.3Å
287	Q	24.6	Very low	23.6	Very low	176 Å²	176	150.8 Å²	150.8	82%	0.822	78%	0.784	S	S	*	*			trans	-64.1	96	170.5	-72.3	171.5	-13.6	0	0	108.2	T289	Q287-T289 VanDerWaalsContact C-N 3.27Å; Q287-T289 PolarHBondContact O-N 2.77Å
288	H	24.1	Very low	23.7	Very low	174 Å²	174	151 Å²	151	81%	0.806	78%	0.782	S	S	*	*			trans	-76.4	85.3	164.4	-76.3	-71.5	0	0	0	108.9	D286 L290	D286-H288 PolarHBondContact O-N 3.3Å; H288-L290 PolarHBondContact O-N 2.78Å
289	T	26.2	Very low	23.8	Very low	109 Å²	109	148.3 Å²	148.3	67%	0.669	78%	0.778	S	S	*	*			trans	-62.4	119.2	161.4	37.2	0	0	0	0	108.8	Q287 S291	Q287-T289 VanDerWaalsContact C-N 3.27Å; Q287-T289 PolarHBondContact O-N 2.77Å; T289-S291 VanDerWaalsContact C-N 3.34Å; T289-S291 PolarHBondContact O-N 2.87Å
290	L	22.5	Very low	23.9	Very low	184 Å²	184	148.6 Å²	148.6	96%	0.963	78%	0.775	S	S	*	*	S	Bend	trans	-58.6	89.1	171.1	-98.8	95.6	0	0	0	110.3	H288	H288-L290 PolarHBondContact O-N 2.78Å
291	S	22.9	Very low	24	Very low	87 Å²	87	148 Å²	148	61%	0.608	77%	0.769	S	S	*	*			trans	-161.1	34.1	168.1	68	0	0	0	0	115.4	T289	T289-S291 VanDerWaalsContact C-N 3.34Å; T289-S291 PolarHBondContact O-N 2.87Å
292	D	25.6	Very low	24.1	Very low	147 Å²	147	148 Å²	148	79%	0.786	77%	0.769	S	S	*	*			trans	-137.2	34.3	-179.6	-79.7	-35.9	0	0	0	114.8
293	I	24.1	Very low	24	Very low	142 Å²	142	145.5 Å²	145.5	73%	0.728	76%	0.762	S	S	*	*			trans	-114.7	60.7	164.9	-44.5	179.6	0	0	0	109	W295	I293-W295 HydrophobicContact CG2-CZ2 4.35Å; I293-W295 PolarHBondContact O-N 3.32Å
294	S	21.9	Very low	24.1	Very low	95 Å²	95	145.6 Å²	145.6	66%	0.664	76%	0.761	S	S	*	*			trans	-79.6	107.7	157.5	60.1	0	0	0	0	107.7	V296	S294-V296 VanDerWaalsContact C-N 3.29Å; S294-V296 PolarHBondContact O-N 2.98Å
295	W	21.6	Very low	24.2	Very low	230 Å²	230	145.5 Å²	145.5	87%	0.871	75%	0.753	S	S	*	*			trans	-65.3	91.5	169.2	-66.1	90.1	0	0	0	108.9	I293 L297	I293-W295 HydrophobicContact CG2-CZ2 4.35Å; I293-W295 PolarHBondContact O-N 3.32Å; W295-L297 PolarHBondContact O-N 3.08Å
296	V	22.7	Very low	24.1	Very low	114 Å²	114	145.8 Å²	145.8	69%	0.691	76%	0.758	S	S	*	*			trans	-75.1	103.1	164.5	-179.7	0	0	0	0	105.9	S294 E298	S294-V296 VanDerWaalsContact C-N 3.29Å; S294-V296 PolarHBondContact O-N 2.98Å; V296-E298 VanDerWaalsContact C-N 3.31Å; V296-E298 PolarHBondContact O-N 3.06Å
297	L	22.2	Very low	23.8	Very low	152 Å²	152	145.7 Å²	145.7	80%	0.796	76%	0.757	S	S	*	*			trans	-63.1	97.9	164.8	-107	118.2	0	0	0	107.4	W295 T299	W295-L297 PolarHBondContact O-N 3.08Å; L297-T299 VanDerWaalsContact C-N 3.28Å; L297-T299 PolarHBondContact O-N 3.36Å
298	E	21.7	Very low	23.7	Very low	165 Å²	165	142.2 Å²	142.2	77%	0.771	75%	0.752	S	S	*	*			trans	-62.9	92	166.8	-77.6	-173.9	151	0	0	108.5	V296 T300	V296-E298 VanDerWaalsContact C-N 3.31Å; V296-E298 PolarHBondContact O-N 3.06Å; E298-T300 PolarHBondContact O-N 3.44Å
299	T	24.7	Very low	23.6	Very low	119 Å²	119	139.3 Å²	139.3	73%	0.73	75%	0.746	S	S	*	*			trans	-73.1	83.1	163.4	54.9	0	0	0	0	107.8	L297 K301	L297-T299 VanDerWaalsContact C-N 3.28Å; L297-T299 PolarHBondContact O-N 3.36Å; T299-K301 PolarHBondContact O-N 3.4Å
300	T	24	Very low	23.4	Very low	116 Å²	116	140.3 Å²	140.3	71%	0.712	75%	0.748	S	S	*	*			trans	-70.6	66.5	164.9	42.6	0	0	0	0	109.5	E298 E302	E298-T300 PolarHBondContact O-N 3.44Å; T300-E302 PolarHBondContact O-N 3.42Å
301	K	26.5	Very low	23.7	Very low	178 Å²	178	138.7 Å²	138.7	77%	0.774	74%	0.74	S	S	*	*			trans	-81.6	83.2	150.3	-86.3	-173.9	177.5	178.2	0	106.3	T299 N303	T299-K301 PolarHBondContact O-N 3.4Å; K301-N303 PolarHBondContact O-N 2.94Å
302	E	24.8	Very low	23.6	Very low	169 Å²	169	142.2 Å²	142.2	79%	0.79	75%	0.751	S	S	*	*			trans	-63.6	72.3	153.7	-72.7	-173.7	153.2	0	0	108.5	T300 I304	T300-E302 PolarHBondContact O-N 3.42Å; E302-I304 VanDerWaalsContact C-N 3.29Å; E302-I304 PolarHBondContact O-N 2.94Å
303	N	24.8	Very low	23.6	Very low	136 Å²	136	143.7 Å²	143.7	73%	0.727	75%	0.751	S	S	*	*			trans	-82.2	91.9	152.7	-86.9	-22.1	0	0	0	105.7	K301 K305	K301-N303 PolarHBondContact O-N 2.94Å; N303-K305 PolarHBondContact O-N 3.18Å; N303-K305 VanDerWaalsContact O-N 3.09Å
304	I	24.2	Very low	23.7	Very low	152 Å²	152	143 Å²	143	78%	0.779	75%	0.748	S	S	*	*			trans	-46.8	115.5	161.5	-65.7	169.4	0	0	0	107.4	E302	E302-I304 VanDerWaalsContact C-N 3.29Å; E302-I304 PolarHBondContact O-N 2.94Å
305	K	24.6	Very low	23.9	Very low	154 Å²	154	149.2 Å²	149.2	67%	0.67	76%	0.759	S	S	*	*			trans	-53.6	132.4	173.3	-72.5	168.2	167.3	175	0	110.6	N303 N307	N303-K305 PolarHBondContact O-N 3.18Å; N303-K305 VanDerWaalsContact O-N 3.09Å; K305-N307 VanDerWaalsContact C-N 3.31Å; K305-N307 HydrophobicContact CB-CB 4.26Å; K305-N307 PolarHBondContact O-N 2.88Å
306	P	24.9	Very low	23.9	Very low	132 Å²	132	145.9 Å²	145.9	86%	0.857	76%	0.758	S	S	*	*			trans	-84.8	86.4	137.9	29.8	-18.6	0	0	0	106.8	S308	P306-S308 PolarHBondContact O-N 2.7Å
307	N	21.6	Very low	24.1	Very low	129 Å²	129	146.4 Å²	146.4	69%	0.69	76%	0.761	S	S	*	*			trans	-77	110.9	165.8	-110	10.3	0	0	0	106.9	K305	K305-N307 VanDerWaalsContact C-N 3.31Å; K305-N307 HydrophobicContact CB-CB 4.26Å; K305-N307 PolarHBondContact O-N 2.88Å
308	S	22.6	Very low	24.2	Very low	102 Å²	102	144.3 Å²	144.3	71%	0.713	76%	0.759	S	S	*	*			trans	-155.2	95.6	162.6	165.4	0	0	0	0	110.2	P306	P306-S308 PolarHBondContact O-N 2.7Å
309	V	21.4	Very low	24.2	Very low	113 Å²	113	144.4 Å²	144.4	69%	0.685	76%	0.76	S	S	*	*			trans	84.8	116.1	134.9	-177.2	0	0	0	0	117.6
310	N	22.8	Very low	24	Very low	131 Å²	131	145.2 Å²	145.2	70%	0.701	77%	0.769	S	S	*	*			trans	73.8	103.8	146.2	-63.7	-5.9	0	0	0	119.2
311	N	28.1	Very low	23.9	Very low	150 Å²	150	147.8 Å²	147.8	80%	0.802	77%	0.77	S	S	*	*				171.8	126.2	88.4	-89.9	-39.7	0	0	0	111.2
312	L	20.3	Very low	23.6	Very low	160 Å²	160	146.2 Å²	146.2	84%	0.838	77%	0.769	S	S	*	*			trans	-47.5	134.7	151.8	-141.1	79	0	0	0	109.8
313	K	25.9	Very low	23.6	Very low	179 Å²	179	145.6 Å²	145.6	78%	0.778	77%	0.771	S	S	*	*				174	120.6	129.7	-94.9	173.7	-178.1	-177.2	0	111.4
314	D	25.6	Very low	23.5	Very low	126 Å²	126	144.6 Å²	144.6	67%	0.674	77%	0.772	S	S	*	*			trans	59.3	104.5	135.2	-48.3	-27.4	0	0	0	117.8
315	Y	26	Very low	23.5	Very low	227 Å²	227	142.6 Å²	142.6	89%	0.89	77%	0.772	S	S	*	*				-168.6	106.4	109.8	-102.3	-76.3	0	0	0	109.9
316	N	21.8	Very low	23.5	Very low	159 Å²	159	142.4 Å²	142.4	85%	0.85	78%	0.777	S	S	*	*			trans	-71.5	130	162.4	-80.1	-47.3	0	0	0	109.5
317	V	26.7	Very low	23.4	Very low	126 Å²	126	144.9 Å²	144.9	76%	0.764	78%	0.777	S	S	*	*			trans	-143.8	98.5	150	-175.8	0	0	0	0	110.1
318	S	25.5	Very low	23.8	Very low	107 Å²	107	146 Å²	146	75%	0.748	78%	0.783	S	S	*	*			trans	58.9	98.4	132.1	-47.5	0	0	0	0	120.7
319	Q	20.9	Very low	23.9	Very low	167 Å²	167	148.3 Å²	148.3	78%	0.78	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-49.8	126.9	153	-65.2	168.3	-13.9	0	0	112.1
320	C	20.2	Very low	24.3	Very low	137 Å²	137	152.5 Å²	152.5	93%	0.926	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-96.6	116.5	153.6	-79	0	0	0	0	108.7
321	K	22.1	Very low	24.5	Very low	170 Å²	170	155.3 Å²	155.3	74%	0.739	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-86.8	145.5	-176.5	-79.5	174.2	173.3	175.8	0	111.8
322	L	20.3	Very low	24.4	Very low	144 Å²	144	157.1 Å²	157.1	75%	0.754	80%	0.803	S	S	*	*			trans	36.1	129	139.8	-101.4	83.1	0	0	0	120.6
323	N	24.5	Very low	24.7	Very low	156 Å²	156	160 Å²	160	83%	0.834	81%	0.805	S	S	*	*				-173.4	125.4	105.8	-93.3	-23.2	0	0	0	112
324	P	24.2	Very low	24.7	Very low	115 Å²	115	157.6 Å²	157.6	75%	0.747	80%	0.8	S	S	*	*			trans	-98.2	124	165.2	33.8	-23.4	0	0	0	110.1
325	S	22.7	Very low	24.8	Very low	111 Å²	111	159 Å²	159	78%	0.776	81%	0.808	S	S	*	*			trans	-166.9	126	157.2	-167.5	0	0	0	0	109.5
326	I	25.8	Very low	24.8	Very low	150 Å²	150	153.4 Å²	153.4	77%	0.769	80%	0.801	S	S	*	*			trans	163.2	98.9	134.5	-77.5	153.1	0	0	0	106.2
327	Q	23.6	Very low	24.9	Very low	183 Å²	183	148.7 Å²	148.7	86%	0.855	79%	0.789	S	S	*	*			trans	-60.1	140.6	152.9	-77.4	169.2	-47.3	0	0	108.7
328	N	28.6	Very low	24.9	Very low	153 Å²	153	148.1 Å²	148.1	82%	0.818	79%	0.786	S	S	*	*			trans	-163.9	119.9	137.8	-92.4	-28.7	0	0	0	110.4
329	D	24.5	Very low	24.8	Very low	151 Å²	151	150.8 Å²	150.8	81%	0.807	79%	0.786	S	S	*	*			trans	-54.8	137.1	169.7	-62.7	-58.9	0	0	0	112.7
330	K	29.6	Very low	25	Very low	201 Å²	201	150 Å²	150	87%	0.874	78%	0.781	S	S	*	*			trans	-179	109.3	132.3	-99.2	158.2	-172.5	177.6	0	112.6
331	K	27.7	Very low	25.3	Very low	190 Å²	190	149.4 Å²	149.4	83%	0.826	77%	0.768	S	S	*	*			trans	40.9	96.7	141.3	-68.3	-176.7	177.7	-179	0	117.7	Y333	K331-Y333 PolarHBondContact O-N 3.3Å
332	F	25.6	Very low	25.5	Very low	187 Å²	187	150 Å²	150	82%	0.82	77%	0.771	S	S	*	*			trans	-41.9	105.4	157.1	-62.6	-91.6	0	0	0	113.2
333	Y	26.5	Very low	26	Very low	222 Å²	222	147.9 Å²	147.9	87%	0.871	76%	0.764	S	S	*	*			trans	-97.1	99.3	142.9	-88.8	-90.4	0	0	0	105.7	K331 D335	K331-Y333 PolarHBondContact O-N 3.3Å; Y333-D335 PolarHBondContact O-N 3.22Å
334	N	27.1	Very low	26.2	Very low	127 Å²	127	147 Å²	147	68%	0.679	76%	0.76	S	S	*	*			trans	-72.7	78.6	169.9	-73.4	-10.7	0	0	0	107.6	C336	N334-C336 PolarHBondContact O-N 3.14Å
335	D	26.7	Very low	26.5	Very low	156 Å²	156	151.3 Å²	151.3	83%	0.834	76%	0.762	S	S	*	*			trans	-70.5	93.1	157.8	-144.7	1.5	0	0	0	104.8	Y333 G337	Y333-D335 PolarHBondContact O-N 3.22Å; D335-G337 PolarHBondContact O-N 2.81Å
336	C	25.9	Very low	26.6	Very low	110 Å²	110	148.5 Å²	148.5	74%	0.743	75%	0.751	S	S	*	*			trans	-71.5	57.1	175.7	-55.8	0	0	0	0	109.2	N334 V338	N334-C336 PolarHBondContact O-N 3.14Å; C336-V338 PolarHBondContact O-N 3.14Å; C336-V338 VanDerWaalsContact O-N 3.16Å
337	G	24.4	Very low	26.6	Very low	59 Å²	59	149.7 Å²	149.7	61%	0.608	75%	0.753	S	S	*	*			trans	-62.7	110.7	158.7	0	0	0	0	0	106.3	D335 Q339	D335-G337 PolarHBondContact O-N 2.81Å; G337-Q339 PolarHBondContact O-N 2.92Å
338	V	26.7	Very low	26.8	Very low	114 Å²	114	146.4 Å²	146.4	69%	0.691	75%	0.748	S	S	*	*			trans	-59.3	95	169.9	177.4	0	0	0	0	106.5	C336 F340	C336-V338 PolarHBondContact O-N 3.14Å; C336-V338 VanDerWaalsContact O-N 3.16Å; V338-F340 VanDerWaalsContact C-N 3.31Å; V338-F340 HydrophobicContact CB-CE2 4.44Å; V338-F340 HydrophobicContact CG1-CD2 4.22Å; V338-F340 HydrophobicContact CG1-CE2 3.93Å; V338-F340 HydrophobicContact CG1-CZ 4.18Å; V338-F340 WeakPolarHBondContact O-CD2 3.46Å; V338-F340 PolarHBondContact O-N 3.37Å
339	Q	23.1	Very low	26.7	Very low	163 Å²	163	148.4 Å²	148.4	76%	0.762	75%	0.749	S	S	*	*			trans	-70.8	95.2	175.3	-163.6	171.1	7	0	0	105.5	G337 N341	G337-Q339 PolarHBondContact O-N 2.92Å; Q339-N341 PolarHBondContact O-N 2.96Å
340	F	25.8	Very low	26.8	Very low	152 Å²	152	148 Å²	148	67%	0.667	75%	0.752	S	S	*	*			trans	-62.6	95.2	165.2	-74	-86.2	0	0	0	106.2	V338 F342	V338-F340 VanDerWaalsContact C-N 3.31Å; V338-F340 HydrophobicContact CB-CE2 4.44Å; V338-F340 HydrophobicContact CG1-CD2 4.22Å; V338-F340 HydrophobicContact CG1-CE2 3.93Å; V338-F340 HydrophobicContact CG1-CZ 4.18Å; V338-F340 WeakPolarHBondContact O-CD2 3.46Å; V338-F340 PolarHBondContact O-N 3.37Å; F340-F342 HydrophobicContact CB-CD2 4.13Å; F340-F342 HydrophobicContact CB-CE2 3.76Å; F340-F342 HydrophobicContact CB-CZ 4.24Å; F340-F342 VanDerWaalsContact O-CD2 3.32Å; F340-F342 WeakPolarHBondContact O-CD2 3.27Å; F340-F342 PolarHBondContact O-N 3.42Å
341	N	26.1	Very low	26.6	Very low	123 Å²	123	146.9 Å²	146.9	66%	0.658	75%	0.75	S	S	*	*			trans	-65.7	87.8	163.3	-74.5	-22.9	0	0	0	105.9	Q339 V343	Q339-N341 PolarHBondContact O-N 2.96Å; N341-V343 PolarHBondContact O-N 3.41Å
342	F	26.3	Very low	26.3	Very low	182 Å²	182	145.7 Å²	145.7	80%	0.798	75%	0.751	S	S	*	*			trans	-60.2	97.6	159.1	-68.2	-82.6	0	0	0	105.2	F340 D344	F340-F342 HydrophobicContact CB-CD2 4.13Å; F340-F342 HydrophobicContact CB-CE2 3.76Å; F340-F342 HydrophobicContact CB-CZ 4.24Å; F340-F342 VanDerWaalsContact O-CD2 3.32Å; F340-F342 WeakPolarHBondContact O-CD2 3.27Å; F340-F342 PolarHBondContact O-N 3.42Å; F342-D344 PolarHBondContact O-N 3.06Å
343	V	30.1	Very low	26.2	Very low	100 Å²	100	139.2 Å²	139.2	61%	0.606	74%	0.737	S	S	*	*			trans	-64.2	96.9	161.7	177.1	0	0	0	0	104.2	N341 Y345	N341-V343 PolarHBondContact O-N 3.41Å; V343-Y345 HydrophobicContact CB-CE2 4.38Å; V343-Y345 HydrophobicContact CG1-CD2 4.4Å; V343-Y345 HydrophobicContact CG1-CE1 4.39Å; V343-Y345 HydrophobicContact CG1-CE2 4.15Å; V343-Y345 WeakPolarHBondContact O-CD2 3.5Å; V343-Y345 PolarHBondContact O-N 2.95Å
344	D	30.2	Very low	25.9	Very low	139 Å²	139	138.5 Å²	138.5	74%	0.743	74%	0.739	S	S	*	*			trans	-62.6	92.5	171.1	-166.7	5	0	0	0	106.2	F342 G346	F342-D344 PolarHBondContact O-N 3.06Å; D344-G346 PolarHBondContact O-N 3.36Å
345	Y	30.6	Very low	25.7	Very low	204 Å²	204	138.7 Å²	138.7	80%	0.8	74%	0.74	S	S	*	*			trans	-66.8	85.4	163.7	-70.2	-79.5	0	0	0	104.9	V343 E347	V343-Y345 HydrophobicContact CB-CE2 4.38Å; V343-Y345 HydrophobicContact CG1-CD2 4.4Å; V343-Y345 HydrophobicContact CG1-CE1 4.39Å; V343-Y345 HydrophobicContact CG1-CE2 4.15Å; V343-Y345 WeakPolarHBondContact O-CD2 3.5Å; V343-Y345 PolarHBondContact O-N 2.95Å; Y345-E347 PolarHBondContact O-N 3.33Å
346	G	24.4	Very low	25.5	Very low	52 Å²	52	137.3 Å²	137.3	54%	0.536	74%	0.737	S	S	.	*			trans	-42.4	135.7	-171.3	0	0	0	0	0	110.7	D344	D344-G346 PolarHBondContact O-N 3.36Å
347	E	25	Very low	25.4	Very low	176 Å²	176	140.1 Å²	140.1	82%	0.822	74%	0.737	S	S	*	*			trans	-38.9	127.6	-176.6	-71.9	-173.5	148.9	0	0	110.4	Y345 K349	Y345-E347 PolarHBondContact O-N 3.33Å; E347-K349 PolarHBondContact O-N 2.66Å
348	P	27.6	Very low	25.4	Very low	113 Å²	113	142.2 Å²	142.2	73%	0.734	74%	0.739	S	S	*	*			trans	-55.2	114.3	-179.2	21.8	-31.1	0	0	0	107.2	T350	P348-T350 PolarHBondContact O-N 3.32Å
349	K	27.4	Very low	25.2	Very low	196 Å²	196	143.7 Å²	143.7	85%	0.852	74%	0.742	S	S	*	*			trans	-44	109.2	178.9	-72.9	-178.9	178.2	178.6	0	108.1	E347 Q351	E347-K349 PolarHBondContact O-N 2.66Å; K349-Q351 PolarHBondContact O-N 3.49Å
350	T	26.8	Very low	25.3	Very low	143 Å²	143	141 Å²	141	88%	0.877	74%	0.741	S	S	*	*	S	Bend	trans	-71.7	30.9	-176	35	0	0	0	0	112.8	P348	P348-T350 PolarHBondContact O-N 3.32Å
351	Q	23.8	Very low	25.3	Very low	177 Å²	177	141.5 Å²	141.5	83%	0.827	75%	0.745	S	S	*	*			trans	-130.5	65.9	179.2	-77.4	-177.9	-2.9	0	0	110.2	K349	K349-Q351 PolarHBondContact O-N 3.49Å
352	I	22.7	Very low	25.5	Very low	164 Å²	164	143.2 Å²	143.2	84%	0.841	75%	0.754	S	S	*	*			trans	-100.5	101	145.6	-63.2	176.7	0	0	0	104.7
353	G	22.4	Very low	25.5	Very low	52 Å²	52	137.7 Å²	137.7	54%	0.536	74%	0.742	S	S	.	*			trans	-55.3	147.1	-180	0	0	0	0	0	111.5	N355	G353-N355 PolarHBondContact O-N 3.17Å
354	F	21.4	Very low	25.5	Very low	207 Å²	207	137.2 Å²	137.2	91%	0.908	75%	0.749	S	S	*	*			trans	-59.1	75	167.8	-75.8	-99.6	0	0	0	110.1	T356	F354-T356 PolarHBondContact O-N 3.44Å
355	N	22.6	Very low	25.3	Very low	130 Å²	130	140.2 Å²	140.2	70%	0.695	75%	0.75	S	S	*	*			trans	-86.9	98.4	165.6	-78.3	-6.5	0	0	0	107.1	G353 F357	G353-N355 PolarHBondContact O-N 3.17Å; N355-F357 VanDerWaalsContact C-N 3.3Å; N355-F357 HydrophobicContact CB-CD2 4.12Å; N355-F357 HydrophobicContact CB-CE2 4Å; N355-F357 PolarHBondContact O-N 2.96Å
356	T	21.5	Very low	25.7	Very low	127 Å²	127	134.8 Å²	134.8	78%	0.779	74%	0.739	S	S	*	*			trans	-42	86.1	163.8	-33.9	0	0	0	0	111	F354	F354-T356 PolarHBondContact O-N 3.44Å
357	F	24.1	Very low	26.4	Very low	169 Å²	169	136.9 Å²	136.9	74%	0.741	74%	0.742	S	S	*	*			trans	-101.3	88.9	164.4	-80.6	-77.5	0	0	0	108.7	N355	N355-F357 VanDerWaalsContact C-N 3.3Å; N355-F357 HydrophobicContact CB-CD2 4.12Å; N355-F357 HydrophobicContact CB-CE2 4Å; N355-F357 PolarHBondContact O-N 2.96Å
358	T	24.7	Very low	27.1	Very low	104 Å²	104	133.9 Å²	133.9	64%	0.638	73%	0.731	S	S	*	*			trans	-15.5	126.9	143.7	47.2	0	0	0	0	115.1	C360	T358-C360 PolarHBondContact O-N 2.87Å
359	N	23.5	Very low	27.4	Very low	144 Å²	144	132.1 Å²	132.1	77%	0.77	72%	0.721	S	S	*	*			trans	30.3	78.7	149	-67.8	-1.8	0	0	0	116.6	E361	N359-E361 PolarHBondContact O-N 3.4Å
360	C	23.9	Very low	27.8	Very low	107 Å²	107	127.2 Å²	127.2	72%	0.723	70%	0.703	S	S	*	*			trans	-79.8	63	155.8	-65.2	0	0	0	0	109.5	T358 N362	T358-C360 PolarHBondContact O-N 2.87Å; C360-N362 PolarHBondContact O-N 3.28Å
361	E	26.9	Very low	28.4	Very low	162 Å²	162	126.3 Å²	126.3	76%	0.757	69%	0.689	S	S	*	*	S	Bend	trans	-81.4	-1.1	174.8	-150.6	169.3	-163.3	0	0	112	N359	N359-E361 PolarHBondContact O-N 3.4Å
362	N	28.7	Very low	29.1	Very low	160 Å²	160	124 Å²	124	86%	0.856	68%	0.678	S	S	*	*			trans	-140.9	20.3	-176.3	-77.8	-38.4	0	0	0	115.4	C360 A364	C360-N362 PolarHBondContact O-N 3.28Å; N362-A364 PolarHBondContact O-N 3.03Å
363	A	27.8	Very low	29.7	Very low	65 Å²	65	121.9 Å²	121.9	54%	0.537	67%	0.668	S	S	.	*			trans	-83.1	76.3	169.2	0	0	0	0	0	109	W365	A363-W365 PolarHBondContact O-N 2.8Å
364	A	28.8	Very low	30.5	Very low	91 Å²	91	124.4 Å²	124.4	75%	0.752	67%	0.669	S	S	*	*			trans	-54.6	110.7	157.7	0	0	0	0	0	106.2	N362	N362-A364 PolarHBondContact O-N 3.03Å
365	W	27.5	Very low	31.7	Very low	202 Å²	202	118 Å²	118	77%	0.765	65%	0.65	S	S	*	*			trans	-54.7	129.5	174.4	-72.9	54.3	0	0	0	106.7	A363 T367	A363-W365 PolarHBondContact O-N 2.8Å; W365-T367 PolarHBondContact O-N 3.11Å
366	P	37.6	Very low	32.7	Very low	89 Å²	89	117.2 Å²	117.2	58%	0.578	65%	0.646	S	S	*	*			trans	-60.1	110.8	173.5	-16.9	28.9	0	0	0	106.9	D368 C369	P366-D368 PolarHBondContact O-N 3.23Å; P366-C369 PolarHBondContact O-N 2.75Å
367	T	39.7	Very low	33.6	Very low	97 Å²	97	116 Å²	116	60%	0.595	63%	0.634	S	S	*	*	H	α-helix	trans	-50.8	-28	-178.9	-39	0	0	0	0	111.3	W365 C369 I370 E371	W365-T367 PolarHBondContact O-N 3.11Å; T367-C369 VanDerWaalsContact C-N 3.29Å; T367-C369 PolarHBondContact O-N 2.85Å; T367-I370 PolarHBondContact O-N 3.46Å; T367-E371 PolarHBondContact O-N 3.04Å; T367-E371 VanDerWaalsContact O-N 3.14Å
368	D	39.4	Very low	34.4	Very low	112 Å²	112	112.3 Å²	112.3	60%	0.599	63%	0.626	S	S	*	*	H	α-helix	trans	-54	-35.2	175.5	-62.5	-3.7	0	0	0	114.4	P366 Q372	P366-D368 PolarHBondContact O-N 3.23Å; D368-Q372 WeakPolarHBondContact O-CB 3.41Å; D368-Q372 WeakPolarHBondContact O-CG 3.48Å; D368-Q372 PolarHBondContact O-N 2.94Å
369	C	35.1	Very low	35.1	Very low	76 Å²	76	109.7 Å²	109.7	51%	0.514	61%	0.614	S	S	.	*	H	α-helix	trans	-72.7	-35.5	-179.7	-82.7	0	0	0	0	112.6	P366 T367 L373	P366-C369 PolarHBondContact O-N 2.75Å; T367-C369 VanDerWaalsContact C-N 3.29Å; T367-C369 PolarHBondContact O-N 2.85Å; C369-L373 PolarHBondContact O-N 3.24Å
370	I	35.1	Very low	35.9	Very low	93 Å²	93	108 Å²	108	48%	0.477	60%	0.602	S	S	.	*	H	α-helix	trans	-73.2	-42.1	178	-61.2	-178.5	0	0	0	109.4	T367 Q372 L373 L374	T367-I370 PolarHBondContact O-N 3.46Å; I370-Q372 VanDerWaalsContact C-N 3.34Å; I370-Q372 PolarHBondContact O-N 3.1Å; I370-L373 PolarHBondContact O-N 3.32Å; I370-L374 HydrophobicContact CG2-CD1 3.78Å; I370-L374 HydrophobicContact CG2-CG 4.31Å; I370-L374 WeakPolarHBondContact O-CB 3.32Å; I370-L374 WeakPolarHBondContact O-CG 3.44Å; I370-L374 PolarHBondContact O-N 3.17Å
371	E	39.9	Very low	36.7	Very low	124 Å²	124	107 Å²	107	58%	0.579	59%	0.592	S	S	*	*	H	α-helix	trans	-64.3	-37	175.5	-76.3	-162.9	170.5	0	0	112.6	T367 S375	T367-E371 PolarHBondContact O-N 3.04Å; T367-E371 VanDerWaalsContact O-N 3.14Å; E371-S375 WeakPolarHBondContact O-CB 3.41Å; E371-S375 PolarHBondContact O-N 3.2Å; E371-S375 PolarHBondContact O-OG 2.85Å
372	Q	38.9	Very low	37.3	Very low	129 Å²	129	102.5 Å²	102.5	60%	0.603	58%	0.576	S	S	*	*	H	α-helix	trans	-68	-39.7	173.8	-82.9	-176.7	-2	0	0	112.7	D368 I370 S375 N376	D368-Q372 WeakPolarHBondContact O-CB 3.41Å; D368-Q372 WeakPolarHBondContact O-CG 3.48Å; D368-Q372 PolarHBondContact O-N 2.94Å; I370-Q372 VanDerWaalsContact C-N 3.34Å; I370-Q372 PolarHBondContact O-N 3.1Å; Q372-S375 PolarHBondContact O-N 3.04Å; Q372-N376 VanDerWaalsContact O-CB 3.31Å; Q372-N376 WeakPolarHBondContact O-CB 3.33Å; Q372-N376 VanDerWaalsContact O-CG 3.28Å; Q372-N376 PolarHBondContact O-N 3.17Å; Q372-N376 PolarHBondContact O-ND2 3.2Å
373	L	34.2	Very low	38.1	Very low	120 Å²	120	102.5 Å²	102.5	63%	0.628	57%	0.568	S	S	*	*	H	α-helix	trans	-63.6	-48.5	176.3	-126.9	96.8	0	0	0	110.7	C369 I370 S375 N376 D377	C369-L373 PolarHBondContact O-N 3.24Å; I370-L373 PolarHBondContact O-N 3.32Å; L373-S375 PolarHBondContact O-N 3.05Å; L373-N376 PolarHBondContact O-N 3.31Å; L373-D377 PolarHBondContact O-N 3.34Å
374	L	39.2	Very low	38.8	Very low	104 Å²	104	104.8 Å²	104.8	55%	0.545	57%	0.567	S	S	.	*	H	α-helix	trans	-65	-39.3	178.3	-69.4	171.3	0	0	0	111.6	I370 D377 V378	I370-L374 HydrophobicContact CG2-CD1 3.78Å; I370-L374 HydrophobicContact CG2-CG 4.31Å; I370-L374 WeakPolarHBondContact O-CB 3.32Å; I370-L374 WeakPolarHBondContact O-CG 3.44Å; I370-L374 PolarHBondContact O-N 3.17Å; L374-D377 PolarHBondContact O-N 3.03Å; L374-V378 WeakPolarHBondContact O-CB 3.43Å; L374-V378 WeakPolarHBondContact O-CG2 3.42Å; L374-V378 PolarHBondContact O-N 3.46Å
375	S	47.6	Very low	39.3	Very low	74 Å²	74	107 Å²	107	52%	0.517	56%	0.56	S	S	.	*	H	α-helix	trans	-67.6	-37.7	177.6	-65.3	0	0	0	0	112.2	E371 Q372 L373 A379	E371-S375 WeakPolarHBondContact O-CB 3.41Å; E371-S375 PolarHBondContact O-N 3.2Å; E371-S375 PolarHBondContact O-OG 2.85Å; Q372-S375 PolarHBondContact O-N 3.04Å; L373-S375 PolarHBondContact O-N 3.05Å; S375-A379 WeakPolarHBondContact O-CB 3.4Å; S375-A379 PolarHBondContact O-N 3.2Å
376	N	42.2	Very low	39.9	Very low	113 Å²	113	101.7 Å²	101.7	60%	0.604	55%	0.546	S	S	*	.	H	α-helix	trans	-68	-41.6	175.3	-78	-22.7	0	0	0	111.7	Q372 L373 A379 H380	Q372-N376 VanDerWaalsContact O-CB 3.31Å; Q372-N376 WeakPolarHBondContact O-CB 3.33Å; Q372-N376 VanDerWaalsContact O-CG 3.28Å; Q372-N376 PolarHBondContact O-N 3.17Å; Q372-N376 PolarHBondContact O-ND2 3.2Å; L373-N376 PolarHBondContact O-N 3.31Å; N376-A379 PolarHBondContact O-N 3.23Å; N376-H380 WeakPolarHBondContact O-CB 3.29Å; N376-H380 PolarHBondContact O-N 3.44Å
377	D	40.6	Very low	40.3	Very low	100 Å²	100	101.3 Å²	101.3	54%	0.535	55%	0.546	S	S	.	.	H	α-helix	trans	-66.9	-44.5	177.4	-81.6	-11.6	0	0	0	111.6	L373 L374 A379 H380 V381	L373-D377 PolarHBondContact O-N 3.34Å; L374-D377 PolarHBondContact O-N 3.03Å; D377-A379 PolarHBondContact O-N 3.46Å; D377-H380 PolarHBondContact O-N 3.48Å; D377-V381 WeakPolarHBondContact O-CG2 3.35Å; D377-V381 PolarHBondContact O-N 3.05Å
378	V	40.7	Very low	40.5	Very low	93 Å²	93	102.2 Å²	102.2	56%	0.564	55%	0.546	S	S	*	.	H	α-helix	trans	-63.7	-42.8	175.9	174.4	0	0	0	0	110.5	L374 H380 V381 T382	L374-V378 WeakPolarHBondContact O-CB 3.43Å; L374-V378 WeakPolarHBondContact O-CG2 3.42Å; L374-V378 PolarHBondContact O-N 3.46Å; V378-H380 VanDerWaalsContact C-N 3.34Å; V378-H380 PolarHBondContact O-N 3.42Å; V378-V381 PolarHBondContact O-N 2.93Å; V378-T382 VanDerWaalsContact O-CB 3.31Å; V378-T382 WeakPolarHBondContact O-CB 3.46Å; V378-T382 PolarHBondContact O-N 3.19Å; V378-T382 PolarHBondContact O-OG1 2.9Å
379	A	40.6	Very low	40.3	Very low	48 Å²	48	99.9 Å²	99.9	40%	0.397	53%	0.531	S	S	.	.	H	α-helix	trans	-64	-37.5	176.8	0	0	0	0	0	112.5	S375 N376 D377 K383	S375-A379 WeakPolarHBondContact O-CB 3.4Å; S375-A379 PolarHBondContact O-N 3.2Å; N376-A379 PolarHBondContact O-N 3.23Å; D377-A379 PolarHBondContact O-N 3.46Å; A379-K383 WeakPolarHBondContact O-CB 3.43Å; A379-K383 WeakPolarHBondContact O-CG 3.29Å; A379-K383 PolarHBondContact O-N 3.48Å
380	H	40.3	Very low	40.5	Very low	110 Å²	110	99.4 Å²	99.4	51%	0.509	53%	0.526	S	S	.	.	H	α-helix	trans	-66.6	-46.9	175.9	-172.1	-69.3	0	0	0	111.6	N376 D377 V378 T382 K383 Q384	N376-H380 WeakPolarHBondContact O-CB 3.29Å; N376-H380 PolarHBondContact O-N 3.44Å; D377-H380 PolarHBondContact O-N 3.48Å; V378-H380 VanDerWaalsContact C-N 3.34Å; V378-H380 PolarHBondContact O-N 3.42Å; H380-T382 VanDerWaalsContact C-N 3.32Å; H380-T382 PolarHBondContact O-N 2.96Å; H380-K383 PolarHBondContact O-N 3.21Å; H380-Q384 PolarHBondContact O-N 3.07Å
381	V	40	Very low	40.8	Very low	86 Å²	86	98.7 Å²	98.7	52%	0.521	53%	0.529	S	S	.	.	H	α-helix	trans	-62.7	-41.9	176.6	174.3	0	0	0	0	110.5	D377 V378 K383 Q384 F385	D377-V381 WeakPolarHBondContact O-CG2 3.35Å; D377-V381 PolarHBondContact O-N 3.05Å; V378-V381 PolarHBondContact O-N 2.93Å; V381-K383 PolarHBondContact O-N 3.24Å; V381-Q384 PolarHBondContact O-N 3.16Å; V381-F385 WeakPolarHBondContact O-CB 3.49Å; V381-F385 PolarHBondContact O-N 2.98Å
382	T	39.8	Very low	40.8	Very low	67 Å²	67	97.3 Å²	97.3	41%	0.411	53%	0.526	S	S	.	.	H	α-helix	trans	-66.3	-38.9	178.6	-47.5	0	0	0	0	111.5	V378 H380 F385 L386	V378-T382 VanDerWaalsContact O-CB 3.31Å; V378-T382 WeakPolarHBondContact O-CB 3.46Å; V378-T382 PolarHBondContact O-N 3.19Å; V378-T382 PolarHBondContact O-OG1 2.9Å; H380-T382 VanDerWaalsContact C-N 3.32Å; H380-T382 PolarHBondContact O-N 2.96Å; T382-F385 PolarHBondContact O-N 3.47Å; T382-L386 HydrophobicContact CG2-CD1 4.08Å; T382-L386 WeakPolarHBondContact O-CB 3.48Å; T382-L386 WeakPolarHBondContact O-CG 3.48Å; T382-L386 PolarHBondContact O-N 2.96Å
383	K	44.3	Very low	40.8	Very low	160 Å²	160	95 Å²	95	70%	0.696	52%	0.517	S	S	*	.	H	α-helix	trans	-65.7	-40.6	173.6	-83.7	-177	177.2	-179.5	0	112.6	A379 H380 V381 F385 S387	A379-K383 WeakPolarHBondContact O-CB 3.43Å; A379-K383 WeakPolarHBondContact O-CG 3.29Å; A379-K383 PolarHBondContact O-N 3.48Å; H380-K383 PolarHBondContact O-N 3.21Å; V381-K383 PolarHBondContact O-N 3.24Å; K383-F385 VanDerWaalsContact C-N 3.34Å; K383-S387 VanDerWaalsContact O-CB 3.23Å; K383-S387 WeakPolarHBondContact O-CB 3.39Å; K383-S387 PolarHBondContact O-N 3.33Å
384	Q	42.8	Very low	41.1	Very low	112 Å²	112	94.4 Å²	94.4	52%	0.523	51%	0.514	S	S	.	.	H	α-helix	trans	-63.7	-42.3	173.3	-82.8	-172.2	-35.2	0	0	111.3	H380 V381 S387 I388	H380-Q384 PolarHBondContact O-N 3.07Å; V381-Q384 PolarHBondContact O-N 3.16Å; Q384-S387 PolarHBondContact O-N 3.24Å; Q384-I388 WeakPolarHBondContact O-CD1 3.49Å; Q384-I388 VanDerWaalsContact O-CG1 3.26Å; Q384-I388 WeakPolarHBondContact O-CG1 3.45Å; Q384-I388 PolarHBondContact O-N 2.93Å; Q384-I388 VanDerWaalsContact O-N 3.08Å
385	F	40.1	Very low	41.2	Very low	137 Å²	137	94.6 Å²	94.6	60%	0.601	52%	0.515	S	S	*	.	H	α-helix	trans	-62.8	-48	177.6	-140.4	-91	0	0	0	111.4	V381 T382 K383 S387 I388 H389	V381-F385 WeakPolarHBondContact O-CB 3.49Å; V381-F385 PolarHBondContact O-N 2.98Å; T382-F385 PolarHBondContact O-N 3.47Å; K383-F385 VanDerWaalsContact C-N 3.34Å; F385-S387 PolarHBondContact O-N 3.25Å; F385-I388 PolarHBondContact O-N 3.2Å; F385-H389 AromaticContact CD1-CD2 3.47Å; F385-H389 VanDerWaalsContact CD1-CD2 3.47Å; F385-H389 WeakPolarHBondContact CD1-CD2 3.48Å; F385-H389 AromaticContact CD1-NE2 3.85Å; F385-H389 AromaticContact CE1-CD2 3.52Å; F385-H389 AromaticContact CE1-NE2 3.46Å; F385-H389 WeakPolarHBondContact CE1-NE2 3.39Å; F385-H389 AromaticContact CZ-NE2 3.87Å; F385-H389 PolarHBondContact O-CD2 3.36Å; F385-H389 PolarHBondContact O-N 3.17Å
386	L	39.8	Very low	40.6	Very low	91 Å²	91	98.9 Å²	98.9	48%	0.476	52%	0.52	S	S	.	.	H	α-helix	trans	-64.7	-39.9	177.4	-76.6	164.5	0	0	0	112	T382 I388 H389 T390 L393	T382-L386 HydrophobicContact CG2-CD1 4.08Å; T382-L386 WeakPolarHBondContact O-CB 3.48Å; T382-L386 WeakPolarHBondContact O-CG 3.48Å; T382-L386 PolarHBondContact O-N 2.96Å; L386-I388 VanDerWaalsContact C-N 3.31Å; L386-I388 PolarHBondContact O-N 3.47Å; L386-H389 CarbonylContact O-C 3.59Å; L386-H389 PolarHBondContact O-N 3.28Å; L386-T390 WeakPolarHBondContact O-CG2 3.42Å; L386-T390 PolarHBondContact O-N 2.88Å; L386-T390 PolarHBondContact O-OG1 2.87Å; L386-L393 HydrophobicContact CD2-CD1 4.48Å
387	S	45.2	Very low	40.4	Very low	81 Å²	81	100.2 Å²	100.2	57%	0.566	53%	0.527	S	S	*	.	H	α-helix	trans	-63.7	-34.3	177.5	174.9	0	0	0	0	113.3	K383 Q384 F385 H389 T390	K383-S387 VanDerWaalsContact O-CB 3.23Å; K383-S387 WeakPolarHBondContact O-CB 3.39Å; K383-S387 PolarHBondContact O-N 3.33Å; Q384-S387 PolarHBondContact O-N 3.24Å; F385-S387 PolarHBondContact O-N 3.25Å; S387-H389 VanDerWaalsContact C-N 3.32Å; S387-T390 PolarHBondContact O-OG1 3.39Å; S387-T390 VanDerWaalsContact O-OG1 3.13Å
388	I	43.7	Very low	40.2	Very low	116 Å²	116	100.5 Å²	100.5	60%	0.595	53%	0.529	S	S	*	.	H	α-helix	trans	-73.9	-31.2	177.9	-66.8	165.1	0	0	0	110.1	Q384 F385 L386	Q384-I388 WeakPolarHBondContact O-CD1 3.49Å; Q384-I388 VanDerWaalsContact O-CG1 3.26Å; Q384-I388 WeakPolarHBondContact O-CG1 3.45Å; Q384-I388 PolarHBondContact O-N 2.93Å; Q384-I388 VanDerWaalsContact O-N 3.08Å; F385-I388 PolarHBondContact O-N 3.2Å; L386-I388 VanDerWaalsContact C-N 3.31Å; L386-I388 PolarHBondContact O-N 3.47Å
389	H	36.2	Very low	40.1	Very low	64 Å²	64	103.2 Å²	103.2	30%	0.296	54%	0.535	S	S	.	.	H	α-helix	trans	-104.1	1.9	-175.5	-63.1	-57.6	0	0	0	115.2	F385 L386 S387 S391 D392 L393	F385-H389 AromaticContact CD1-CD2 3.47Å; F385-H389 VanDerWaalsContact CD1-CD2 3.47Å; F385-H389 WeakPolarHBondContact CD1-CD2 3.48Å; F385-H389 AromaticContact CD1-NE2 3.85Å; F385-H389 AromaticContact CE1-CD2 3.52Å; F385-H389 AromaticContact CE1-NE2 3.46Å; F385-H389 WeakPolarHBondContact CE1-NE2 3.39Å; F385-H389 AromaticContact CZ-NE2 3.87Å; F385-H389 PolarHBondContact O-CD2 3.36Å; F385-H389 PolarHBondContact O-N 3.17Å; L386-H389 CarbonylContact O-C 3.59Å; L386-H389 PolarHBondContact O-N 3.28Å; S387-H389 VanDerWaalsContact C-N 3.32Å; H389-S391 VanDerWaalsContact C-N 3.27Å; H389-S391 PolarHBondContact O-N 3.01Å; H389-D392 IonicContact ND1-OD2 3.7Å; H389-D392 PolarHBondContact ND1-OD2 3.44Å; H389-D392 VanDerWaalsContact ND1-OD2 3.1Å; H389-D392 PolarHBondContact O-N 2.91Å; H389-L393 WeakPolarHBondContact O-CB 3.34Å; H389-L393 WeakPolarHBondContact O-CG 3.49Å; H389-L393 PolarHBondContact O-N 2.83Å
390	T	38.5	Very low	40.1	Very low	66 Å²	66	108.3 Å²	108.3	41%	0.405	56%	0.556	S	S	.	*	H	α-helix	trans	-62.9	-35.5	177.3	29.1	0	0	0	0	112	L386 S387 D392 L393 I394	L386-T390 WeakPolarHBondContact O-CG2 3.42Å; L386-T390 PolarHBondContact O-N 2.88Å; L386-T390 PolarHBondContact O-OG1 2.87Å; S387-T390 PolarHBondContact O-OG1 3.39Å; S387-T390 VanDerWaalsContact O-OG1 3.13Å; T390-D392 VanDerWaalsContact C-N 3.35Å; T390-L393 PolarHBondContact O-N 3.48Å; T390-I394 WeakPolarHBondContact O-CD1 3.34Å; T390-I394 VanDerWaalsContact O-CG1 3.23Å; T390-I394 WeakPolarHBondContact O-CG1 3.29Å; T390-I394 PolarHBondContact O-N 3.4Å
391	S	41.4	Very low	39.8	Very low	77 Å²	77	111.9 Å²	111.9	54%	0.538	57%	0.57	S	S	.	*	H	α-helix	trans	-61.1	-47.1	173.9	-36	0	0	0	0	110.5	H389 L393 I394 D395	H389-S391 VanDerWaalsContact C-N 3.27Å; H389-S391 PolarHBondContact O-N 3.01Å; S391-L393 VanDerWaalsContact C-N 3.3Å; S391-L393 PolarHBondContact O-N 3.01Å; S391-I394 PolarHBondContact O-N 3.34Å; S391-D395 PolarHBondContact O-N 2.73Å
392	D	40.9	Very low	39.4	Very low	95 Å²	95	112.4 Å²	112.4	51%	0.508	58%	0.576	S	S	.	*	H	α-helix	trans	-67.7	-29.6	-179	-54.5	-23.9	0	0	0	112.5	H389 T390	H389-D392 IonicContact ND1-OD2 3.7Å; H389-D392 PolarHBondContact ND1-OD2 3.44Å; H389-D392 VanDerWaalsContact ND1-OD2 3.1Å; H389-D392 PolarHBondContact O-N 2.91Å; T390-D392 VanDerWaalsContact C-N 3.35Å
393	L	37.6	Very low	38.7	Very low	82 Å²	82	116.6 Å²	116.6	43%	0.429	60%	0.595	S	S	.	*	H	α-helix	trans	-85.2	-29.4	-179.9	-72.7	169	0	0	0	113.3	L386 H389 T390 S391 D395 W396 N397	L386-L393 HydrophobicContact CD2-CD1 4.48Å; H389-L393 WeakPolarHBondContact O-CB 3.34Å; H389-L393 WeakPolarHBondContact O-CG 3.49Å; H389-L393 PolarHBondContact O-N 2.83Å; T390-L393 PolarHBondContact O-N 3.48Å; S391-L393 VanDerWaalsContact C-N 3.3Å; S391-L393 PolarHBondContact O-N 3.01Å; L393-D395 VanDerWaalsContact C-N 3.33Å; L393-W396 HydrophobicContact CD2-CE3 4.48Å; L393-W396 WeakPolarHBondContact O-CB 3.36Å; L393-W396 PolarHBondContact O-N 3.3Å; L393-N397 PolarHBondContact O-N 3.41Å
394	I	40.8	Very low	37.9	Very low	107 Å²	107	114.7 Å²	114.7	55%	0.549	60%	0.596	S	S	.	*	H	α-helix	trans	-68.2	-38.3	174.5	-70.6	165.2	0	0	0	110.1	T390 S391 W396 N397	T390-I394 WeakPolarHBondContact O-CD1 3.34Å; T390-I394 VanDerWaalsContact O-CG1 3.23Å; T390-I394 WeakPolarHBondContact O-CG1 3.29Å; T390-I394 PolarHBondContact O-N 3.4Å; S391-I394 PolarHBondContact O-N 3.34Å; I394-W396 PolarHBondContact O-N 3.06Å; I394-N397 PolarHBondContact O-N 3.13Å
395	D	42.5	Very low	37	Very low	108 Å²	108	114.2 Å²	114.2	58%	0.578	60%	0.602	S	S	*	*	H	α-helix	trans	-63.6	-31.9	174.3	-74.1	-14.5	0	0	0	111.6	S391 L393 N397 N398	S391-D395 PolarHBondContact O-N 2.73Å; L393-D395 VanDerWaalsContact C-N 3.33Å; D395-N397 PolarHBondContact O-N 3.44Å; D395-N398 PolarHBondContact O-N 3.45Å
396	W	33.9	Very low	36.2	Very low	163 Å²	163	113.8 Å²	113.8	62%	0.617	62%	0.615	S	S	*	*	H	α-helix	trans	-64.8	-38.5	177.6	-149.6	-46	0	0	0	113	L393 I394 N398	L393-W396 HydrophobicContact CD2-CE3 4.48Å; L393-W396 WeakPolarHBondContact O-CB 3.36Å; L393-W396 PolarHBondContact O-N 3.3Å; I394-W396 PolarHBondContact O-N 3.06Å; W396-N398 VanDerWaalsContact C-N 3.29Å; W396-N398 PolarHBondContact O-N 3.34Å
397	N	37.9	Very low	35.3	Very low	142 Å²	142	115.1 Å²	115.1	76%	0.759	63%	0.627	S	S	*	*	H	α-helix	trans	-78.2	-9.4	-176.3	-94.6	-13.1	0	0	0	114.4	L393 I394 D395	L393-N397 PolarHBondContact O-N 3.41Å; I394-N397 PolarHBondContact O-N 3.13Å; D395-N397 PolarHBondContact O-N 3.44Å
398	N	38.1	Very low	34.5	Very low	106 Å²	106	115.7 Å²	115.7	57%	0.567	63%	0.629	S	S	*	*	H	α-helix	trans	-101.1	-19	-178.8	-71.2	-31.6	0	0	0	113.9	D395 W396 D400 K401	D395-N398 PolarHBondContact O-N 3.45Å; W396-N398 VanDerWaalsContact C-N 3.29Å; W396-N398 PolarHBondContact O-N 3.34Å; N398-D400 PolarHBondContact O-N 3.31Å; N398-K401 PolarHBondContact O-N 3.08Å
399	E	38.3	Very low	33.5	Very low	149 Å²	149	118.1 Å²	118.1	70%	0.696	64%	0.642	S	S	*	*	G	3₁₀ helix	trans	-74.6	-21.4	-176	-73.2	-167.2	165.4	0	0	114.3	K401 C402	E399-K401 PolarHBondContact O-N 3.47Å; E399-C402 PolarHBondContact O-N 3.24Å
400	D	40.5	Very low	32.8	Very low	155 Å²	155	123 Å²	123	83%	0.829	66%	0.664	S	S	*	*	G	3₁₀ helix	trans	-72.2	2.1	177.5	-80.4	-16	0	0	0	114.1	N398	N398-D400 PolarHBondContact O-N 3.31Å
401	K	33.6	Very low	32.1	Very low	186 Å²	186	127.2 Å²	127.2	81%	0.809	68%	0.683	S	S	*	*	G	3₁₀ helix	trans	-125.7	8.5	174.7	-73.6	-172.5	-179.4	178.5	0	115.8	N398 E399 I403	N398-K401 PolarHBondContact O-N 3.08Å; E399-K401 PolarHBondContact O-N 3.47Å; K401-I403 PolarHBondContact O-N 3.29Å
402	C	30.7	Very low	31.1	Very low	96 Å²	96	130.3 Å²	130.3	65%	0.649	69%	0.693	S	S	*	*			trans	-75.9	81.9	170.3	-77.7	0	0	0	0	110.3	E399 V404	E399-C402 PolarHBondContact O-N 3.24Å; C402-V404 PolarHBondContact O-N 3.18Å
403	I	26.3	Very low	30.4	Very low	156 Å²	156	132.4 Å²	132.4	80%	0.8	71%	0.71	S	S	*	*			trans	-57.4	90.4	154.5	-60.4	168.7	0	0	0	105.8	K401 P405	K401-I403 PolarHBondContact O-N 3.29Å; I403-P405 VanDerWaalsContact O-CD 3.25Å; I403-P405 WeakPolarHBondContact O-CD 3.5Å
404	V	26.7	Very low	29.7	Very low	120 Å²	120	132.6 Å²	132.6	73%	0.727	72%	0.718	S	S	*	*			trans	-67.4	115.8	170.3	178.9	0	0	0	0	106.1	C402 C406	C402-V404 PolarHBondContact O-N 3.18Å; V404-C406 PolarHBondContact O-N 3.21Å; V404-C406 VanDerWaalsContact O-N 3.11Å
405	P	25.1	Very low	28.8	Very low	101 Å²	101	134.4 Å²	134.4	66%	0.656	73%	0.729	S	S	*	*			trans	-63.6	118.3	177.6	-14.5	28.7	0	0	0	107.9	I403 V407	I403-P405 VanDerWaalsContact O-CD 3.25Å; I403-P405 WeakPolarHBondContact O-CD 3.5Å; P405-V407 PolarHBondContact O-N 3.25Å
406	C	21.9	Very low	27.9	Very low	129 Å²	129	138.2 Å²	138.2	87%	0.872	75%	0.746	S	S	*	*			trans	-53.9	101.2	164.5	-96.3	0	0	0	0	108.1	V404 P408	V404-C406 PolarHBondContact O-N 3.21Å; V404-C406 VanDerWaalsContact O-N 3.11Å; C406-P408 WeakPolarHBondContact O-CD 3.47Å
407	V	22.4	Very low	27.2	Very low	118 Å²	118	140.4 Å²	140.4	72%	0.715	76%	0.755	S	S	*	*			trans	-87.6	113.1	164.1	-176.9	0	0	0	0	106.1	P405 L409	P405-V407 PolarHBondContact O-N 3.25Å; V407-L409 PolarHBondContact O-N 3.44Å; V407-L409 VanDerWaalsContact O-N 3.13Å
408	P	26.9	Very low	26.5	Very low	94 Å²	94	142.2 Å²	142.2	61%	0.61	76%	0.759	S	S	*	*			trans	-61.4	116.7	175.8	-17.2	30.7	0	0	0	108.7	C406 H410	C406-P408 WeakPolarHBondContact O-CD 3.47Å; P408-H410 PolarHBondContact O-CD2 3.38Å; P408-H410 PolarHBondContact O-N 3.02Å
409	L	22.3	Very low	25.6	Very low	167 Å²	167	144.6 Å²	144.6	87%	0.874	77%	0.767	S	S	*	*			trans	-66.4	96.7	173.3	-77.2	162	0	0	0	108.3	V407 I411	V407-L409 PolarHBondContact O-N 3.44Å; V407-L409 VanDerWaalsContact O-N 3.13Å; L409-I411 PolarHBondContact O-N 3.03Å; L409-I411 VanDerWaalsContact O-N 3.09Å
410	H	23.3	Very low	24.7	Very low	165 Å²	165	144.6 Å²	144.6	76%	0.764	77%	0.772	S	S	*	*			trans	-59.8	111.5	167.9	-76.9	-95.6	0	0	0	108.3	P408 N412	P408-H410 PolarHBondContact O-CD2 3.38Å; P408-H410 PolarHBondContact O-N 3.02Å; H410-N412 PolarHBondContact O-N 3.49Å
411	I	22.9	Very low	23.8	Very low	156 Å²	156	143 Å²	143	80%	0.8	77%	0.77	S	S	*	*			trans	-61.3	105.5	172.1	-63.5	168.1	0	0	0	106.8	L409 T413	L409-I411 PolarHBondContact O-N 3.03Å; L409-I411 VanDerWaalsContact O-N 3.09Å; I411-T413 PolarHBondContact O-N 2.96Å
412	N	21.3	Very low	23.2	Very low	141 Å²	141	140.1 Å²	140.1	75%	0.754	77%	0.771	S	S	*	*			trans	-62.7	99.7	171.5	-94	-28.7	0	0	0	108.9	H410 S414	H410-N412 PolarHBondContact O-N 3.49Å; N412-S414 PolarHBondContact O-N 2.94Å
413	T	25.5	Very low	22.7	Very low	140 Å²	140	143.3 Å²	143.3	86%	0.859	78%	0.782	S	S	*	*			trans	-73.1	62.1	159.3	41.1	0	0	0	0	109.3	I411 N415	I411-T413 PolarHBondContact O-N 2.96Å; T413-N415 PolarHBondContact O-N 3.05Å
414	S	22.2	Very low	22.6	Very low	86 Å²	86	140.7 Å²	140.7	60%	0.601	78%	0.778	S	S	*	*			trans	-80.5	103.1	169.6	56.2	0	0	0	0	108.6	N412	N412-S414 PolarHBondContact O-N 2.94Å
415	N	23.4	Very low	22.3	Very low	145 Å²	145	141 Å²	141	78%	0.775	78%	0.782	S	S	*	*			trans	157.5	66.4	141.4	-77.6	-15.6	0	0	0	110.2	T413	T413-N415 PolarHBondContact O-N 3.05Å
416	M	22.5	Very low	22.3	Very low	187 Å²	187	141.7 Å²	141.7	92%	0.921	79%	0.785	S	S	*	*			trans	-119.5	115.8	148.4	-77.3	-77.8	99.1	0	0	106.5	E418	M416-E418 PolarHBondContact O-N 3.17Å
417	Y	19.4	Very low	22.5	Very low	209 Å²	209	143 Å²	143	82%	0.82	78%	0.783	S	S	*	*			trans	-74.9	108.5	-172.1	-151.1	-97	0	0	0	107.8
418	E	22.6	Very low	22.5	Very low	181 Å²	181	146.8 Å²	146.8	85%	0.846	79%	0.79	S	S	*	*			trans	-148.8	108.6	159.5	-118.4	173	-162.4	0	0	109.9	M416 N420	M416-E418 PolarHBondContact O-N 3.17Å; E418-N420 PolarHBondContact O-N 3.13Å
419	Q	19.5	Very low	22.4	Very low	155 Å²	155	151.2 Å²	151.2	72%	0.724	80%	0.802	S	S	*	*			trans	-63	125.5	173.2	-67.5	168.9	-36.4	0	0	109.2
420	N	20.7	Very low	22.5	Very low	149 Å²	149	149.3 Å²	149.3	80%	0.797	80%	0.8	S	S	*	*			trans	-147.2	99.8	153.1	-88.1	-40.5	0	0	0	108.9	E418 C422	E418-N420 PolarHBondContact O-N 3.13Å; N420-C422 PolarHBondContact O-N 3.46Å
421	P	21.2	Very low	22.6	Very low	123 Å²	123	149 Å²	149	80%	0.799	80%	0.802	S	S	*	*			trans	-84.1	101.6	172.5	31.7	-26.4	0	0	0	108.7
422	C	20.3	Very low	22.5	Very low	124 Å²	124	149.9 Å²	149.9	84%	0.838	80%	0.803	S	S	*	*			trans	-126.5	113.1	168.4	-91	0	0	0	0	110.5	N420	N420-C422 PolarHBondContact O-N 3.46Å
423	N	19.5	Very low	22.6	Very low	163 Å²	163	151.5 Å²	151.5	87%	0.872	81%	0.808	S	S	*	*			trans	-50.2	139.4	169.1	-61.1	-45.4	0	0	0	112.4
424	S	24	Very low	22.6	Very low	102 Å²	102	151.6 Å²	151.6	71%	0.713	80%	0.803	S	S	*	*				176.1	126.8	123	-169.7	0	0	0	0	111.7
425	P	22.1	Very low	22.6	Very low	126 Å²	126	154.9 Å²	154.9	82%	0.818	81%	0.814	S	S	*	*			trans	-94.2	116.5	176.7	33	-26.4	0	0	0	111.4
426	V	24.8	Very low	22.6	Very low	116 Å²	116	154.1 Å²	154.1	70%	0.703	82%	0.815	S	S	*	*			trans	-142.3	122.8	174.8	-178.1	0	0	0	0	113
427	N	26.5	Very low	22.5	Very low	157 Å²	157	152.7 Å²	152.7	84%	0.84	81%	0.809	S	S	*	*			trans	70.7	115.5	155.3	-85.9	-29.8	0	0	0	123.3
428	K	22.3	Very low	22.7	Very low	197 Å²	197	147.7 Å²	147.7	86%	0.857	81%	0.805	S	S	*	*			trans	-74.7	135.2	156.9	-60.9	171.1	175.6	179.7	0	109.7
429	Q	24.1	Very low	22.7	Very low	187 Å²	187	145 Å²	145	87%	0.874	80%	0.803	S	S	*	*			trans	-152.5	123.3	149	-109.6	-177.5	-2.2	0	0	109.7
430	P	24.4	Very low	23	Very low	126 Å²	126	142.7 Å²	142.7	82%	0.818	80%	0.804	S	S	*	*			trans	-87.4	135.3	-179.3	32.1	-29.7	0	0	0	111.5
431	I	24.7	Very low	23.1	Very low	159 Å²	159	145 Å²	145	82%	0.815	81%	0.807	S	S	*	*			trans	-98.7	112.7	-179.8	-62	170.1	0	0	0	108.7
432	E	22.1	Very low	23.2	Very low	175 Å²	175	146.9 Å²	146.9	82%	0.818	81%	0.809	S	S	*	*			trans	-77.8	122.9	174.9	-130.5	172.2	-179.4	0	0	109.7
433	M	22.8	Very low	23.4	Very low	175 Å²	175	146.2 Å²	146.2	86%	0.862	80%	0.8	S	S	*	*			trans	-97.4	110.7	176.9	-83.3	-169.6	-90.7	0	0	110.5
434	N	25.5	Very low	23.4	Very low	142 Å²	142	146.5 Å²	146.5	76%	0.759	80%	0.796	S	S	*	*			trans	-89.3	120.6	172.9	-74.7	-44.1	0	0	0	110.7
435	N	22.7	Very low	23.3	Very low	154 Å²	154	149 Å²	149	82%	0.824	80%	0.802	S	S	*	*			trans	-86.9	120.3	173.9	-76.3	-33.9	0	0	0	110.6
436	T	22.5	Very low	23.3	Very low	129 Å²	129	151.5 Å²	151.5	79%	0.791	80%	0.802	S	S	*	*			trans	-130.7	99.9	169	-16.9	0	0	0	0	108.7
437	I	21	Very low	23.1	Very low	157 Å²	157	151.4 Å²	151.4	81%	0.805	81%	0.807	S	S	*	*			trans	-97.1	113.5	176.7	-61.7	170.8	0	0	0	107.7
438	S	23.7	Very low	23	Very low	104 Å²	104	149.8 Å²	149.8	73%	0.727	81%	0.808	S	S	*	*			trans	-99.5	121.8	173.5	-66.5	0	0	0	0	110	S440	S438-S440 PolarHBondContact O-N 3.17Å
439	P	22.6	Very low	22.9	Very low	124 Å²	124	147.7 Å²	147.7	81%	0.805	81%	0.805	S	S	*	*			trans	-84.2	108.8	178.4	30.4	-29	0	0	0	110.6
440	S	25.1	Very low	22.8	Very low	107 Å²	107	144.1 Å²	144.1	75%	0.748	80%	0.796	S	S	*	*			trans	-82.8	122.6	173.8	44.4	0	0	0	0	111.2	S438 I442	S438-S440 PolarHBondContact O-N 3.17Å; S440-I442 PolarHBondContact O-N 3.06Å
441	K	23.3	Very low	22.8	Very low	197 Å²	197	144 Å²	144	86%	0.857	80%	0.798	S	S	*	*			trans	-62.7	120.1	174.6	-64	170.6	177.6	178.1	0	110.2
442	I	24.3	Very low	22.5	Very low	164 Å²	164	145.8 Å²	145.8	84%	0.841	80%	0.8	S	S	*	*			trans	-106.8	117	163.4	-63	176.4	0	0	0	107.4	S440	S440-I442 PolarHBondContact O-N 3.06Å
443	V	22.8	Very low	22.5	Very low	109 Å²	109	142.9 Å²	142.9	66%	0.661	80%	0.799	S	S	*	*			trans	-81.2	133.3	-166.8	169.9	0	0	0	0	110.5	N445	V443-N445 PolarHBondContact O-N 3Å
444	H	20.7	Very low	22.3	Very low	169 Å²	169	143.3 Å²	143.3	78%	0.782	80%	0.798	S	S	*	*			trans	-62.4	120	167.1	-83.5	-78.8	0	0	0	110.4
445	N	22.1	Very low	22.1	Very low	155 Å²	155	143.7 Å²	143.7	83%	0.829	80%	0.799	S	S	*	*			trans	-99.5	87	166.5	-77.1	-18.8	0	0	0	109	V443	V443-N445 PolarHBondContact O-N 3Å
446	E	20.6	Very low	22.1	Very low	179 Å²	179	142.9 Å²	142.9	84%	0.836	80%	0.795	S	S	*	*			trans	-106	92.4	162.2	-74.8	-172.8	167.2	0	0	108.5
447	S	21.9	Very low	21.9	Very low	113 Å²	113	144.6 Å²	144.6	79%	0.79	80%	0.799	S	S	*	*			trans	-172.6	102.3	158.6	60.2	0	0	0	0	111.5
448	S	24.6	Very low	22	Very low	123 Å²	123	142.8 Å²	142.8	86%	0.86	80%	0.795	S	S	*	*			trans	-158	89.7	154	170.9	0	0	0	0	108.1
449	L	20.4	Very low	21.7	Very low	153 Å²	153	144.3 Å²	144.3	80%	0.801	80%	0.8	S	S	*	*			trans	-55.1	138.9	171.2	-81.2	126.5	0	0	0	112.7
450	V	20.3	Very low	21.6	Very low	113 Å²	113	144 Å²	144	69%	0.685	80%	0.796	S	S	*	*				49	105.6	128	-172.5	0	0	0	0	117.5	K452	V450-K452 HydrophobicContact CG1-CG 4.44Å
451	S	24.4	Very low	21.3	Very low	122 Å²	122	144.9 Å²	144.9	85%	0.853	80%	0.797	S	S	*	*			trans	-125.2	102.4	143.4	38	0	0	0	0	109.1	S453	S451-S453 PolarHBondContact O-N 3.5Å
452	K	19.4	Very low	21.1	Very low	198 Å²	198	139.7 Å²	139.7	86%	0.861	79%	0.791	S	S	*	*			trans	-65.5	120.7	163.3	-82	172.7	171.6	174.4	0	108.3	V450	V450-K452 HydrophobicContact CG1-CG 4.44Å
453	S	22.3	Very low	21.1	Very low	113 Å²	113	137.9 Å²	137.9	79%	0.79	79%	0.788	S	S	*	*			trans	-131	94.9	153.2	57.7	0	0	0	0	108.5	S451	S451-S453 PolarHBondContact O-N 3.5Å
454	Q	19.2	Very low	21.1	Very low	184 Å²	184	142.3 Å²	142.3	86%	0.86	80%	0.801	S	S	*	*			trans	-57.9	135.9	151.7	-79.6	168.4	-46.4	0	0	107.7
455	I	19.8	Very low	21.2	Very low	151 Å²	151	141 Å²	141	77%	0.774	80%	0.8	S	S	*	*			trans	-170.9	122	144.6	-93.8	147	0	0	0	109.1
456	N	23.1	Very low	21.3	Very low	137 Å²	137	143 Å²	143	73%	0.733	80%	0.802	S	S	*	*			trans	70.3	99.9	149.7	-60.7	-3.9	0	0	0	121.6	V458	N456-V458 PolarHBondContact O-N 2.92Å
457	N	19.4	Very low	21.5	Very low	164 Å²	164	140.3 Å²	140.3	88%	0.877	80%	0.8	S	S	*	*			trans	-49.6	118.7	144.7	-65	-21.3	0	0	0	110.6
458	V	21.8	Very low	21.7	Very low	120 Å²	120	142.6 Å²	142.6	73%	0.727	80%	0.798	S	S	*	*			trans	-121.6	107.5	156.8	178.6	0	0	0	0	107	N456 T460	N456-V458 PolarHBondContact O-N 2.92Å; V458-T460 PolarHBondContact O-N 3.47Å
459	T	17.3	Very low	21.7	Very low	135 Å²	135	144 Å²	144	83%	0.828	80%	0.795	S	S	*	*			trans	-72.1	107.8	170.4	-48.2	0	0	0	0	108
460	T	21.3	Very low	22	Very low	117 Å²	117	145.2 Å²	145.2	72%	0.718	79%	0.794	S	S	*	*			trans	-133	114.6	164	-23.7	0	0	0	0	109.2	V458	V458-T460 PolarHBondContact O-N 3.47Å
461	T	18.4	Very low	22.2	Very low	126 Å²	126	145.1 Å²	145.1	77%	0.773	79%	0.794	S	S	*	*			trans	-58.2	156	166.3	44.1	0	0	0	0	112.1
462	A	19.8	Very low	22.4	Very low	89 Å²	89	145.2 Å²	145.2	74%	0.736	79%	0.789	S	S	*	*			trans	93.1	84.8	167.5	0	0	0	0	0	116.9
463	T	23	Very low	22.9	Very low	126 Å²	126	141.6 Å²	141.6	77%	0.773	78%	0.779	S	S	*	*				166.1	110.8	118.1	34.3	0	0	0	0	108	N465	T463-N465 PolarHBondContact O-N 3.18Å
464	E	23.4	Very low	23.4	Very low	201 Å²	201	142.9 Å²	142.9	94%	0.939	78%	0.777	S	S	*	*			trans	-71.1	72.7	176.4	-72.4	-179	144.7	0	0	110.5
465	N	23.9	Very low	24.1	Very low	142 Å²	142	139.3 Å²	139.3	76%	0.759	77%	0.767	S	S	*	*			trans	-92.6	102.1	162.7	-79.4	-22.3	0	0	0	108.1	T463 P467	T463-N465 PolarHBondContact O-N 3.18Å; N465-P467 WeakPolarHBondContact O-CD 3.47Å
466	K	22.7	Very low	24.8	Very low	198 Å²	198	136.7 Å²	136.7	86%	0.861	76%	0.758	S	S	*	*			trans	-47.3	118.3	166.4	-122.1	177	179.5	179.1	0	108.9	E468	K466-E468 PolarHBondContact O-N 3.38Å
467	P	25.4	Very low	25.1	Very low	122 Å²	122	133 Å²	133	79%	0.792	75%	0.747	S	S	*	*			trans	-80.4	98.7	176.1	29.7	-28.2	0	0	0	108.5	N465 L469	N465-P467 WeakPolarHBondContact O-CD 3.47Å; P467-L469 PolarHBondContact O-N 3.39Å
468	E	25.2	Very low	25.6	Very low	160 Å²	160	132.3 Å²	132.3	75%	0.748	74%	0.736	S	S	*	*			trans	-70.4	112.9	163.5	-84.1	-176.1	166.7	0	0	108.7	K466 F470	K466-E468 PolarHBondContact O-N 3.38Å; E468-F470 WeakPolarHBondContact O-CD2 3.48Å; E468-F470 PolarHBondContact O-N 3.13Å
469	L	25.1	Very low	25.9	Very low	153 Å²	153	134.2 Å²	134.2	80%	0.801	74%	0.739	S	S	*	*			trans	-65.2	90	-178.3	-170.7	75.1	0	0	0	110.2	P467 T471	P467-L469 PolarHBondContact O-N 3.39Å; L469-T471 VanDerWaalsContact C-N 3.34Å; L469-T471 HydrophobicContact CG-CG2 4.36Å; L469-T471 PolarHBondContact O-N 3.04Å
470	F	26.1	Very low	26.5	Very low	178 Å²	178	134 Å²	134	78%	0.781	73%	0.732	S	S	*	*			trans	-75	84.5	166.4	-74.6	-81.1	0	0	0	110	E468	E468-F470 WeakPolarHBondContact O-CD2 3.48Å; E468-F470 PolarHBondContact O-N 3.13Å
471	T	26.2	Very low	26.9	Very low	111 Å²	111	135.7 Å²	135.7	68%	0.681	73%	0.732	S	S	*	*			trans	-111.6	64.4	160	51.5	0	0	0	0	109	L469 D473	L469-T471 VanDerWaalsContact C-N 3.34Å; L469-T471 HydrophobicContact CG-CG2 4.36Å; L469-T471 PolarHBondContact O-N 3.04Å; T471-D473 PolarHBondContact O-N 3.49Å
472	T	28.2	Very low	27.4	Very low	125 Å²	125	135.8 Å²	135.8	77%	0.767	73%	0.728	S	S	*	*			trans	-83	107.4	160.6	42.2	0	0	0	0	107.8	L474	T472-L474 PolarHBondContact O-N 3.04Å
473	D	29.4	Very low	27.7	Very low	121 Å²	121	135.5 Å²	135.5	65%	0.647	72%	0.721	S	S	*	*			trans	-36	119.6	175	-96.5	-42	0	0	0	113	T471 V475 T476	T471-D473 PolarHBondContact O-N 3.49Å; D473-V475 PolarHBondContact O-N 3.3Å; D473-T476 PolarHBondContact O-N 3.35Å
474	L	32.2	Very low	27.9	Very low	141 Å²	141	136.6 Å²	136.6	74%	0.738	72%	0.722	S	S	*	*	H	α-helix	trans	-52.2	-18.3	172.9	-166.8	73.9	0	0	0	112.8	T472	T472-L474 PolarHBondContact O-N 3.04Å
475	V	35.3	Very low	28.3	Very low	108 Å²	108	132.7 Å²	132.7	66%	0.655	71%	0.712	S	S	*	*	H	α-helix	trans	-68.4	-34.4	179.1	-174.9	0	0	0	0	112	D473	D473-V475 PolarHBondContact O-N 3.3Å
476	T	33.3	Very low	28.7	Very low	96 Å²	96	132.9 Å²	132.9	59%	0.589	71%	0.711	S	S	*	*	H	α-helix	trans	-78.4	-31.6	-178.3	-45.7	0	0	0	0	112	D473 M479	D473-T476 PolarHBondContact O-N 3.35Å; T476-M479 PolarHBondContact O-N 3.41Å
477	A	30.1	Very low	29	Very low	61 Å²	61	129 Å²	129	50%	0.504	70%	0.7	S	S	.	*	H	α-helix	trans	-69.8	-33.5	178.6	0	0	0	0	0	112.9	L480 Q481	A477-L480 PolarHBondContact O-N 3.3Å; A477-Q481 PolarHBondContact O-N 2.74Å
478	K	28.8	Very low	29.5	Very low	148 Å²	148	131.7 Å²	131.7	64%	0.643	70%	0.702	S	S	*	*	H	α-helix	trans	-73.4	-27.6	176.9	-91.5	-173.5	174.9	-179.7	0	113.7	L480	K478-L480 VanDerWaalsContact C-N 3.33Å
479	M	29.3	Very low	30.1	Very low	160 Å²	160	129.9 Å²	129.9	79%	0.788	70%	0.697	S	S	*	*	H	α-helix	trans	-71.1	-28.2	174.6	-88.6	-148.5	155.3	0	0	113.1	T476	T476-M479 PolarHBondContact O-N 3.41Å
480	L	29.8	Very low	30.6	Very low	130 Å²	130	127.1 Å²	127.1	68%	0.681	68%	0.683	S	S	*	*	H	α-helix	trans	-83	-17.4	178.6	-76.4	168.2	0	0	0	114.4	A477 K478	A477-L480 PolarHBondContact O-N 3.3Å; K478-L480 VanDerWaalsContact C-N 3.33Å
481	Q	30.5	Very low	31	Very low	154 Å²	154	126.8 Å²	126.8	72%	0.72	68%	0.681	S	S	*	*	H	α-helix	trans	-89.2	-17	177.2	-75.9	-161.9	-19.3	0	0	114.6	A477 S483	A477-Q481 PolarHBondContact O-N 2.74Å; Q481-S483 PolarHBondContact O-N 3.21Å
482	N	27.5	Very low	31.7	Very low	127 Å²	127	127.9 Å²	127.9	68%	0.679	68%	0.679	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.6	5.7	-174.2	-76.7	-3.7	0	0	0	115.4
483	S	26.8	Very low	32.3	Very low	84 Å²	84	124.6 Å²	124.6	59%	0.587	66%	0.661	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107.2	4.1	178.2	42.1	0	0	0	0	115.4	Q481	Q481-S483 PolarHBondContact O-N 3.21Å
484	N	27.3	Very low	32.7	Very low	149 Å²	149	123 Å²	123	80%	0.797	65%	0.652	S	S	*	*	S	Bend	trans	-101.1	9	-177.6	-84.2	-12	0	0	0	116
485	T	30.5	Very low	32.7	Very low	119 Å²	119	121.2 Å²	121.2	73%	0.73	64%	0.643	S	S	*	*			trans	-123.4	16.3	-178.4	13	0	0	0	0	115.4	N487	T485-N487 PolarHBondContact O-N 2.7Å
486	I	32.6	Very low	32.9	Very low	145 Å²	145	120.6 Å²	120.6	74%	0.744	64%	0.636	S	S	*	*	S	Bend	trans	-94.2	90.1	170.1	-62.2	177.5	0	0	0	109.4
487	N	29.8	Very low	33.2	Very low	116 Å²	116	121.9 Å²	121.9	62%	0.62	64%	0.635	S	S	*	*			trans	25.2	124	149.2	-66.6	-21.7	0	0	0	118.7	T485 D489 N490	T485-N487 PolarHBondContact O-N 2.7Å; N487-D489 PolarHBondContact O-N 3.29Å; N487-N490 PolarHBondContact O-N 3.49Å
488	Q	35	Very low	33.6	Very low	179 Å²	179	123.1 Å²	123.1	84%	0.836	63%	0.633	S	S	*	*	T	Hydrogen-bonded Turn	trans	-53.8	-9.8	174.2	-68.4	-167.3	-12.2	0	0	115.3	N490 K491	Q488-N490 PolarHBondContact O-N 2.99Å; Q488-K491 PolarHBondContact O-N 3.24Å
489	D	38.3	Very low	34.1	Very low	123 Å²	123	123.4 Å²	123.4	66%	0.658	63%	0.634	S	S	*	*	H	α-helix	trans	-66.3	-22.7	179.9	-61.6	-29.5	0	0	0	113	N487 Q492 S493	N487-D489 PolarHBondContact O-N 3.29Å; D489-Q492 PolarHBondContact O-N 2.81Å; D489-S493 PolarHBondContact O-N 3Å
490	N	36.4	Very low	34.5	Very low	95 Å²	95	118.6 Å²	118.6	51%	0.508	62%	0.616	S	S	.	*	H	α-helix	trans	-83.1	-17	-178	-138.3	14.5	0	0	0	114.4	N487 Q488 Q492 S493 I494	N487-N490 PolarHBondContact O-N 3.49Å; Q488-N490 PolarHBondContact O-N 2.99Å; N490-Q492 PolarHBondContact O-N 3.34Å; N490-S493 PolarHBondContact O-N 3.39Å; N490-S493 WeakPolarHBondContact OD1-CB 3.43Å; N490-I494 WeakPolarHBondContact O-CG1 3.46Å; N490-I494 PolarHBondContact O-N 3.39Å; N490-I494 VanDerWaalsContact O-N 3.13Å
491	K	34.5	Very low	34.7	Very low	170 Å²	170	118.8 Å²	118.8	74%	0.739	62%	0.617	S	S	*	*	H	α-helix	trans	-68.8	-27.4	171	-80.6	-171.3	178.4	-178.9	0	111.8	Q488 N495	Q488-K491 PolarHBondContact O-N 3.24Å; K491-N495 WeakPolarHBondContact O-CB 3.34Å; K491-N495 PolarHBondContact O-N 3.42Å
492	Q	39.6	Very low	35	Very low	134 Å²	134	118.1 Å²	118.1	63%	0.626	62%	0.618	S	S	*	*	H	α-helix	trans	-81.2	-32.4	176.6	-152.2	158.4	9.6	0	0	111.6	D489 N490 N495 N496	D489-Q492 PolarHBondContact O-N 2.81Å; N490-Q492 PolarHBondContact O-N 3.34Å; Q492-N495 PolarHBondContact O-N 3.44Å; Q492-N496 VanDerWaalsContact O-CB 3.26Å; Q492-N496 WeakPolarHBondContact O-CB 3.33Å; Q492-N496 VanDerWaalsContact O-CG 3.24Å; Q492-N496 PolarHBondContact O-N 3.29Å; Q492-N496 PolarHBondContact O-ND2 2.84Å
493	S	40.5	Very low	35.3	Very low	57 Å²	57	116.5 Å²	116.5	40%	0.399	62%	0.616	S	S	.	*	H	α-helix	trans	-62.3	-47.2	171.5	-166.1	0	0	0	0	111.8	D489 N490 N495 N496 E497	D489-S493 PolarHBondContact O-N 3Å; N490-S493 PolarHBondContact O-N 3.39Å; N490-S493 WeakPolarHBondContact OD1-CB 3.43Å; S493-N495 PolarHBondContact O-N 3.34Å; S493-N496 CarbonylContact O-C 3.48Å; S493-N496 PolarHBondContact O-N 2.79Å; S493-E497 PolarHBondContact O-N 3.03Å
494	I	38.8	Very low	35.2	Very low	88 Å²	88	116.4 Å²	116.4	45%	0.451	62%	0.615	S	S	.	*	H	α-helix	trans	-66.5	-40.3	179	-61.8	166.8	0	0	0	111.2	N490 N496 E497 I498	N490-I494 WeakPolarHBondContact O-CG1 3.46Å; N490-I494 PolarHBondContact O-N 3.39Å; N490-I494 VanDerWaalsContact O-N 3.13Å; I494-N496 VanDerWaalsContact C-N 3.32Å; I494-N496 PolarHBondContact O-N 2.97Å; I494-E497 PolarHBondContact O-N 3.39Å; I494-I498 HydrophobicContact CG2-CD1 3.8Å; I494-I498 HydrophobicContact CG2-CG1 4.35Å; I494-I498 WeakPolarHBondContact O-CB 3.49Å; I494-I498 VanDerWaalsContact O-CG1 3.25Å; I494-I498 WeakPolarHBondContact O-CG1 3.35Å; I494-I498 PolarHBondContact O-N 3.35Å
495	N	33	Very low	35.3	Very low	102 Å²	102	114 Å²	114	55%	0.545	60%	0.602	S	S	.	*	H	α-helix	trans	-68.1	-32.5	176.4	-85.1	-22.4	0	0	0	112.7	K491 Q492 S493 K499	K491-N495 WeakPolarHBondContact O-CB 3.34Å; K491-N495 PolarHBondContact O-N 3.42Å; Q492-N495 PolarHBondContact O-N 3.44Å; S493-N495 PolarHBondContact O-N 3.34Å; N495-K499 VanDerWaalsContact O-CB 3.31Å; N495-K499 WeakPolarHBondContact O-CB 3.44Å; N495-K499 PolarHBondContact O-N 3.48Å
496	N	39.5	Very low	35.4	Very low	96 Å²	96	118.3 Å²	118.3	51%	0.513	61%	0.61	S	S	.	*	H	α-helix	trans	-76	-32.6	173.5	-74.2	-13.8	0	0	0	111.8	Q492 S493 I494 S500	Q492-N496 VanDerWaalsContact O-CB 3.26Å; Q492-N496 WeakPolarHBondContact O-CB 3.33Å; Q492-N496 VanDerWaalsContact O-CG 3.24Å; Q492-N496 PolarHBondContact O-N 3.29Å; Q492-N496 PolarHBondContact O-ND2 2.84Å; S493-N496 CarbonylContact O-C 3.48Å; S493-N496 PolarHBondContact O-N 2.79Å; I494-N496 VanDerWaalsContact C-N 3.32Å; I494-N496 PolarHBondContact O-N 2.97Å; N496-S500 WeakPolarHBondContact O-CA 3.35Å; N496-S500 WeakPolarHBondContact O-CB 3.23Å; N496-S500 PolarHBondContact O-N 3.04Å
497	E	39.6	Very low	35.4	Very low	123 Å²	123	120.9 Å²	120.9	58%	0.575	62%	0.619	S	S	*	*	H	α-helix	trans	-67.5	-41.2	170.4	-99.6	-176.5	162	0	0	111.3	S493 I494 S500 L501	S493-E497 PolarHBondContact O-N 3.03Å; I494-E497 PolarHBondContact O-N 3.39Å; E497-S500 PolarHBondContact O-N 3.03Å; E497-L501 VanDerWaalsContact O-CB 3.28Å; E497-L501 WeakPolarHBondContact O-CB 3.36Å; E497-L501 WeakPolarHBondContact O-CG 3.48Å; E497-L501 PolarHBondContact O-N 2.96Å
498	I	37	Very low	35.5	Very low	87 Å²	87	116.9 Å²	116.9	45%	0.446	61%	0.605	S	S	.	*	H	α-helix	trans	-66.6	-45.1	175.2	-66.4	168.6	0	0	0	110.1	I494 S500 L501 L502	I494-I498 HydrophobicContact CG2-CD1 3.8Å; I494-I498 HydrophobicContact CG2-CG1 4.35Å; I494-I498 WeakPolarHBondContact O-CB 3.49Å; I494-I498 VanDerWaalsContact O-CG1 3.25Å; I494-I498 WeakPolarHBondContact O-CG1 3.35Å; I494-I498 PolarHBondContact O-N 3.35Å; I498-S500 VanDerWaalsContact C-N 3.34Å; I498-S500 PolarHBondContact O-N 3.48Å; I498-L501 PolarHBondContact O-N 3.37Å; I498-L502 HydrophobicContact CG2-CD1 3.8Å; I498-L502 WeakPolarHBondContact O-CB 3.46Å; I498-L502 WeakPolarHBondContact O-CD1 3.39Å; I498-L502 PolarHBondContact O-N 2.95Å
499	K	40.1	Very low	35.5	Very low	153 Å²	153	112.9 Å²	112.9	67%	0.665	60%	0.598	S	S	*	*	H	α-helix	trans	-66.1	-34	173.8	-95.7	-175.9	174	178.7	0	112.9	N495 L502 S503	N495-K499 VanDerWaalsContact O-CB 3.31Å; N495-K499 WeakPolarHBondContact O-CB 3.44Å; N495-K499 PolarHBondContact O-N 3.48Å; K499-L502 CarbonylContact O-C 3.56Å; K499-L502 PolarHBondContact O-N 3.45Å; K499-S503 WeakPolarHBondContact O-CB 3.47Å; K499-S503 PolarHBondContact O-N 3.07Å
500	S	38.1	Very low	35.6	Very low	60 Å²	60	111.7 Å²	111.7	42%	0.42	60%	0.599	S	S	.	*	H	α-helix	trans	-70	-40.9	175.7	-169.6	0	0	0	0	109.4	N496 E497 I498 L502 S503 C504	N496-S500 WeakPolarHBondContact O-CA 3.35Å; N496-S500 WeakPolarHBondContact O-CB 3.23Å; N496-S500 PolarHBondContact O-N 3.04Å; E497-S500 PolarHBondContact O-N 3.03Å; I498-S500 VanDerWaalsContact C-N 3.34Å; I498-S500 PolarHBondContact O-N 3.48Å; S500-L502 VanDerWaalsContact C-N 3.28Å; S500-L502 PolarHBondContact O-N 3.23Å; S500-S503 PolarHBondContact O-N 3Å; S500-C504 WeakPolarHBondContact O-CA 3.41Å; S500-C504 WeakPolarHBondContact O-CB 3.47Å; S500-C504 PolarHBondContact O-N 3.35Å; S500-C504 PolarHBondContact O-SG 2.89Å; S500-C504 PolarHBondContact OG-SG 3.48Å; S500-C504 VanDerWaalsContact OG-SG 3.4Å
501	L	34	Very low	36	Very low	133 Å²	133	116.2 Å²	116.2	70%	0.696	61%	0.61	S	S	*	*	H	α-helix	trans	-64.1	-32.8	171.3	-73.8	167.5	0	0	0	112.3	E497 I498	E497-L501 VanDerWaalsContact O-CB 3.28Å; E497-L501 WeakPolarHBondContact O-CB 3.36Å; E497-L501 WeakPolarHBondContact O-CG 3.48Å; E497-L501 PolarHBondContact O-N 2.96Å; I498-L501 PolarHBondContact O-N 3.37Å
502	L	36.1	Very low	36.7	Very low	141 Å²	141	115.2 Å²	115.2	74%	0.738	61%	0.606	S	S	*	*	H	α-helix	trans	-78.7	-24.6	173.7	-85.7	143.9	0	0	0	113.7	I498 K499 S500	I498-L502 HydrophobicContact CG2-CD1 3.8Å; I498-L502 WeakPolarHBondContact O-CB 3.46Å; I498-L502 WeakPolarHBondContact O-CD1 3.39Å; I498-L502 PolarHBondContact O-N 2.95Å; K499-L502 CarbonylContact O-C 3.56Å; K499-L502 PolarHBondContact O-N 3.45Å; S500-L502 VanDerWaalsContact C-N 3.28Å; S500-L502 PolarHBondContact O-N 3.23Å
503	S	33.1	Very low	37.6	Very low	92 Å²	92	112.1 Å²	112.1	64%	0.643	60%	0.599	S	S	*	*	H	α-helix	trans	-99.1	-28.9	-178	-165.2	0	0	0	0	112.9	K499 S500 N505	K499-S503 WeakPolarHBondContact O-CB 3.47Å; K499-S503 PolarHBondContact O-N 3.07Å; S500-S503 PolarHBondContact O-N 3Å; S503-N505 PolarHBondContact O-N 3.24Å
504	C	24.8	Very low	39	Very low	83 Å²	83	114.6 Å²	114.6	56%	0.561	61%	0.607	S	S	*	*	S	Bend	trans	-84.3	53.7	175.4	-64.7	0	0	0	0	110.7	S500	S500-C504 WeakPolarHBondContact O-CA 3.41Å; S500-C504 WeakPolarHBondContact O-CB 3.47Å; S500-C504 PolarHBondContact O-N 3.35Å; S500-C504 PolarHBondContact O-SG 2.89Å; S500-C504 PolarHBondContact OG-SG 3.48Å; S500-C504 VanDerWaalsContact OG-SG 3.4Å
505	N	30.9	Very low	40.5	Very low	98 Å²	98	115.8 Å²	115.8	52%	0.524	61%	0.614	S	S	.	*			trans	-151.4	62.8	155.8	-102.4	-25.1	0	0	0	110.5	S503 Q507 G508	S503-N505 PolarHBondContact O-N 3.24Å; N505-Q507 VanDerWaalsContact C-N 3.29Å; N505-G508 PolarHBondContact ND2-O 3.41Å; N505-G508 WeakPolarHBondContact OD1-CA 3.47Å; N505-G508 PolarHBondContact OD1-N 3.11Å; N505-G508 PolarHBondContact OD1-O 3.33Å
506	K	32.7	Very low	42.4	Very low	209 Å²	209	114 Å²	114	91%	0.909	61%	0.607	S	S	*	*	S	Bend	trans	-80.9	-2.9	159.3	-92.4	-173.1	176.1	-179.6	0	113.8
507	Q	31	Very low	43.9	Very low	199 Å²	199	112.9 Å²	112.9	93%	0.93	60%	0.604	S	S	*	*	S	Bend	trans	-143.2	-4.8	178.2	-73.1	-163.5	-17.5	0	0	116.9	N505	N505-Q507 VanDerWaalsContact C-N 3.29Å
508	G	32.1	Very low	45.9	Very low	32 Å²	32	112.9 Å²	112.9	33%	0.33	60%	0.602	S	S	.	*			trans	-112.5	78.5	172.2	0	0	0	0	0	110	N505 S510	N505-G508 PolarHBondContact ND2-O 3.41Å; N505-G508 WeakPolarHBondContact OD1-CA 3.47Å; N505-G508 PolarHBondContact OD1-N 3.11Å; N505-G508 PolarHBondContact OD1-O 3.33Å; G508-S510 PolarHBondContact O-N 2.97Å
509	S	35.4	Very low	47.9	Very low	96 Å²	96	111.1 Å²	111.1	67%	0.671	60%	0.6	S	S	*	*			trans	-59.1	81.8	167.6	168.8	0	0	0	0	109	Y511	S509-Y511 PolarHBondContact O-N 2.85Å; S509-Y511 WeakPolarHBondContact OG-CD2 3.39Å
510	S	41.2	Very low	50	Low	97 Å²	97	108.9 Å²	108.9	68%	0.678	60%	0.595	S	S	*	*			trans	-75.8	48.9	157.8	77	0	0	0	0	107.8	G508 F512	G508-S510 PolarHBondContact O-N 2.97Å; S510-F512 PolarHBondContact O-N 3.28Å
511	Y	44.4	Very low	52	Low	191 Å²	191	108.8 Å²	108.8	75%	0.749	59%	0.594	S	S	*	*			trans	-56.6	112.7	158.6	-99.7	-104.7	0	0	0	104.4	S509 S513	S509-Y511 PolarHBondContact O-N 2.85Å; S509-Y511 WeakPolarHBondContact OG-CD2 3.39Å; Y511-S513 PolarHBondContact O-N 3.43Å
512	F	47.9	Very low	54.6	Low	149 Å²	149	106.9 Å²	106.9	65%	0.654	58%	0.582	S	S	*	*			trans	-42.5	122.9	153	-72.2	-81	0	0	0	105.3	S510 L514 V516 V517	S510-F512 PolarHBondContact O-N 3.28Å; F512-L514 PolarHBondContact O-N 3.22Å; F512-V516 HydrophobicContact CB-CB 4.47Å; F512-V516 HydrophobicContact CD1-CG1 4.26Å; F512-V517 HydrophobicContact CB-CG2 3.65Å
513	S	59.4	Low	57.1	Low	68 Å²	68	104.6 Å²	104.6	48%	0.476	57%	0.57	S	S	.	*			trans	-46.5	133.6	-179.7	-163.4	0	0	0	0	107.3	Y511 D515 V516 V517	Y511-S513 PolarHBondContact O-N 3.43Å; S513-D515 CarbonylContact O-C 3.54Å; S513-D515 PolarHBondContact O-N 2.95Å; S513-V516 WeakPolarHBondContact O-CA 3.4Å; S513-V516 WeakPolarHBondContact O-CB 3.46Å; S513-V516 PolarHBondContact O-N 2.92Å; S513-V517 PolarHBondContact O-N 3.05Å
514	L	69.7	Low	59.7	Low	110 Å²	110	105.1 Å²	105.1	58%	0.576	57%	0.565	S	S	*	*	H	α-helix	trans	-49.8	-29.4	-172.7	-175.7	65.1	0	0	0	111.7	F512 V517 K518	F512-L514 PolarHBondContact O-N 3.22Å; L514-V517 PolarHBondContact O-N 2.8Å; L514-K518 WeakPolarHBondContact O-CB 3.38Å; L514-K518 WeakPolarHBondContact O-CG 3.24Å; L514-K518 PolarHBondContact O-N 3.25Å
515	D	71.2	Confident	62.8	Low	112 Å²	112	104.2 Å²	104.2	60%	0.599	56%	0.555	S	S	*	*	H	α-helix	trans	-63.3	-39.4	174.3	-58.5	-24.4	0	0	0	113.8	S513 A519	S513-D515 CarbonylContact O-C 3.54Å; S513-D515 PolarHBondContact O-N 2.95Å; D515-A519 VanDerWaalsContact O-CB 3.31Å; D515-A519 WeakPolarHBondContact O-CB 3.44Å; D515-A519 PolarHBondContact O-N 2.91Å
516	V	72	Confident	65.7	Low	66 Å²	66	107.5 Å²	107.5	40%	0.4	56%	0.56	S	S	.	*	H	α-helix	trans	-68.4	-43	176.2	179.5	0	0	0	0	110.4	F512 S513 K518 A519 L520	F512-V516 HydrophobicContact CB-CB 4.47Å; F512-V516 HydrophobicContact CD1-CG1 4.26Å; S513-V516 WeakPolarHBondContact O-CA 3.4Å; S513-V516 WeakPolarHBondContact O-CB 3.46Å; S513-V516 PolarHBondContact O-N 2.92Å; V516-K518 VanDerWaalsContact C-N 3.34Å; V516-A519 PolarHBondContact O-N 2.94Å; V516-L520 HydrophobicContact CG1-CD1 4.07Å; V516-L520 HydrophobicContact CG1-CG 4.42Å; V516-L520 WeakPolarHBondContact O-CB 3.49Å; V516-L520 VanDerWaalsContact O-CG 3.3Å; V516-L520 WeakPolarHBondContact O-CG 3.4Å; V516-L520 PolarHBondContact O-N 3.01Å
517	V	71.4	Confident	68.4	Low	72 Å²	72	102 Å²	102	44%	0.436	54%	0.54	S	S	.	.	H	α-helix	trans	-63.9	-43	177.3	-178.8	0	0	0	0	110.4	F512 S513 L514 L520 S521	F512-V517 HydrophobicContact CB-CG2 3.65Å; S513-V517 PolarHBondContact O-N 3.05Å; L514-V517 PolarHBondContact O-N 2.8Å; V517-L520 PolarHBondContact O-N 3.42Å; V517-S521 PolarHBondContact O-N 2.8Å; V517-S521 PolarHBondContact O-OG 3.39Å
518	K	81.8	Confident	71.2	Confident	122 Å²	122	95.7 Å²	95.7	53%	0.53	51%	0.513	S	S	.	.	H	α-helix	trans	-61	-44.4	173.6	-77.6	178.8	178.4	-178.7	0	112.4	L514 V516 L520 S521 E522	L514-K518 WeakPolarHBondContact O-CB 3.38Å; L514-K518 WeakPolarHBondContact O-CG 3.24Å; L514-K518 PolarHBondContact O-N 3.25Å; V516-K518 VanDerWaalsContact C-N 3.34Å; K518-L520 VanDerWaalsContact C-N 3.34Å; K518-L520 PolarHBondContact O-N 3.44Å; K518-S521 WeakPolarHBondContact CA-OG 3.43Å; K518-S521 PolarHBondContact O-N 2.99Å; K518-S521 PolarHBondContact O-OG 2.98Å; K518-E522 WeakPolarHBondContact O-CB 3.27Å; K518-E522 PolarHBondContact O-N 3.01Å
519	A	79	Confident	73.8	Confident	51 Å²	51	98.5 Å²	98.5	42%	0.421	52%	0.523	S	S	.	.	H	α-helix	trans	-63.4	-40.6	177.6	0	0	0	0	0	111.9	D515 V516 E522 I523	D515-A519 VanDerWaalsContact O-CB 3.31Å; D515-A519 WeakPolarHBondContact O-CB 3.44Å; D515-A519 PolarHBondContact O-N 2.91Å; V516-A519 PolarHBondContact O-N 2.94Å; A519-E522 PolarHBondContact O-N 3.36Å; A519-I523 VanDerWaalsContact O-CG1 3.26Å; A519-I523 WeakPolarHBondContact O-CG1 3.5Å; A519-I523 PolarHBondContact O-N 3Å
520	L	83.1	Confident	76.3	Confident	105 Å²	105	98.9 Å²	98.9	55%	0.55	52%	0.516	S	S	.	.	H	α-helix	trans	-67.6	-42.3	176.5	-71.7	173.1	0	0	0	112	V516 V517 K518 E522 I523 D524	V516-L520 HydrophobicContact CG1-CD1 4.07Å; V516-L520 HydrophobicContact CG1-CG 4.42Å; V516-L520 WeakPolarHBondContact O-CB 3.49Å; V516-L520 VanDerWaalsContact O-CG 3.3Å; V516-L520 WeakPolarHBondContact O-CG 3.4Å; V516-L520 PolarHBondContact O-N 3.01Å; V517-L520 PolarHBondContact O-N 3.42Å; K518-L520 VanDerWaalsContact C-N 3.34Å; K518-L520 PolarHBondContact O-N 3.44Å; L520-E522 VanDerWaalsContact C-N 3.27Å; L520-E522 PolarHBondContact O-N 2.9Å; L520-I523 PolarHBondContact O-N 2.7Å; L520-D524 WeakPolarHBondContact O-CB 3.29Å; L520-D524 PolarHBondContact O-N 3.4Å
521	S	82	Confident	78.5	Confident	59 Å²	59	96.7 Å²	96.7	41%	0.413	50%	0.497	S	S	.	.	H	α-helix	trans	-62.8	-37.1	174.6	61.4	0	0	0	0	112	V517 K518 D524 N525	V517-S521 PolarHBondContact O-N 2.8Å; V517-S521 PolarHBondContact O-OG 3.39Å; K518-S521 WeakPolarHBondContact CA-OG 3.43Å; K518-S521 PolarHBondContact O-N 2.99Å; K518-S521 PolarHBondContact O-OG 2.98Å; S521-D524 PolarHBondContact O-N 3.29Å; S521-N525 WeakPolarHBondContact O-CB 3.43Å; S521-N525 PolarHBondContact O-N 3.11Å; S521-N525 PolarHBondContact O-ND2 2.89Å
522	E	88.5	Confident	80.7	Confident	93 Å²	93	94.2 Å²	94.2	44%	0.435	49%	0.49	S	S	.	.	H	α-helix	trans	-69.2	-41.7	177.2	179.2	54.1	-155.4	0	0	111.9	K518 A519 L520 D524 N525 R526	K518-E522 WeakPolarHBondContact O-CB 3.27Å; K518-E522 PolarHBondContact O-N 3.01Å; A519-E522 PolarHBondContact O-N 3.36Å; L520-E522 VanDerWaalsContact C-N 3.27Å; L520-E522 PolarHBondContact O-N 2.9Å; E522-D524 VanDerWaalsContact C-N 3.31Å; E522-D524 PolarHBondContact O-N 3.26Å; E522-N525 PolarHBondContact O-N 3.38Å; E522-R526 WeakPolarHBondContact O-CB 3.5Å; E522-R526 VanDerWaalsContact O-CG 3.27Å; E522-R526 WeakPolarHBondContact O-CG 3.38Å; E522-R526 PolarHBondContact O-N 3.21Å; E522-R526 WeakPolarHBondContact OE1-CD 3.4Å; E522-R526 WeakPolarHBondContact OE1-CG 3.32Å; E522-R526 IonicContact OE1-NE 3.74Å
523	I	86.7	Confident	82.7	Confident	93 Å²	93	91.2 Å²	91.2	48%	0.477	48%	0.484	S	S	.	.	H	α-helix	trans	-61.1	-43.1	174.2	-70.7	165.3	0	0	0	110.7	A519 L520 R526 L527	A519-I523 VanDerWaalsContact O-CG1 3.26Å; A519-I523 WeakPolarHBondContact O-CG1 3.5Å; A519-I523 PolarHBondContact O-N 3Å; L520-I523 PolarHBondContact O-N 2.7Å; I523-R526 PolarHBondContact O-N 3.36Å; I523-L527 HydrophobicContact CG2-CD1 3.94Å; I523-L527 HydrophobicContact CG2-CG 4.38Å; I523-L527 WeakPolarHBondContact O-CB 3.4Å; I523-L527 WeakPolarHBondContact O-CG 3.46Å; I523-L527 PolarHBondContact O-N 3.38Å
524	D	89.1	Confident	84.1	Confident	103 Å²	103	90.6 Å²	90.6	55%	0.551	48%	0.48	S	S	*	.	H	α-helix	trans	-62.9	-43.4	177.9	-166.4	48.6	0	0	0	111.6	L520 S521 E522 R526 L527 N528	L520-D524 WeakPolarHBondContact O-CB 3.29Å; L520-D524 PolarHBondContact O-N 3.4Å; S521-D524 PolarHBondContact O-N 3.29Å; E522-D524 VanDerWaalsContact C-N 3.31Å; E522-D524 PolarHBondContact O-N 3.26Å; D524-R526 PolarHBondContact O-N 3.02Å; D524-L527 PolarHBondContact O-N 3.23Å; D524-N528 WeakPolarHBondContact O-CB 3.41Å; D524-N528 PolarHBondContact O-N 3.48Å
525	N	89.3	Confident	85.1	Confident	64 Å²	64	89.2 Å²	89.2	34%	0.342	48%	0.476	S	S	.	.	H	α-helix	trans	-59.5	-46	173.5	-70.9	-24.4	0	0	0	112	S521 E522 L527 N528 V529	S521-N525 WeakPolarHBondContact O-CB 3.43Å; S521-N525 PolarHBondContact O-N 3.11Å; S521-N525 PolarHBondContact O-ND2 2.89Å; E522-N525 PolarHBondContact O-N 3.38Å; N525-L527 PolarHBondContact O-N 3.29Å; N525-N528 WeakPolarHBondContact O-CB 3.45Å; N525-N528 PolarHBondContact O-N 3.46Å; N525-V529 WeakPolarHBondContact O-CG2 3.36Å; N525-V529 PolarHBondContact O-N 3.07Å
526	R	92.2	Very high	86.1	Confident	167 Å²	167	88.2 Å²	88.2	63%	0.63	47%	0.467	S	S	*	.	H	α-helix	trans	-64.4	-39.9	178.4	-70.3	177	111.9	-163	3.5	112.1	E522 I523 D524 N528 V529 I530	E522-R526 WeakPolarHBondContact O-CB 3.5Å; E522-R526 VanDerWaalsContact O-CG 3.27Å; E522-R526 WeakPolarHBondContact O-CG 3.38Å; E522-R526 PolarHBondContact O-N 3.21Å; E522-R526 WeakPolarHBondContact OE1-CD 3.4Å; E522-R526 WeakPolarHBondContact OE1-CG 3.32Å; E522-R526 IonicContact OE1-NE 3.74Å; I523-R526 PolarHBondContact O-N 3.36Å; D524-R526 PolarHBondContact O-N 3.02Å; R526-N528 VanDerWaalsContact C-N 3.32Å; R526-V529 PolarHBondContact O-N 3.25Å; R526-I530 VanDerWaalsContact O-CG1 3.29Å; R526-I530 WeakPolarHBondContact O-CG1 3.32Å; R526-I530 PolarHBondContact O-N 2.77Å
527	L	88.8	Confident	87	Confident	94 Å²	94	90.9 Å²	90.9	49%	0.492	48%	0.479	S	S	.	.	H	α-helix	trans	-64	-38.9	174.4	-74.6	171.6	0	0	0	111.5	I523 D524 N525 I530 D531	I523-L527 HydrophobicContact CG2-CD1 3.94Å; I523-L527 HydrophobicContact CG2-CG 4.38Å; I523-L527 WeakPolarHBondContact O-CB 3.4Å; I523-L527 WeakPolarHBondContact O-CG 3.46Å; I523-L527 PolarHBondContact O-N 3.38Å; D524-L527 PolarHBondContact O-N 3.23Å; N525-L527 PolarHBondContact O-N 3.29Å; L527-I530 PolarHBondContact O-N 2.92Å; L527-D531 PolarHBondContact O-N 3.49Å
528	N	90.2	Very high	88.1	Confident	66 Å²	66	92.9 Å²	92.9	35%	0.353	48%	0.483	S	S	.	.	H	α-helix	trans	-65	-39.1	175.5	-166.2	29.8	0	0	0	112.3	D524 N525 R526 D531 K532	D524-N528 WeakPolarHBondContact O-CB 3.41Å; D524-N528 PolarHBondContact O-N 3.48Å; N525-N528 WeakPolarHBondContact O-CB 3.45Å; N525-N528 PolarHBondContact O-N 3.46Å; R526-N528 VanDerWaalsContact C-N 3.32Å; N528-D531 PolarHBondContact O-N 3.31Å; N528-K532 WeakPolarHBondContact O-CG 3.41Å; N528-K532 PolarHBondContact O-N 3.01Å; N528-K532 VanDerWaalsContact O-N 3.07Å
529	V	87.4	Confident	88.6	Confident	90 Å²	90	92.2 Å²	92.2	55%	0.545	48%	0.482	S	S	.	.	H	α-helix	trans	-63.6	-41.9	173.5	173.5	0	0	0	0	111.2	N525 R526 D531 K532 V533	N525-V529 WeakPolarHBondContact O-CG2 3.36Å; N525-V529 PolarHBondContact O-N 3.07Å; R526-V529 PolarHBondContact O-N 3.25Å; V529-D531 VanDerWaalsContact C-N 3.34Å; V529-D531 PolarHBondContact O-N 3.01Å; V529-K532 PolarHBondContact O-N 3.33Å; V529-V533 HydrophobicContact CG1-CG2 4.42Å; V529-V533 WeakPolarHBondContact O-CG2 3.42Å; V529-V533 PolarHBondContact O-N 3.29Å
530	I	86.5	Confident	89.2	Confident	105 Å²	105	92.5 Å²	92.5	54%	0.538	48%	0.477	S	S	.	.	H	α-helix	trans	-62.2	-42.3	176.3	-68.7	164.8	0	0	0	111	R526 L527 K532 V533 S534	R526-I530 VanDerWaalsContact O-CG1 3.29Å; R526-I530 WeakPolarHBondContact O-CG1 3.32Å; R526-I530 PolarHBondContact O-N 2.77Å; L527-I530 PolarHBondContact O-N 2.92Å; I530-K532 VanDerWaalsContact C-N 3.33Å; I530-K532 PolarHBondContact O-N 3.46Å; I530-V533 PolarHBondContact O-N 2.91Å; I530-S534 WeakPolarHBondContact O-CB 3.26Å; I530-S534 PolarHBondContact O-N 3.16Å
531	D	88.3	Confident	89.7	Confident	50 Å²	50	91.5 Å²	91.5	27%	0.267	47%	0.469	S	S	.	.	H	α-helix	trans	-59.4	-43.7	175.4	-84.9	-9.8	0	0	0	110.7	L527 N528 V529 S534 V535 R643 R647	L527-D531 PolarHBondContact O-N 3.49Å; N528-D531 PolarHBondContact O-N 3.31Å; V529-D531 VanDerWaalsContact C-N 3.34Å; V529-D531 PolarHBondContact O-N 3.01Å; D531-S534 WeakPolarHBondContact O-CB 3.33Å; D531-S534 PolarHBondContact O-N 3.22Å; D531-V535 WeakPolarHBondContact O-CG2 3.5Å; D531-V535 PolarHBondContact O-N 3.29Å; D531-V535 VanDerWaalsContact O-N 3.11Å; D531-R643 IonicContact OD2-NH2 3.56Å; D531-R643 PolarHBondContact OD2-NH2 2.89Å; D531-R647 IonicContact OD2-NH2 3.06Å
532	K	90	Very high	90.3	Very high	139 Å²	139	94.9 Å²	94.9	60%	0.604	48%	0.476	S	S	*	.	H	α-helix	trans	-63.6	-46.2	176.4	-71.2	-177.9	179.8	-174.4	0	113	N528 V529 I530 S534 V535 Q536	N528-K532 WeakPolarHBondContact O-CG 3.41Å; N528-K532 PolarHBondContact O-N 3.01Å; N528-K532 VanDerWaalsContact O-N 3.07Å; V529-K532 PolarHBondContact O-N 3.33Å; I530-K532 VanDerWaalsContact C-N 3.33Å; I530-K532 PolarHBondContact O-N 3.46Å; K532-S534 VanDerWaalsContact C-N 3.27Å; K532-S534 PolarHBondContact O-N 3.36Å; K532-V535 PolarHBondContact O-N 2.92Å; K532-Q536 PolarHBondContact O-N 3.04Å
533	V	89.9	Confident	90.5	Very high	86 Å²	86	96.9 Å²	96.9	52%	0.521	48%	0.48	S	S	.	.	H	α-helix	trans	-62.5	-37.6	176.8	172.9	0	0	0	0	110.7	V529 I530 V535 Q536 L537	V529-V533 HydrophobicContact CG1-CG2 4.42Å; V529-V533 WeakPolarHBondContact O-CG2 3.42Å; V529-V533 PolarHBondContact O-N 3.29Å; I530-V533 PolarHBondContact O-N 2.91Å; V533-V535 PolarHBondContact O-N 2.99Å; V533-Q536 PolarHBondContact O-N 3.01Å; V533-L537 WeakPolarHBondContact O-CB 3.37Å; V533-L537 PolarHBondContact O-N 2.69Å
534	S	88.8	Confident	90.8	Very high	56 Å²	56	97.1 Å²	97.1	39%	0.392	48%	0.482	S	S	.	.	H	α-helix	trans	-63.1	-40.9	176.4	-173.6	0	0	0	0	112.4	I530 D531 K532 E538	I530-S534 WeakPolarHBondContact O-CB 3.26Å; I530-S534 PolarHBondContact O-N 3.16Å; D531-S534 WeakPolarHBondContact O-CB 3.33Å; D531-S534 PolarHBondContact O-N 3.22Å; K532-S534 VanDerWaalsContact C-N 3.27Å; K532-S534 PolarHBondContact O-N 3.36Å; S534-E538 PolarHBondContact O-N 2.95Å; S534-E538 VanDerWaalsContact O-N 3.13Å
535	V	91.4	Very high	91	Very high	81 Å²	81	96 Å²	96	49%	0.491	47%	0.473	S	S	.	.	H	α-helix	trans	-66.5	-43.9	176.8	172.3	0	0	0	0	110.8	D531 K532 V533 L537 E538 Q539	D531-V535 WeakPolarHBondContact O-CG2 3.5Å; D531-V535 PolarHBondContact O-N 3.29Å; D531-V535 VanDerWaalsContact O-N 3.11Å; K532-V535 PolarHBondContact O-N 2.92Å; V533-V535 PolarHBondContact O-N 2.99Å; V535-L537 PolarHBondContact O-N 2.67Å; V535-E538 PolarHBondContact O-N 2.71Å; V535-Q539 PolarHBondContact O-N 2.76Å
536	Q	91.9	Very high	91.2	Very high	90 Å²	90	97.7 Å²	97.7	42%	0.421	48%	0.479	S	S	.	.	H	α-helix	trans	-60.8	-45.1	177.4	-175.7	58.7	49	0	0	111.6	K532 V533 E538 Q539 D540	K532-Q536 PolarHBondContact O-N 3.04Å; V533-Q536 PolarHBondContact O-N 3.01Å; Q536-E538 VanDerWaalsContact C-N 3.3Å; Q536-E538 PolarHBondContact O-N 2.76Å; Q536-Q539 WeakPolarHBondContact O-CB 3.47Å; Q536-Q539 PolarHBondContact O-N 2.88Å; Q536-D540 PolarHBondContact NE2-OD1 2.79Å; Q536-D540 PolarHBondContact NE2-OD2 2.78Å; Q536-D540 PolarHBondContact O-N 2.9Å
537	L	91.6	Very high	91.1	Very high	122 Å²	122	94.3 Å²	94.3	64%	0.639	47%	0.473	S	S	*	.	H	α-helix	trans	-64.6	-34.9	179.7	-159.8	112.2	0	0	0	112.3	V533 V535 H541	V533-L537 WeakPolarHBondContact O-CB 3.37Å; V533-L537 PolarHBondContact O-N 2.69Å; V535-L537 PolarHBondContact O-N 2.67Å; L537-H541 WeakPolarHBondContact O-CB 3.47Å; L537-H541 PolarHBondContact O-N 2.89Å
538	E	93.1	Very high	91.3	Very high	114 Å²	114	94.7 Å²	94.7	53%	0.533	48%	0.475	S	S	.	.	H	α-helix	trans	-67.7	-39.6	174.4	-173.9	167.4	-163.1	0	0	111.7	S534 V535 Q536 H541 K542	S534-E538 PolarHBondContact O-N 2.95Å; S534-E538 VanDerWaalsContact O-N 3.13Å; V535-E538 PolarHBondContact O-N 2.71Å; Q536-E538 VanDerWaalsContact C-N 3.3Å; Q536-E538 PolarHBondContact O-N 2.76Å; E538-H541 PolarHBondContact O-N 3.42Å; E538-K542 PolarHBondContact O-N 2.97Å
539	Q	93.5	Very high	91.2	Very high	109 Å²	109	97.3 Å²	97.3	51%	0.509	49%	0.485	S	S	.	.	H	α-helix	trans	-66	-42.8	175.1	-171.2	173.7	2.2	0	0	112.2	V535 Q536 K542 R543	V535-Q539 PolarHBondContact O-N 2.76Å; Q536-Q539 WeakPolarHBondContact O-CB 3.47Å; Q536-Q539 PolarHBondContact O-N 2.88Å; Q539-K542 PolarHBondContact O-N 2.95Å; Q539-R543 PolarHBondContact O-N 2.67Å
540	D	91.3	Very high	91.3	Very high	57 Å²	57	96.5 Å²	96.5	31%	0.305	48%	0.48	S	S	.	.	H	α-helix	trans	-67.8	-38	176.9	-69.5	-26.4	0	0	0	111.6	Q536 K542 R543 N544	Q536-D540 PolarHBondContact NE2-OD1 2.79Å; Q536-D540 PolarHBondContact NE2-OD2 2.78Å; Q536-D540 PolarHBondContact O-N 2.9Å; D540-K542 VanDerWaalsContact C-N 3.34Å; D540-K542 PolarHBondContact O-N 3.46Å; D540-R543 PolarHBondContact O-N 2.69Å; D540-R543 IonicContact OD1-NH1 3.04Å; D540-N544 WeakPolarHBondContact O-CB 3.46Å; D540-N544 PolarHBondContact O-N 3.06Å; D540-N544 PolarHBondContact O-ND2 2.87Å
541	H	92.9	Very high	91.4	Very high	84 Å²	84	95.9 Å²	95.9	39%	0.389	48%	0.477	S	S	.	.	H	α-helix	trans	-59.1	-46.1	171.6	-175.3	70.5	0	0	0	111.2	L537 E538 N544 Q545 R657	L537-H541 WeakPolarHBondContact O-CB 3.47Å; L537-H541 PolarHBondContact O-N 2.89Å; E538-H541 PolarHBondContact O-N 3.42Å; H541-N544 PolarHBondContact O-N 2.71Å; H541-Q545 WeakPolarHBondContact O-CG 3.47Å; H541-Q545 PolarHBondContact O-N 2.8Å; H541-R657 PolarHBondContact NE2-NH2 3.02Å
542	K	94.7	Very high	91.4	Very high	129 Å²	129	97.2 Å²	97.2	56%	0.561	48%	0.484	S	S	*	.	H	α-helix	trans	-60.6	-47	177	-172.1	-177.6	176	-171.7	0	112	E538 Q539 D540 N544 Q545 E546	E538-K542 PolarHBondContact O-N 2.97Å; Q539-K542 PolarHBondContact O-N 2.95Å; D540-K542 VanDerWaalsContact C-N 3.34Å; D540-K542 PolarHBondContact O-N 3.46Å; K542-N544 VanDerWaalsContact C-N 3.31Å; K542-N544 PolarHBondContact O-N 2.84Å; K542-Q545 PolarHBondContact O-N 2.88Å; K542-Q545 VanDerWaalsContact O-N 3.17Å; K542-E546 VanDerWaalsContact CE-OE1 3.29Å; K542-E546 WeakPolarHBondContact CE-OE1 3.45Å; K542-E546 WeakPolarHBondContact O-CG 3.4Å; K542-E546 PolarHBondContact O-N 3.06Å
543	R	93.4	Very high	91.3	Very high	136 Å²	136	95.9 Å²	95.9	51%	0.513	48%	0.48	S	S	.	.	H	α-helix	trans	-57.9	-43.5	175.1	176.2	-176.1	-91.2	132.3	-9.9	111.5	Q539 D540 Q545 E546 L547	Q539-R543 PolarHBondContact O-N 2.67Å; D540-R543 PolarHBondContact O-N 2.69Å; D540-R543 IonicContact OD1-NH1 3.04Å; R543-Q545 VanDerWaalsContact C-N 3.31Å; R543-Q545 PolarHBondContact O-N 2.82Å; R543-E546 PolarHBondContact O-N 2.75Å; R543-L547 HydrophobicContact CG-CD1 4.15Å; R543-L547 WeakPolarHBondContact O-CG 3.17Å; R543-L547 PolarHBondContact O-N 3.47Å
544	N	93.1	Very high	90.9	Very high	98 Å²	98	96.6 Å²	96.6	52%	0.524	48%	0.48	S	S	.	.	H	α-helix	trans	-65.4	-34.7	178.9	-72	-18.3	0	0	0	112.1	D540 H541 K542 L548	D540-N544 WeakPolarHBondContact O-CB 3.46Å; D540-N544 PolarHBondContact O-N 3.06Å; D540-N544 PolarHBondContact O-ND2 2.87Å; H541-N544 PolarHBondContact O-N 2.71Å; K542-N544 VanDerWaalsContact C-N 3.31Å; K542-N544 PolarHBondContact O-N 2.84Å; N544-L548 WeakPolarHBondContact O-CB 3.1Å; N544-L548 PolarHBondContact O-N 3.14Å
545	Q	92.8	Very high	90.5	Very high	79 Å²	79	97.9 Å²	97.9	37%	0.369	48%	0.483	S	S	.	.	H	α-helix	trans	-66.5	-43.4	173.2	-67.1	-158.9	-59	0	0	112.1	H541 K542 R543 L547 L548 E549 R657	H541-Q545 WeakPolarHBondContact O-CG 3.47Å; H541-Q545 PolarHBondContact O-N 2.8Å; K542-Q545 PolarHBondContact O-N 2.88Å; K542-Q545 VanDerWaalsContact O-N 3.17Å; R543-Q545 VanDerWaalsContact C-N 3.31Å; R543-Q545 PolarHBondContact O-N 2.82Å; Q545-L547 PolarHBondContact O-N 2.88Å; Q545-L548 PolarHBondContact O-N 3.18Å; Q545-E549 PolarHBondContact O-N 2.93Å; Q545-R657 VanDerWaalsContact CD-NH2 3.3Å
546	E	92.7	Very high	90	Very high	100 Å²	100	101 Å²	101	47%	0.467	49%	0.489	S	S	.	.	H	α-helix	trans	-63	-41	176.2	-69.4	171.4	-173.3	0	0	112	K542 R543 E549 T550	K542-E546 VanDerWaalsContact CE-OE1 3.29Å; K542-E546 WeakPolarHBondContact CE-OE1 3.45Å; K542-E546 WeakPolarHBondContact O-CG 3.4Å; K542-E546 PolarHBondContact O-N 3.06Å; R543-E546 PolarHBondContact O-N 2.75Å; E546-E549 PolarHBondContact O-N 2.9Å; E546-T550 WeakPolarHBondContact O-CB 3.39Å; E546-T550 PolarHBondContact O-N 3.3Å; E546-T550 PolarHBondContact O-OG1 3.19Å
547	L	91.8	Very high	89.1	Confident	95 Å²	95	102.8 Å²	102.8	50%	0.497	50%	0.496	S	S	.	.	H	α-helix	trans	-63.1	-43.2	174	-74.3	172.1	0	0	0	111.6	R543 Q545 T550 I551	R543-L547 HydrophobicContact CG-CD1 4.15Å; R543-L547 WeakPolarHBondContact O-CG 3.17Å; R543-L547 PolarHBondContact O-N 3.47Å; Q545-L547 PolarHBondContact O-N 2.88Å; L547-T550 WeakPolarHBondContact O-CB 3.31Å; L547-T550 PolarHBondContact O-N 2.95Å; L547-I551 VanDerWaalsContact O-CG1 3.32Å; L547-I551 WeakPolarHBondContact O-CG1 3.32Å; L547-I551 PolarHBondContact O-N 2.9Å
548	L	91	Very high	87.7	Confident	102 Å²	102	102.6 Å²	102.6	53%	0.534	49%	0.492	S	S	.	.	H	α-helix	trans	-63	-44	177.9	-176.3	62.1	0	0	0	111.7	N544 Q545 T550 I551 I552	N544-L548 WeakPolarHBondContact O-CB 3.1Å; N544-L548 PolarHBondContact O-N 3.14Å; Q545-L548 PolarHBondContact O-N 3.18Å; L548-T550 VanDerWaalsContact C-N 3.29Å; L548-T550 PolarHBondContact O-N 3.24Å; L548-I551 PolarHBondContact O-N 3.14Å; L548-I552 HydrophobicContact CG-CD1 4.16Å; L548-I552 VanDerWaalsContact O-CG1 3.29Å; L548-I552 WeakPolarHBondContact O-CG1 3.33Å; L548-I552 PolarHBondContact O-N 3.31Å
549	E	90	Very high	85.9	Confident	121 Å²	121	100.5 Å²	100.5	57%	0.565	49%	0.489	S	S	*	.	H	α-helix	trans	-60.6	-40	174.3	-75.6	-175.4	-177.6	0	0	111.9	Q545 E546 I552 Q553	Q545-E549 PolarHBondContact O-N 2.93Å; E546-E549 PolarHBondContact O-N 2.9Å; E549-I552 PolarHBondContact O-N 2.91Å; E549-Q553 WeakPolarHBondContact O-CG 3.2Å; E549-Q553 PolarHBondContact O-N 3.4Å
550	T	89.3	Confident	84.1	Confident	73 Å²	73	102.4 Å²	102.4	45%	0.448	50%	0.498	S	S	.	.	H	α-helix	trans	-63.9	-43.6	176.8	-55.9	0	0	0	0	111.6	E546 L547 L548 I552 Q553 L554	E546-T550 WeakPolarHBondContact O-CB 3.39Å; E546-T550 PolarHBondContact O-N 3.3Å; E546-T550 PolarHBondContact O-OG1 3.19Å; L547-T550 WeakPolarHBondContact O-CB 3.31Å; L547-T550 PolarHBondContact O-N 2.95Å; L548-T550 VanDerWaalsContact C-N 3.29Å; L548-T550 PolarHBondContact O-N 3.24Å; T550-I552 VanDerWaalsContact C-N 3.35Å; T550-I552 PolarHBondContact O-N 3.2Å; T550-Q553 PolarHBondContact O-N 3.06Å; T550-L554 HydrophobicContact CG2-CD1 4.3Å; T550-L554 WeakPolarHBondContact O-CG 3.41Å; T550-L554 PolarHBondContact O-N 3.06Å
551	I	88	Confident	82.3	Confident	92 Å²	92	104 Å²	104	47%	0.472	51%	0.51	S	S	.	.	H	α-helix	trans	-62.1	-43.1	175.9	-68.1	164.8	0	0	0	110.7	L547 L548 Q553 L554 N555	L547-I551 VanDerWaalsContact O-CG1 3.32Å; L547-I551 WeakPolarHBondContact O-CG1 3.32Å; L547-I551 PolarHBondContact O-N 2.9Å; L548-I551 PolarHBondContact O-N 3.14Å; I551-Q553 VanDerWaalsContact C-N 3.32Å; I551-Q553 PolarHBondContact O-N 3.11Å; I551-L554 PolarHBondContact O-N 2.96Å; I551-N555 WeakPolarHBondContact O-CB 3.46Å; I551-N555 PolarHBondContact O-N 3.12Å
552	I	88.1	Confident	80	Confident	79 Å²	79	105.5 Å²	105.5	41%	0.405	52%	0.521	S	S	.	.	H	α-helix	trans	-61.9	-41.3	176.5	-67.5	165.3	0	0	0	110.9	L548 E549 T550 N555 K556	L548-I552 HydrophobicContact CG-CD1 4.16Å; L548-I552 VanDerWaalsContact O-CG1 3.29Å; L548-I552 WeakPolarHBondContact O-CG1 3.33Å; L548-I552 PolarHBondContact O-N 3.31Å; E549-I552 PolarHBondContact O-N 2.91Å; T550-I552 VanDerWaalsContact C-N 3.35Å; T550-I552 PolarHBondContact O-N 3.2Å; I552-N555 PolarHBondContact O-N 3.48Å; I552-K556 WeakPolarHBondContact O-CG 3.31Å; I552-K556 PolarHBondContact O-N 3.28Å
553	Q	87.5	Confident	77.7	Confident	111 Å²	111	106 Å²	106	52%	0.519	53%	0.529	S	S	.	.	H	α-helix	trans	-66.9	-40.6	176.8	-73	-174.5	34	0	0	112.7	E549 T550 I551 K556 K557	E549-Q553 WeakPolarHBondContact O-CG 3.2Å; E549-Q553 PolarHBondContact O-N 3.4Å; T550-Q553 PolarHBondContact O-N 3.06Å; I551-Q553 VanDerWaalsContact C-N 3.32Å; I551-Q553 PolarHBondContact O-N 3.11Å; Q553-K556 PolarHBondContact O-N 3.11Å; Q553-K557 WeakPolarHBondContact O-CG 3.45Å; Q553-K557 PolarHBondContact O-N 2.93Å
554	L	82.8	Confident	75.3	Confident	100 Å²	100	104 Å²	104	52%	0.524	54%	0.535	S	S	.	.	H	α-helix	trans	-62.7	-45.8	175.2	-73.6	171.5	0	0	0	110.9	T550 I551 K556 K557 E558	T550-L554 HydrophobicContact CG2-CD1 4.3Å; T550-L554 WeakPolarHBondContact O-CG 3.41Å; T550-L554 PolarHBondContact O-N 3.06Å; I551-L554 PolarHBondContact O-N 2.96Å; L554-K556 VanDerWaalsContact C-N 3.3Å; L554-K556 PolarHBondContact O-N 2.98Å; L554-K557 PolarHBondContact O-N 2.98Å; L554-K557 VanDerWaalsContact O-N 3.11Å; L554-E558 WeakPolarHBondContact O-CB 3.37Å; L554-E558 PolarHBondContact O-N 3.42Å
555	N	80.1	Confident	72.6	Confident	84 Å²	84	104.3 Å²	104.3	45%	0.449	55%	0.545	S	S	.	.	H	α-helix	trans	-62.4	-35.8	176.7	-72.4	-16.3	0	0	0	112.4	I551 I552 S559	I551-N555 WeakPolarHBondContact O-CB 3.46Å; I551-N555 PolarHBondContact O-N 3.12Å; I552-N555 PolarHBondContact O-N 3.48Å; N555-S559 VanDerWaalsContact O-CB 3.27Å; N555-S559 WeakPolarHBondContact O-CB 3.31Å; N555-S559 PolarHBondContact O-N 3.44Å; N555-S559 PolarHBondContact O-OG 3.34Å
556	K	81.1	Confident	69.5	Low	146 Å²	146	108.6 Å²	108.6	64%	0.635	56%	0.564	S	S	*	*	H	α-helix	trans	-65.8	-41.9	173	-78.2	-179.3	179.7	180	0	112.3	I552 Q553 L554 Q560	I552-K556 WeakPolarHBondContact O-CG 3.31Å; I552-K556 PolarHBondContact O-N 3.28Å; Q553-K556 PolarHBondContact O-N 3.11Å; L554-K556 VanDerWaalsContact C-N 3.3Å; L554-K556 PolarHBondContact O-N 2.98Å; K556-Q560 PolarHBondContact O-N 3.23Å
557	K	71.7	Confident	66.7	Low	128 Å²	128	111.6 Å²	111.6	56%	0.557	58%	0.583	S	S	*	*	H	α-helix	trans	-65.4	-45	176.3	-73.3	176.9	-178.4	176.3	0	111.2	Q553 L554 S559 Q560 V561	Q553-K557 WeakPolarHBondContact O-CG 3.45Å; Q553-K557 PolarHBondContact O-N 2.93Å; L554-K557 PolarHBondContact O-N 2.98Å; L554-K557 VanDerWaalsContact O-N 3.11Å; K557-S559 VanDerWaalsContact C-N 3.34Å; K557-S559 PolarHBondContact O-N 2.96Å; K557-Q560 PolarHBondContact O-N 3.19Å; K557-V561 VanDerWaalsContact O-CG2 3.3Å; K557-V561 WeakPolarHBondContact O-CG2 3.3Å; K557-V561 PolarHBondContact O-N 3.41Å
558	E	63.3	Low	63.5	Low	118 Å²	118	115.3 Å²	115.3	55%	0.551	60%	0.603	S	S	*	*	H	α-helix	trans	-65.8	-37.8	178.6	-163.1	171	-161.2	0	0	111.7	L554 Q560 V561 N562	L554-E558 WeakPolarHBondContact O-CB 3.37Å; L554-E558 PolarHBondContact O-N 3.42Å; E558-Q560 PolarHBondContact O-N 3.34Å; E558-V561 PolarHBondContact O-N 2.97Å; E558-N562 WeakPolarHBondContact O-CB 3.38Å; E558-N562 PolarHBondContact O-N 3.46Å; E558-N562 PolarHBondContact O-ND2 3.25Å
559	S	54.9	Low	60.6	Low	69 Å²	69	118.2 Å²	118.2	48%	0.483	61%	0.614	S	S	.	*	H	α-helix	trans	-63.7	-39.4	172.9	-59.3	0	0	0	0	112.3	N555 K557 L563	N555-S559 VanDerWaalsContact O-CB 3.27Å; N555-S559 WeakPolarHBondContact O-CB 3.31Å; N555-S559 PolarHBondContact O-N 3.44Å; N555-S559 PolarHBondContact O-OG 3.34Å; K557-S559 VanDerWaalsContact C-N 3.34Å; K557-S559 PolarHBondContact O-N 2.96Å; S559-L563 WeakPolarHBondContact O-CB 3.42Å; S559-L563 WeakPolarHBondContact O-CD1 3.42Å; S559-L563 WeakPolarHBondContact O-CG 3.46Å; S559-L563 PolarHBondContact O-N 3.42Å; S559-L563 VanDerWaalsContact O-N 3.11Å
560	Q	55.3	Low	57.6	Low	150 Å²	150	118.1 Å²	118.1	70%	0.701	62%	0.624	S	S	*	*	H	α-helix	trans	-68.9	-37.7	174.5	-93.2	-174.5	-7.5	0	0	112.9	K556 K557 E558 N562 L563 S564	K556-Q560 PolarHBondContact O-N 3.23Å; K557-Q560 PolarHBondContact O-N 3.19Å; E558-Q560 PolarHBondContact O-N 3.34Å; Q560-N562 VanDerWaalsContact C-N 3.33Å; Q560-L563 PolarHBondContact O-N 2.84Å; Q560-S564 PolarHBondContact O-N 2.95Å; Q560-S564 VanDerWaalsContact O-N 3.16Å; Q560-S564 PolarHBondContact O-OG 2.77Å
561	V	52.9	Low	54.7	Low	91 Å²	91	121.8 Å²	121.8	55%	0.552	64%	0.641	S	S	*	*	H	α-helix	trans	-66.4	-37.3	176.5	173.9	0	0	0	0	110.9	K557 E558 S564	K557-V561 VanDerWaalsContact O-CG2 3.3Å; K557-V561 WeakPolarHBondContact O-CG2 3.3Å; K557-V561 PolarHBondContact O-N 3.41Å; E558-V561 PolarHBondContact O-N 2.97Å; V561-S564 PolarHBondContact O-OG 2.91Å
562	N	45.7	Very low	51.7	Low	114 Å²	114	127.2 Å²	127.2	61%	0.61	66%	0.661	S	S	*	*	H	α-helix	trans	-74.3	-26.1	177.3	-72.3	-30.7	0	0	0	113.3	E558 Q560	E558-N562 WeakPolarHBondContact O-CB 3.38Å; E558-N562 PolarHBondContact O-N 3.46Å; E558-N562 PolarHBondContact O-ND2 3.25Å; Q560-N562 VanDerWaalsContact C-N 3.33Å
563	L	46.7	Very low	48.7	Very low	141 Å²	141	128.8 Å²	128.8	74%	0.738	68%	0.679	S	S	*	*	H	α-helix	trans	-81.6	-23.6	177	-82.4	158.2	0	0	0	113.7	S559 Q560 C565	S559-L563 WeakPolarHBondContact O-CB 3.42Å; S559-L563 WeakPolarHBondContact O-CD1 3.42Å; S559-L563 WeakPolarHBondContact O-CG 3.46Å; S559-L563 PolarHBondContact O-N 3.42Å; S559-L563 VanDerWaalsContact O-N 3.11Å; Q560-L563 PolarHBondContact O-N 2.84Å; L563-C565 VanDerWaalsContact C-N 3.32Å; L563-C565 PolarHBondContact O-N 3.16Å
564	S	42.9	Very low	45.6	Very low	92 Å²	92	132.5 Å²	132.5	64%	0.643	70%	0.696	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.3	-8.6	-179	62.5	0	0	0	0	114.5	Q560 V561	Q560-S564 PolarHBondContact O-N 2.95Å; Q560-S564 VanDerWaalsContact O-N 3.16Å; Q560-S564 PolarHBondContact O-OG 2.77Å; V561-S564 PolarHBondContact O-OG 2.91Å
565	C	35.3	Very low	42.9	Very low	106 Å²	106	132.1 Å²	132.1	72%	0.716	71%	0.707	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99	5.2	-178.4	-66.9	0	0	0	0	115.4	L563	L563-C565 VanDerWaalsContact C-N 3.32Å; L563-C565 PolarHBondContact O-N 3.16Å
566	Q	29	Very low	40.2	Very low	168 Å²	168	133.3 Å²	133.3	79%	0.785	72%	0.718	S	S	*	*	S	Bend	trans	-136.4	67.4	178.4	-74.3	-170.9	4.1	0	0	112.5
567	L	32.3	Very low	37.5	Very low	163 Å²	163	137.1 Å²	137.1	85%	0.853	73%	0.73	S	S	*	*			trans	-157.9	53.3	158.8	-125.4	125.8	0	0	0	112.3
568	D	26.5	Very low	35.1	Very low	174 Å²	174	139 Å²	139	93%	0.93	74%	0.74	S	S	*	*			trans	-100.6	79.8	163.1	-85.5	-30.4	0	0	0	109.1
569	E	28.2	Very low	33.2	Very low	163 Å²	163	142.4 Å²	142.4	76%	0.762	76%	0.757	S	S	*	*			trans	-145.1	121.4	153.8	-140.4	175.7	-159.7	0	0	110.7	N571	E569-N571 PolarHBondContact O-N 3.36Å
570	P	29	Very low	31.7	Very low	119 Å²	119	147.2 Å²	147.2	77%	0.773	77%	0.771	S	S	*	*			trans	-89.4	91.3	-167.8	34.4	-32.8	0	0	0	111	K572	P570-K572 PolarHBondContact O-N 3.47Å
571	N	27.4	Very low	30.2	Very low	149 Å²	149	148.4 Å²	148.4	80%	0.797	77%	0.774	S	S	*	*			trans	-91.3	103.2	166	-78.9	-40.9	0	0	0	110.7	E569 S573	E569-N571 PolarHBondContact O-N 3.36Å; N571-S573 PolarHBondContact O-N 2.91Å
572	K	23.9	Very low	28.7	Very low	207 Å²	207	150.2 Å²	150.2	90%	0.9	78%	0.78	S	S	*	*			trans	-54.7	118.9	160	-70.5	173.3	174.6	177	0	109.9	P570	P570-K572 PolarHBondContact O-N 3.47Å
573	S	26.8	Very low	27.8	Very low	112 Å²	112	152.5 Å²	152.5	78%	0.783	79%	0.787	S	S	*	*			trans	-169.4	119.1	139.8	50.8	0	0	0	0	109.8	N571	N571-S573 PolarHBondContact O-N 2.91Å
574	E	21.6	Very low	26.7	Very low	189 Å²	189	152.4 Å²	152.4	88%	0.883	79%	0.787	S	S	*	*			trans	-54.2	129.4	172.4	-64	156.1	140	0	0	111.3
575	A	26.4	Very low	25.9	Very low	91 Å²	91	153.4 Å²	153.4	75%	0.752	79%	0.791	S	S	*	*			trans	-143.6	82.5	153	0	0	0	0	0	107.9	Y577	A575-Y577 PolarHBondContact O-N 2.98Å
576	T	23.3	Very low	25.6	Very low	110 Å²	110	156.2 Å²	156.2	68%	0.675	80%	0.799	S	S	*	*			trans	-46.1	98.7	163.9	-55.3	0	0	0	0	110.8	Q578	T576-Q578 HydrophobicContact CG2-CG 3.84Å
577	Y	24.1	Very low	25.3	Very low	225 Å²	225	157 Å²	157	88%	0.882	80%	0.802	S	S	*	*			trans	-114.3	91.4	153.6	-96.4	-85.4	0	0	0	108.1	A575 Q579	A575-Y577 PolarHBondContact O-N 2.98Å; Y577-Q579 PolarHBondContact O-N 3.43Å
578	Q	22.3	Very low	25.1	Very low	167 Å²	167	156.6 Å²	156.6	78%	0.78	80%	0.801	S	S	*	*			trans	-62	111.3	168.4	-65.6	-170.6	-2.8	0	0	109.7	T576	T576-Q578 HydrophobicContact CG2-CG 3.84Å
579	Q	22.3	Very low	25	Very low	191 Å²	191	155.6 Å²	155.6	89%	0.893	80%	0.795	S	S	*	*			trans	-143	60.3	145.9	-69.9	-165.1	-12.5	0	0	108.5	Y577 K581	Y577-Q579 PolarHBondContact O-N 3.43Å; Q579-K581 VanDerWaalsContact C-N 3.34Å; Q579-K581 PolarHBondContact O-N 3.35Å; Q579-K581 VanDerWaalsContact O-N 3.12Å
580	Q	23.6	Very low	24.8	Very low	169 Å²	169	157.6 Å²	157.6	79%	0.79	80%	0.802	S	S	*	*			trans	-75.2	90.6	163	-80.8	-179.9	-13.7	0	0	108.2	L582	Q580-L582 HydrophobicContact CB-CD1 4.14Å; Q580-L582 HydrophobicContact CB-CG 4.31Å; Q580-L582 PolarHBondContact O-N 2.73Å; Q580-L582 VanDerWaalsContact O-N 3.09Å
581	K	23.9	Very low	24.6	Very low	176 Å²	176	160.1 Å²	160.1	77%	0.765	80%	0.801	S	S	*	*			trans	-79.4	76.5	157	-164.3	174.5	-178.4	-175.7	0	107.1	Q579 Q583	Q579-K581 VanDerWaalsContact C-N 3.34Å; Q579-K581 PolarHBondContact O-N 3.35Å; Q579-K581 VanDerWaalsContact O-N 3.12Å; K581-Q583 PolarHBondContact O-N 3.48Å; K581-Q583 VanDerWaalsContact O-N 3.15Å
582	L	22.3	Very low	24.3	Very low	128 Å²	128	156.6 Å²	156.6	67%	0.67	80%	0.799	S	S	*	*			trans	-68.7	96.6	165.9	-82.7	153.7	0	0	0	107.3	Q580	Q580-L582 HydrophobicContact CB-CD1 4.14Å; Q580-L582 HydrophobicContact CB-CG 4.31Å; Q580-L582 PolarHBondContact O-N 2.73Å; Q580-L582 VanDerWaalsContact O-N 3.09Å
583	Q	25	Very low	24.2	Very low	162 Å²	162	153.3 Å²	153.3	76%	0.757	79%	0.791	S	S	*	*			trans	-97.5	106.3	158.2	-98.1	171.7	-34.4	0	0	106.8	K581	K581-Q583 PolarHBondContact O-N 3.48Å; K581-Q583 VanDerWaalsContact O-N 3.15Å
584	L	23.9	Very low	24	Very low	140 Å²	140	156.7 Å²	156.7	73%	0.733	80%	0.795	S	S	*	*			trans	-60.6	149.4	175.1	-128.8	74.9	0	0	0	110	D586	L584-D586 PolarHBondContact O-N 2.91Å
585	P	27	Very low	24.2	Very low	113 Å²	113	153 Å²	153	73%	0.734	79%	0.785	S	S	*	*			trans	-75.6	119.3	172	-2	20.1	0	0	0	109.4	E587	P585-E587 PolarHBondContact O-N 2.79Å
586	D	29.4	Very low	23.9	Very low	165 Å²	165	157.6 Å²	157.6	88%	0.882	79%	0.791	S	S	*	*			trans	-73.3	90	168.2	-69.7	-35.7	0	0	0	108.8	L584	L584-D586 PolarHBondContact O-N 2.91Å
587	E	21.9	Very low	24	Very low	183 Å²	183	159.2 Å²	159.2	86%	0.855	80%	0.795	S	S	*	*			trans	-77.5	112.3	153.3	-82.4	-177.4	161.4	0	0	107.6	P585	P585-E587 PolarHBondContact O-N 2.79Å
588	L	28.1	Very low	24	Very low	156 Å²	156	157 Å²	157	82%	0.817	79%	0.793	S	S	*	*			trans	-157	103	155.8	-105.9	156.9	0	0	0	109.4	F590	L588-F590 PolarHBondContact O-N 2.9Å
589	D	23.9	Very low	24.1	Very low	153 Å²	153	157.8 Å²	157.8	82%	0.818	79%	0.794	S	S	*	*			trans	-45.6	117.3	167.6	-70.3	-55.7	0	0	0	112.3
590	F	24.7	Very low	24.3	Very low	205 Å²	205	155.8 Å²	155.8	90%	0.899	79%	0.789	S	S	*	*			trans	-106.9	87.2	155.3	-96.1	-84.6	0	0	0	109.5	L588 G592	L588-F590 PolarHBondContact O-N 2.9Å; F590-G592 VanDerWaalsContact C-N 3.31Å; F590-G592 PolarHBondContact O-N 3.25Å
591	K	24.3	Very low	24.5	Very low	172 Å²	172	153.7 Å²	153.7	75%	0.748	78%	0.782	S	S	*	*			trans	-65.6	89.4	157.7	-84.1	-77.2	-173.1	174.9	0	108.9	D593	K591-D593 PolarHBondContact O-N 2.93Å
592	G	22.5	Very low	24.6	Very low	74 Å²	74	152.4 Å²	152.4	76%	0.763	78%	0.783	S	S	*	*			trans	-91.7	72	165.7	0	0	0	0	0	110.9	F590 Q594	F590-G592 VanDerWaalsContact C-N 3.31Å; F590-G592 PolarHBondContact O-N 3.25Å; G592-Q594 PolarHBondContact O-N 3.48Å
593	D	20.8	Very low	24.7	Very low	138 Å²	138	150.6 Å²	150.6	74%	0.738	78%	0.781	S	S	*	*			trans	-82	99.1	164.9	-83.1	-34.3	0	0	0	108.2	K591	K591-D593 PolarHBondContact O-N 2.93Å
594	Q	23	Very low	24.9	Very low	184 Å²	184	152.3 Å²	152.3	86%	0.86	79%	0.786	S	S	*	*			trans	-158	133.3	161.8	-131.6	178.3	24.6	0	0	114.8	G592	G592-Q594 PolarHBondContact O-N 3.48Å
595	V	25.2	Very low	25	Very low	111 Å²	111	153.3 Å²	153.3	67%	0.673	79%	0.79	S	S	*	*			trans	88.4	85.8	158.4	-160.2	0	0	0	0	117.1
596	Q	21.6	Very low	24.9	Very low	187 Å²	187	155 Å²	155	87%	0.874	79%	0.794	S	S	*	*			trans	-54.7	134.3	142.7	-64	176.3	-5.9	0	0	109.6
597	N	24	Very low	24.8	Very low	144 Å²	144	154 Å²	154	77%	0.77	79%	0.787	S	S	*	*			trans	-156.3	138.5	146.6	-93.7	-28.6	0	0	0	111.7
598	E	25.1	Very low	25	Very low	179 Å²	179	150.8 Å²	150.8	84%	0.836	78%	0.776	S	S	*	*			trans	74.2	82.2	158.1	-69.8	179.5	147.4	0	0	119.6	L600	E598-L600 PolarHBondContact O-N 3.22Å
599	K	22.8	Very low	24.9	Very low	184 Å²	184	148.4 Å²	148.4	80%	0.8	77%	0.768	S	S	*	*			trans	-50.6	120.5	137	-73.5	171.2	173.7	175	0	110.3	I601	K599-I601 HydrophobicContact CD-CD1 4.45Å; K599-I601 HydrophobicContact CG-CD1 4.4Å
600	L	27.5	Very low	25	Very low	149 Å²	149	147.2 Å²	147.2	78%	0.78	76%	0.757	S	S	*	*			trans	-117.9	92.6	147.6	-145.1	93.8	0	0	0	107.4	E598	E598-L600 PolarHBondContact O-N 3.22Å
601	I	27.2	Very low	25.1	Very low	125 Å²	125	143.3 Å²	143.3	64%	0.641	75%	0.746	S	S	*	*			trans	-97.6	92.4	172.5	-61.3	171.6	0	0	0	105.5	K599 S603	K599-I601 HydrophobicContact CD-CD1 4.45Å; K599-I601 HydrophobicContact CG-CD1 4.4Å; I601-S603 VanDerWaalsContact C-N 3.26Å; I601-S603 PolarHBondContact O-N 3.31Å; I601-S603 VanDerWaalsContact O-N 3.1Å
602	D	26.9	Very low	25.1	Very low	149 Å²	149	141.5 Å²	141.5	80%	0.797	74%	0.74	S	S	*	*			trans	-80.6	81.9	165.8	-82.8	-31.2	0	0	0	108.9
603	S	24.6	Very low	25.3	Very low	90 Å²	90	147.6 Å²	147.6	63%	0.629	74%	0.74	S	S	*	*			trans	-88.2	111.2	163.9	55.1	0	0	0	0	109.2	I601	I601-S603 VanDerWaalsContact C-N 3.26Å; I601-S603 PolarHBondContact O-N 3.31Å; I601-S603 VanDerWaalsContact O-N 3.1Å
604	K	28.3	Very low	25.5	Very low	198 Å²	198	148.2 Å²	148.2	86%	0.861	74%	0.738	S	S	*	*			trans	174.9	110.3	148.4	-99.8	161.7	-173.5	-177.8	0	109.2
605	I	26.2	Very low	25.7	Very low	160 Å²	160	146.2 Å²	146.2	82%	0.821	73%	0.733	S	S	*	*				-174.4	97.2	122.5	-82.2	145.5	0	0	0	105
606	N	25.2	Very low	25.7	Very low	150 Å²	150	146.4 Å²	146.4	80%	0.802	74%	0.738	S	S	*	*			trans	-90.3	97.1	172.6	-167.3	-13.8	0	0	0	105.9	N608	N606-N608 VanDerWaalsContact C-N 3.31Å; N606-N608 PolarHBondContact O-N 2.86Å
607	L	28	Very low	26.1	Very low	143 Å²	143	143.6 Å²	143.6	75%	0.749	73%	0.734	S	S	*	*			trans	-90	77.2	172.3	-145.3	85.1	0	0	0	108.1	V609	L607-V609 VanDerWaalsContact C-N 3.31Å; L607-V609 HydrophobicContact CD2-CG2 4.1Å; L607-V609 HydrophobicContact CG-CG2 4.08Å; L607-V609 PolarHBondContact O-N 3.46Å
608	N	24.9	Very low	26.2	Very low	116 Å²	116	143.2 Å²	143.2	62%	0.62	73%	0.731	S	S	*	*			trans	-73.1	86.3	167.2	-175.7	11.3	0	0	0	108.2	N606	N606-N608 VanDerWaalsContact C-N 3.31Å; N606-N608 PolarHBondContact O-N 2.86Å
609	V	26.7	Very low	26.2	Very low	106 Å²	106	141 Å²	141	64%	0.642	73%	0.729	S	S	*	*			trans	-103.4	89.4	165.1	-176.8	0	0	0	0	107.2	L607 D611	L607-V609 VanDerWaalsContact C-N 3.31Å; L607-V609 HydrophobicContact CD2-CG2 4.1Å; L607-V609 HydrophobicContact CG-CG2 4.08Å; L607-V609 PolarHBondContact O-N 3.46Å; V609-D611 VanDerWaalsContact C-N 3.33Å; V609-D611 PolarHBondContact O-N 2.67Å; V609-D611 VanDerWaalsContact O-N 3.09Å
610	Q	24.5	Very low	26.4	Very low	128 Å²	128	140.5 Å²	140.5	60%	0.598	73%	0.727	S	S	*	*			trans	-73.6	82	174.4	-173.4	167.8	-6.8	0	0	109	Q612	Q610-Q612 HydrophobicContact CG-CG 4.16Å; Q610-Q612 PolarHBondContact O-N 2.7Å
611	D	27.1	Very low	26.3	Very low	123 Å²	123	142 Å²	142	66%	0.658	73%	0.73	S	S	*	*			trans	-89.1	81.6	168.6	-119.3	-18.5	0	0	0	108.8	V609 R613	V609-D611 VanDerWaalsContact C-N 3.33Å; V609-D611 PolarHBondContact O-N 2.67Å; V609-D611 VanDerWaalsContact O-N 3.09Å; D611-R613 VanDerWaalsContact C-N 3.34Å; D611-R613 PolarHBondContact O-N 2.88Å
612	Q	24.5	Very low	26.3	Very low	133 Å²	133	144.1 Å²	144.1	62%	0.621	74%	0.737	S	S	*	*			trans	-68.6	88.5	168.6	-81.4	174.9	-8.7	0	0	109.3	Q610	Q610-Q612 HydrophobicContact CG-CG 4.16Å; Q610-Q612 PolarHBondContact O-N 2.7Å
613	R	27.8	Very low	26.3	Very low	202 Å²	202	144.8 Å²	144.8	76%	0.762	74%	0.739	S	S	*	*			trans	-96.7	101	163.7	-71.9	-170.9	-178.3	-179.3	1.8	109.6	D611 D615	D611-R613 VanDerWaalsContact C-N 3.34Å; D611-R613 PolarHBondContact O-N 2.88Å; R613-D615 VanDerWaalsContact C-N 3.33Å; R613-D615 PolarHBondContact O-N 3.01Å
614	H	24.7	Very low	26.5	Very low	151 Å²	151	150.1 Å²	150.1	70%	0.699	75%	0.75	S	S	*	*			trans	-69	85.4	168.4	-65.1	-76.3	0	0	0	109.8	C616	H614-C616 PolarHBondContact O-N 2.88Å
615	D	28	Very low	26.4	Very low	142 Å²	142	145 Å²	145	76%	0.759	74%	0.74	S	S	*	*			trans	-78.6	83.8	165.1	-81.7	-19.8	0	0	0	109.2	R613 T617	R613-D615 VanDerWaalsContact C-N 3.33Å; R613-D615 PolarHBondContact O-N 3.01Å; D615-T617 VanDerWaalsContact C-N 3.3Å; D615-T617 PolarHBondContact O-N 2.95Å; D615-T617 PolarHBondContact O-OG1 3.04Å
616	C	24.6	Very low	26.5	Very low	115 Å²	115	143.4 Å²	143.4	78%	0.777	74%	0.74	S	S	*	*			trans	-58.1	90.1	164.3	-75.7	0	0	0	0	109.3	H614 I618	H614-C616 PolarHBondContact O-N 2.88Å; C616-I618 PolarHBondContact O-N 2.69Å
617	T	28.6	Very low	26.7	Very low	128 Å²	128	144.9 Å²	144.9	79%	0.785	74%	0.739	S	S	*	*			trans	-78.8	106.4	172.1	-28.2	0	0	0	0	108.4	D615 V619	D615-T617 VanDerWaalsContact C-N 3.3Å; D615-T617 PolarHBondContact O-N 2.95Å; D615-T617 PolarHBondContact O-OG1 3.04Å; T617-V619 PolarHBondContact O-N 3.42Å
618	I	26.9	Very low	26.9	Very low	137 Å²	137	143.5 Å²	143.5	70%	0.703	74%	0.739	S	S	*	*			trans	-52.5	119.2	-179.6	-63	167.9	0	0	0	109.9	C616 K620	C616-I618 PolarHBondContact O-N 2.69Å; I618-K620 HydrophobicContact CG2-CG 4.07Å; I618-K620 PolarHBondContact O-N 2.88Å
619	V	25	Very low	27.2	Very low	132 Å²	132	145.4 Å²	145.4	80%	0.8	75%	0.747	S	S	*	*			trans	-66.2	81.4	169	-177	0	0	0	0	108.3	T617 Q621	T617-V619 PolarHBondContact O-N 3.42Å; V619-Q621 PolarHBondContact O-N 3.39Å
620	K	28.2	Very low	27.3	Very low	173 Å²	173	148.7 Å²	148.7	75%	0.752	76%	0.756	S	S	*	*			trans	-78.4	98.7	163.9	-85.8	-176.5	177.7	177.4	0	107.6	I618 Q622	I618-K620 HydrophobicContact CG2-CG 4.07Å; I618-K620 PolarHBondContact O-N 2.88Å; K620-Q622 PolarHBondContact O-N 2.93Å
621	Q	23.9	Very low	27.5	Very low	181 Å²	181	152.4 Å²	152.4	85%	0.846	76%	0.764	S	S	*	*			trans	-52.8	86.7	163.5	-72.4	172.8	-21.9	0	0	109.6	V619 I623	V619-Q621 PolarHBondContact O-N 3.39Å; Q621-I623 PolarHBondContact O-N 3.19Å
622	Q	27.5	Very low	27.5	Very low	169 Å²	169	151.8 Å²	151.8	79%	0.79	77%	0.769	S	S	*	*			trans	-83.6	111.4	163.7	-77.8	-170.1	7.6	0	0	107.6	K620 K624	K620-Q622 PolarHBondContact O-N 2.93Å; Q622-K624 PolarHBondContact O-N 2.83Å
623	I	27.3	Very low	27.7	Very low	163 Å²	163	153 Å²	153	84%	0.836	78%	0.775	S	S	*	*			trans	-47.9	106.8	171.8	-62.9	164	0	0	0	107.6	Q621 S625	Q621-I623 PolarHBondContact O-N 3.19Å; I623-S625 PolarHBondContact O-N 2.81Å
624	K	28.4	Very low	27.8	Very low	202 Å²	202	148.4 Å²	148.4	88%	0.878	77%	0.774	S	S	*	*			trans	-66.7	95.9	176.4	-71.4	-179.9	177.7	179.3	0	107.9	Q622	Q622-K624 PolarHBondContact O-N 2.83Å
625	S	27	Very low	28.3	Very low	91 Å²	91	148.9 Å²	148.9	64%	0.636	78%	0.78	S	S	*	*			trans	-68.2	133.3	156.3	45.1	0	0	0	0	107.6	I623 K627	I623-S625 PolarHBondContact O-N 2.81Å; S625-K627 PolarHBondContact O-N 3.3Å
626	P	27.3	Very low	28.7	Very low	127 Å²	127	146.6 Å²	146.6	83%	0.825	77%	0.771	S	S	*	*			trans	-71.4	94.5	-175.5	28.2	-31.7	0	0	0	108.4
627	K	30.9	Very low	29.5	Very low	180 Å²	180	144.2 Å²	144.2	78%	0.783	77%	0.766	S	S	*	*			trans	-68.9	129.3	162.5	-78	-175.9	177.7	179.9	0	107.2	S625 I629	S625-K627 PolarHBondContact O-N 3.3Å; K627-I629 PolarHBondContact O-N 3.39Å
628	P	31	Very low	30	Very low	114 Å²	114	144.9 Å²	144.9	74%	0.74	76%	0.76	S	S	*	*			trans	-55.2	125.8	177	21.7	-29.9	0	0	0	108.1	E630	P628-E630 PolarHBondContact O-N 2.89Å
629	I	30.4	Very low	30.9	Very low	157 Å²	157	148.5 Å²	148.5	81%	0.805	77%	0.766	S	S	*	*			trans	-66.4	90	174.1	-64.9	165.1	0	0	0	105.5	K627 R631	K627-I629 PolarHBondContact O-N 3.39Å; I629-R631 VanDerWaalsContact C-N 3.26Å; I629-R631 HydrophobicContact CG2-CG 4.5Å; I629-R631 PolarHBondContact O-N 3.34Å
630	E	30	Very low	32.7	Very low	175 Å²	175	145.5 Å²	145.5	82%	0.818	75%	0.748	S	S	*	*			trans	-61.3	98.3	161.1	-80	-177.3	163.9	0	0	105.9	P628 S632	P628-E630 PolarHBondContact O-N 2.89Å; E630-S632 PolarHBondContact O-N 3.48Å
631	R	28.3	Very low	34.6	Very low	206 Å²	206	144.2 Å²	144.2	78%	0.777	75%	0.75	S	S	*	*			trans	-56.5	105.6	169.7	-83.3	-179.1	173.2	170.9	-2.8	106.9	I629 H633	I629-R631 VanDerWaalsContact C-N 3.26Å; I629-R631 HydrophobicContact CG2-CG 4.5Å; I629-R631 PolarHBondContact O-N 3.34Å; R631-H633 PolarHBondContact O-CD2 3.29Å; R631-H633 PolarHBondContact O-N 2.89Å
632	S	27.5	Very low	37	Very low	109 Å²	109	142.6 Å²	142.6	76%	0.762	74%	0.742	S	S	*	*			trans	-65.9	100.5	172.8	-34	0	0	0	0	106.7	E630 S634	E630-S632 PolarHBondContact O-N 3.48Å; S632-S634 PolarHBondContact O-N 2.96Å
633	H	28.5	Very low	39	Very low	159 Å²	159	140.1 Å²	140.1	74%	0.736	73%	0.725	S	S	*	*			trans	-71.5	97.5	170.3	-66.3	-70.2	0	0	0	107.6	R631 I635	R631-H633 PolarHBondContact O-CD2 3.29Å; R631-H633 PolarHBondContact O-N 2.89Å; H633-I635 PolarHBondContact O-N 3.42Å
634	S	29.6	Very low	41.2	Very low	106 Å²	106	136.5 Å²	136.5	74%	0.741	71%	0.705	S	S	*	*			trans	-66.7	98.5	172	-48.8	0	0	0	0	108.6	S632 T636	S632-S634 PolarHBondContact O-N 2.96Å; S634-T636 PolarHBondContact O-N 3.43Å
635	I	35.2	Very low	43.9	Very low	161 Å²	161	134 Å²	134	83%	0.826	69%	0.694	S	S	*	*			trans	-75.6	6.6	176.2	-66.7	166.7	0	0	0	111.5	H633 G637	H633-I635 PolarHBondContact O-N 3.42Å; I635-G637 VanDerWaalsContact C-N 3.26Å; I635-G637 PolarHBondContact O-N 2.87Å
636	T	36.8	Very low	46.4	Very low	93 Å²	93	134.5 Å²	134.5	57%	0.571	69%	0.689	S	S	*	*			trans	-82.7	70.3	-175.7	-13.6	0	0	0	0	111.5	S634 H638	S634-T636 PolarHBondContact O-N 3.43Å; T636-H638 VanDerWaalsContact CG2-CD2 3.5Å; T636-H638 WeakPolarHBondContact CG2-CD2 3.47Å; T636-H638 VanDerWaalsContact CG2-CE1 3.47Å; T636-H638 WeakPolarHBondContact CG2-CE1 3.4Å; T636-H638 WeakPolarHBondContact CG2-NE2 3.39Å; T636-H638 PolarHBondContact O-N 2.83Å
637	G	41.5	Very low	48.6	Very low	66 Å²	66	131.8 Å²	131.8	68%	0.68	66%	0.663	S	S	*	*			trans	-64.7	79.9	154.1	0	0	0	0	0	108	I635 Y639	I635-G637 VanDerWaalsContact C-N 3.26Å; I635-G637 PolarHBondContact O-N 2.87Å; G637-Y639 PolarHBondContact O-N 2.89Å
638	H	39.1	Very low	51.1	Low	142 Å²	142	129.8 Å²	129.8	66%	0.657	65%	0.654	S	S	*	*			trans	-60	106	173.8	-77.8	-81	0	0	0	107.5	T636 T640	T636-H638 VanDerWaalsContact CG2-CD2 3.5Å; T636-H638 WeakPolarHBondContact CG2-CD2 3.47Å; T636-H638 VanDerWaalsContact CG2-CE1 3.47Å; T636-H638 WeakPolarHBondContact CG2-CE1 3.4Å; T636-H638 WeakPolarHBondContact CG2-NE2 3.39Å; T636-H638 PolarHBondContact O-N 2.83Å; H638-T640 HydrophobicContact CB-CG2 4.13Å; H638-T640 PolarHBondContact O-N 3.44Å
639	Y	45.7	Very low	53.7	Low	213 Å²	213	130 Å²	130	84%	0.835	65%	0.645	S	S	*	*			trans	-58	89.5	155.4	-87.5	-98.5	0	0	0	106.3	G637	G637-Y639 PolarHBondContact O-N 2.89Å
640	T	63.5	Low	56.3	Low	68 Å²	68	128.3 Å²	128.3	42%	0.417	63%	0.629	S	S	.	*			trans	-75.7	127.3	172.6	55.4	0	0	0	0	107.2	H638 E642 R643 E644	H638-T640 HydrophobicContact CB-CG2 4.13Å; H638-T640 PolarHBondContact O-N 3.44Å; T640-E642 PolarHBondContact O-N 3.07Å; T640-R643 PolarHBondContact O-N 3.06Å; T640-R643 WeakPolarHBondContact OG1-CB 3.43Å; T640-R643 PolarHBondContact OG1-N 2.9Å; T640-E644 PolarHBondContact O-N 3.28Å
641	D	68.2	Low	58.8	Low	146 Å²	146	126.7 Å²	126.7	78%	0.781	62%	0.615	S	S	*	*	H	α-helix	trans	-53.9	-26.7	173.4	-70.2	-34.8	0	0	0	111.3	E644 K645	D641-E644 PolarHBondContact O-N 3.44Å; D641-K645 VanDerWaalsContact O-CB 3.3Å; D641-K645 WeakPolarHBondContact O-CB 3.47Å; D641-K645 PolarHBondContact O-N 3.32Å
642	E	74.2	Confident	61.4	Low	148 Å²	148	123 Å²	123	69%	0.692	61%	0.606	S	S	*	*	H	α-helix	trans	-61.4	-43.8	170.7	-77.1	-164.2	148.7	0	0	113.7	T640 E644 K645 L646	T640-E642 PolarHBondContact O-N 3.07Å; E642-E644 VanDerWaalsContact C-N 3.29Å; E642-E644 PolarHBondContact O-N 3.1Å; E642-K645 PolarHBondContact O-N 2.75Å; E642-L646 PolarHBondContact O-N 3.47Å
643	R	68.4	Low	64.2	Low	116 Å²	116	120.8 Å²	120.8	44%	0.438	60%	0.595	S	S	.	*	H	α-helix	trans	-63.9	-38.9	178.9	-168.9	176.8	-177.4	-169.7	-2.8	110.5	D531 T640 R647	D531-R643 IonicContact OD2-NH2 3.56Å; D531-R643 PolarHBondContact OD2-NH2 2.89Å; T640-R643 PolarHBondContact O-N 3.06Å; T640-R643 WeakPolarHBondContact OG1-CB 3.43Å; T640-R643 PolarHBondContact OG1-N 2.9Å; R643-R647 WeakPolarHBondContact O-CG 3.3Å; R643-R647 PolarHBondContact O-N 3.45Å
644	E	73.8	Confident	66.7	Low	88 Å²	88	115.7 Å²	115.7	41%	0.411	58%	0.577	S	S	.	*	H	α-helix	trans	-72.5	-36.5	175.8	-170.2	56.1	-154.2	0	0	112.4	T640 D641 E642 R647 K648 R651	T640-E644 PolarHBondContact O-N 3.28Å; D641-E644 PolarHBondContact O-N 3.44Å; E642-E644 VanDerWaalsContact C-N 3.29Å; E642-E644 PolarHBondContact O-N 3.1Å; E644-R647 PolarHBondContact O-N 2.94Å; E644-R647 IonicContact OE2-NH1 3.1Å; E644-K648 PolarHBondContact O-N 2.84Å; E644-R651 IonicContact OE1-NH2 3.7Å; E644-R651 PolarHBondContact OE1-NH2 3.18Å
645	K	84.9	Confident	69.1	Low	149 Å²	149	115.5 Å²	115.5	65%	0.648	57%	0.566	S	S	*	*	H	α-helix	trans	-59.4	-47.7	173.5	-172.7	-177.7	175.6	-171.3	0	111.5	D641 E642 R647 K648 E649	D641-K645 VanDerWaalsContact O-CB 3.3Å; D641-K645 WeakPolarHBondContact O-CB 3.47Å; D641-K645 PolarHBondContact O-N 3.32Å; E642-K645 PolarHBondContact O-N 2.75Å; K645-R647 VanDerWaalsContact C-N 3.33Å; K645-R647 PolarHBondContact O-N 2.61Å; K645-K648 WeakPolarHBondContact O-CB 3.12Å; K645-K648 PolarHBondContact O-N 3.49Å; K645-K648 VanDerWaalsContact O-N 3.12Å; K645-E649 PolarHBondContact O-N 2.87Å
646	L	78.8	Confident	71.5	Confident	102 Å²	102	111.4 Å²	111.4	53%	0.534	55%	0.548	S	S	.	.	H	α-helix	trans	-60.6	-39.6	176.3	-79.9	165.4	0	0	0	112.3	E642 K648 R650	E642-L646 PolarHBondContact O-N 3.47Å; L646-K648 VanDerWaalsContact C-N 3.33Å; L646-K648 PolarHBondContact O-N 3.3Å; L646-R650 WeakPolarHBondContact O-CB 3.47Å; L646-R650 PolarHBondContact O-N 2.91Å
647	R	73.4	Confident	73.9	Confident	69 Å²	69	111.9 Å²	111.9	26%	0.26	54%	0.54	S	S	.	.	H	α-helix	trans	-65.9	-34.9	175	-75	-173.6	-173.9	118.2	-5.8	113	D531 R643 E644 K645 R651	D531-R647 IonicContact OD2-NH2 3.06Å; R643-R647 WeakPolarHBondContact O-CG 3.3Å; R643-R647 PolarHBondContact O-N 3.45Å; E644-R647 PolarHBondContact O-N 2.94Å; E644-R647 IonicContact OE2-NH1 3.1Å; K645-R647 VanDerWaalsContact C-N 3.33Å; K645-R647 PolarHBondContact O-N 2.61Å; R647-R651 WeakPolarHBondContact O-CG 3.5Å; R647-R651 PolarHBondContact O-N 2.95Å; R647-R651 PolarHBondContact O-NE 2.88Å; R647-R651 VanDerWaalsContact O-NE 3.11Å
648	K	83.3	Confident	75.9	Confident	138 Å²	138	115.8 Å²	115.8	60%	0.6	53%	0.534	S	S	*	.	H	α-helix	trans	-71.1	-46.2	178.6	-165.7	-179.8	179	-172.3	0	110.6	E644 K645 L646 R650 R651 E652	E644-K648 PolarHBondContact O-N 2.84Å; K645-K648 WeakPolarHBondContact O-CB 3.12Å; K645-K648 PolarHBondContact O-N 3.49Å; K645-K648 VanDerWaalsContact O-N 3.12Å; L646-K648 VanDerWaalsContact C-N 3.33Å; L646-K648 PolarHBondContact O-N 3.3Å; K648-R650 PolarHBondContact O-N 2.61Å; K648-R651 PolarHBondContact O-N 2.72Å; K648-E652 PolarHBondContact O-N 3.25Å
649	E	87.5	Confident	78.1	Confident	119 Å²	119	112.4 Å²	112.4	56%	0.556	53%	0.525	S	S	*	.	H	α-helix	trans	-59.4	-45.4	176.5	-172.6	175.7	-180	0	0	112	K645 R651 E652 A653	K645-E649 PolarHBondContact O-N 2.87Å; E649-R651 VanDerWaalsContact C-N 3.34Å; E649-R651 PolarHBondContact O-N 2.84Å; E649-E652 PolarHBondContact O-N 3.36Å; E649-A653 WeakPolarHBondContact O-CB 3.23Å; E649-A653 PolarHBondContact O-N 3.41Å
650	R	83.8	Confident	80.1	Confident	122 Å²	122	107 Å²	107	46%	0.46	51%	0.511	S	S	.	.	H	α-helix	trans	-60.9	-40.1	176.5	-169.1	-176.2	-65.2	149.3	-0.8	112.7	L646 K648 S654	L646-R650 WeakPolarHBondContact O-CB 3.47Å; L646-R650 PolarHBondContact O-N 2.91Å; K648-R650 PolarHBondContact O-N 2.61Å; R650-S654 WeakPolarHBondContact O-CB 3.45Å; R650-S654 PolarHBondContact O-N 2.73Å
651	R	82.8	Confident	81.2	Confident	141 Å²	141	108 Å²	108	53%	0.532	51%	0.511	S	S	.	.	H	α-helix	trans	-66.6	-41.4	177.3	-83.4	-179.3	-81.1	160.6	-10.3	112	E644 R647 K648 E649 S654 M655	E644-R651 IonicContact OE1-NH2 3.7Å; E644-R651 PolarHBondContact OE1-NH2 3.18Å; R647-R651 WeakPolarHBondContact O-CG 3.5Å; R647-R651 PolarHBondContact O-N 2.95Å; R647-R651 PolarHBondContact O-NE 2.88Å; R647-R651 VanDerWaalsContact O-NE 3.11Å; K648-R651 PolarHBondContact O-N 2.72Å; E649-R651 VanDerWaalsContact C-N 3.34Å; E649-R651 PolarHBondContact O-N 2.84Å; R651-S654 PolarHBondContact O-N 2.86Å; R651-M655 PolarHBondContact O-N 3.34Å
652	E	83.2	Confident	82	Confident	128 Å²	128	103.5 Å²	103.5	60%	0.598	49%	0.494	S	S	*	.	H	α-helix	trans	-67.4	-42.8	178.8	-169.4	166.7	-174.1	0	0	111.7	K648 E649 M655 T656	K648-E652 PolarHBondContact O-N 3.25Å; E649-E652 PolarHBondContact O-N 3.36Å; E652-M655 PolarHBondContact O-N 3.49Å; E652-T656 WeakPolarHBondContact O-CB 3.26Å; E652-T656 PolarHBondContact O-N 3.35Å; E652-T656 PolarHBondContact O-OG1 2.92Å
653	A	85	Confident	82.6	Confident	63 Å²	63	102.9 Å²	102.9	52%	0.521	49%	0.489	S	S	.	.	H	α-helix	trans	-60.9	-45.1	173.6	0	0	0	0	0	112.4	E649 M655 T656 R657	E649-A653 WeakPolarHBondContact O-CB 3.23Å; E649-A653 PolarHBondContact O-N 3.41Å; A653-M655 PolarHBondContact O-N 2.87Å; A653-T656 PolarHBondContact O-N 2.86Å; A653-R657 WeakPolarHBondContact O-CB 3.44Å; A653-R657 PolarHBondContact O-N 2.85Å
654	S	82.7	Confident	83.3	Confident	51 Å²	51	103.9 Å²	103.9	36%	0.357	50%	0.499	S	S	.	.	H	α-helix	trans	-62.4	-40.7	176.9	178.3	0	0	0	0	112.8	R650 R651 R658	R650-S654 WeakPolarHBondContact O-CB 3.45Å; R650-S654 PolarHBondContact O-N 2.73Å; R651-S654 PolarHBondContact O-N 2.86Å; S654-R658 PolarHBondContact O-N 3.22Å; S654-R658 VanDerWaalsContact O-N 3.13Å; S654-R658 PolarHBondContact OG-NH2 3.46Å
655	M	80.2	Confident	83.7	Confident	102 Å²	102	105.9 Å²	105.9	50%	0.502	51%	0.506	S	S	.	.	H	α-helix	trans	-65.6	-44.7	176.1	-89.2	-64	-59.7	0	0	111.7	R651 E652 A653 R657 R658 C659	R651-M655 PolarHBondContact O-N 3.34Å; E652-M655 PolarHBondContact O-N 3.49Å; A653-M655 PolarHBondContact O-N 2.87Å; M655-R657 VanDerWaalsContact C-N 3.33Å; M655-R657 PolarHBondContact O-N 3.44Å; M655-R658 PolarHBondContact O-N 3.19Å; M655-C659 PolarHBondContact O-N 2.97Å; M655-C659 PolarHBondContact O-SG 2.9Å; M655-C659 VanDerWaalsContact O-SG 3.39Å
656	T	84.6	Confident	83.4	Confident	75 Å²	75	103.4 Å²	103.4	46%	0.46	50%	0.499	S	S	.	.	H	α-helix	trans	-62.8	-41.9	-179.7	-52.4	0	0	0	0	111.2	E652 A653 C659 N660	E652-T656 WeakPolarHBondContact O-CB 3.26Å; E652-T656 PolarHBondContact O-N 3.35Å; E652-T656 PolarHBondContact O-OG1 2.92Å; A653-T656 PolarHBondContact O-N 2.86Å; T656-C659 PolarHBondContact O-N 3.04Å; T656-N660 PolarHBondContact O-N 2.81Å; T656-N660 PolarHBondContact O-ND2 3.27Å
657	R	86.7	Confident	83.1	Confident	104 Å²	104	102.8 Å²	102.8	39%	0.392	50%	0.497	S	S	.	.	H	α-helix	trans	-60.4	-48.8	174.7	-175.9	-178.5	172.5	162.5	7.6	112.1	H541 Q545 A653 M655 C659 N660 E661	H541-R657 PolarHBondContact NE2-NH2 3.02Å; Q545-R657 VanDerWaalsContact CD-NH2 3.3Å; A653-R657 WeakPolarHBondContact O-CB 3.44Å; A653-R657 PolarHBondContact O-N 2.85Å; M655-R657 VanDerWaalsContact C-N 3.33Å; M655-R657 PolarHBondContact O-N 3.44Å; R657-C659 VanDerWaalsContact C-N 3.34Å; R657-C659 PolarHBondContact O-N 2.92Å; R657-N660 PolarHBondContact O-N 3.17Å; R657-N660 VanDerWaalsContact O-N 3.17Å; R657-E661 WeakPolarHBondContact CG-OE1 3.41Å; R657-E661 IonicContact CZ-OE1 3.95Å; R657-E661 IonicContact NE-OE1 2.79Å; R657-E661 PolarHBondContact NE-OE1 3.18Å; R657-E661 IonicContact NH2-OE1 3.67Å; R657-E661 WeakPolarHBondContact O-CG 3.41Å; R657-E661 PolarHBondContact O-N 2.87Å
658	R	84.5	Confident	83.2	Confident	148 Å²	148	105.1 Å²	105.1	56%	0.558	51%	0.51	S	S	*	.	H	α-helix	trans	-61	-39.8	177.4	-86.7	-176.3	-85.2	176.4	-11.2	112.9	S654 M655 N660 A662	S654-R658 PolarHBondContact O-N 3.22Å; S654-R658 VanDerWaalsContact O-N 3.13Å; S654-R658 PolarHBondContact OG-NH2 3.46Å; M655-R658 PolarHBondContact O-N 3.19Å; R658-N660 VanDerWaalsContact C-N 3.35Å; R658-A662 WeakPolarHBondContact O-CB 3.33Å; R658-A662 PolarHBondContact O-N 2.87Å
659	C	84.5	Confident	82.5	Confident	71 Å²	71	103 Å²	103	48%	0.48	51%	0.505	S	S	.	.	H	α-helix	trans	-63.8	-39.7	175.1	-72.3	0	0	0	0	112.2	M655 T656 R657 K663	M655-C659 PolarHBondContact O-N 2.97Å; M655-C659 PolarHBondContact O-SG 2.9Å; M655-C659 VanDerWaalsContact O-SG 3.39Å; T656-C659 PolarHBondContact O-N 3.04Å; R657-C659 VanDerWaalsContact C-N 3.34Å; R657-C659 PolarHBondContact O-N 2.92Å; C659-K663 WeakPolarHBondContact O-CB 3.36Å; C659-K663 PolarHBondContact O-N 3.35Å
660	N	88.4	Confident	81.7	Confident	100 Å²	100	102.9 Å²	102.9	54%	0.535	51%	0.507	S	S	.	.	H	α-helix	trans	-68.4	-43.9	177.2	-73.9	-22.6	0	0	0	112.2	T656 R657 R658 A662 K663 Q664	T656-N660 PolarHBondContact O-N 2.81Å; T656-N660 PolarHBondContact O-ND2 3.27Å; R657-N660 PolarHBondContact O-N 3.17Å; R657-N660 VanDerWaalsContact O-N 3.17Å; R658-N660 VanDerWaalsContact C-N 3.35Å; N660-A662 PolarHBondContact O-N 3.19Å; N660-K663 PolarHBondContact O-N 3.49Å; N660-Q664 WeakPolarHBondContact O-CB 3.46Å; N660-Q664 PolarHBondContact O-N 3.36Å
661	E	86.1	Confident	80.8	Confident	87 Å²	87	101 Å²	101	41%	0.407	51%	0.512	S	S	.	.	H	α-helix	trans	-60.6	-44.1	175.3	-72.9	171	-173.9	0	0	111	R657 K663 Q664 F665	R657-E661 WeakPolarHBondContact CG-OE1 3.41Å; R657-E661 IonicContact CZ-OE1 3.95Å; R657-E661 IonicContact NE-OE1 2.79Å; R657-E661 PolarHBondContact NE-OE1 3.18Å; R657-E661 IonicContact NH2-OE1 3.67Å; R657-E661 WeakPolarHBondContact O-CG 3.41Å; R657-E661 PolarHBondContact O-N 2.87Å; E661-K663 PolarHBondContact O-N 3.06Å; E661-Q664 PolarHBondContact O-N 3.08Å; E661-F665 WeakPolarHBondContact O-CB 3.31Å; E661-F665 PolarHBondContact O-N 3.4Å
662	A	84.4	Confident	79.6	Confident	53 Å²	53	100.4 Å²	100.4	44%	0.438	52%	0.52	S	S	.	.	H	α-helix	trans	-62.4	-40.4	175.7	0	0	0	0	0	112.5	R658 N660 Q664 F665 I666	R658-A662 WeakPolarHBondContact O-CB 3.33Å; R658-A662 PolarHBondContact O-N 2.87Å; N660-A662 PolarHBondContact O-N 3.19Å; A662-Q664 VanDerWaalsContact C-N 3.35Å; A662-F665 PolarHBondContact O-N 2.86Å; A662-I666 WeakPolarHBondContact O-CG1 3.16Å; A662-I666 PolarHBondContact O-N 3.39Å
663	K	86.9	Confident	77.7	Confident	135 Å²	135	97.7 Å²	97.7	59%	0.587	52%	0.515	S	S	*	.	H	α-helix	trans	-65.2	-39.3	176	-171.6	179.1	-179	-178.6	0	111.8	C659 N660 E661 I666 N667	C659-K663 WeakPolarHBondContact O-CB 3.36Å; C659-K663 PolarHBondContact O-N 3.35Å; N660-K663 PolarHBondContact O-N 3.49Å; E661-K663 PolarHBondContact O-N 3.06Å; K663-I666 PolarHBondContact O-N 3.44Å; K663-N667 PolarHBondContact O-N 2.98Å
664	Q	84.8	Confident	75.9	Confident	137 Å²	137	100.4 Å²	100.4	64%	0.64	53%	0.525	S	S	*	.	H	α-helix	trans	-64.8	-43.3	177.4	-160.3	172.9	16.8	0	0	111	N660 E661 A662 I666 N667 E668	N660-Q664 WeakPolarHBondContact O-CB 3.46Å; N660-Q664 PolarHBondContact O-N 3.36Å; E661-Q664 PolarHBondContact O-N 3.08Å; A662-Q664 VanDerWaalsContact C-N 3.35Å; Q664-I666 PolarHBondContact O-N 3.48Å; Q664-N667 PolarHBondContact O-N 2.81Å; Q664-E668 PolarHBondContact O-N 2.97Å
665	F	81.6	Confident	73.7	Confident	130 Å²	130	105 Å²	105	57%	0.57	55%	0.545	S	S	*	.	H	α-helix	trans	-61.9	-41.9	175.8	-173.6	-107	0	0	0	112.8	E661 A662 N667 E668 I669	E661-F665 WeakPolarHBondContact O-CB 3.31Å; E661-F665 PolarHBondContact O-N 3.4Å; A662-F665 PolarHBondContact O-N 2.86Å; F665-N667 VanDerWaalsContact C-N 3.34Å; F665-N667 PolarHBondContact O-N 3.1Å; F665-E668 PolarHBondContact O-N 3.07Å; F665-I669 HydrophobicContact CD1-CD1 3.76Å; F665-I669 HydrophobicContact CE1-CD1 3.34Å; F665-I669 HydrophobicContact CE1-CG1 4.4Å; F665-I669 HydrophobicContact CE2-CD1 4.48Å; F665-I669 HydrophobicContact CG-CD1 4.5Å; F665-I669 HydrophobicContact CZ-CD1 3.75Å; F665-I669 HydrophobicContact CZ-CG1 4.49Å; F665-I669 WeakPolarHBondContact O-CG1 3.4Å; F665-I669 PolarHBondContact O-N 2.98Å
666	I	78	Confident	71.5	Confident	97 Å²	97	105.3 Å²	105.3	50%	0.497	55%	0.554	S	S	.	*	H	α-helix	trans	-63	-41.7	175.2	-68.9	166.8	0	0	0	111.1	A662 K663 Q664 E668 I669 L670	A662-I666 WeakPolarHBondContact O-CG1 3.16Å; A662-I666 PolarHBondContact O-N 3.39Å; K663-I666 PolarHBondContact O-N 3.44Å; Q664-I666 PolarHBondContact O-N 3.48Å; I666-E668 VanDerWaalsContact C-N 3.34Å; I666-I669 PolarHBondContact O-N 2.8Å; I666-L670 HydrophobicContact CG2-CD1 4.33Å; I666-L670 PolarHBondContact O-N 3.38Å
667	N	72.7	Confident	69.2	Low	89 Å²	89	111.3 Å²	111.3	48%	0.476	57%	0.574	S	S	.	*	H	α-helix	trans	-66.4	-36	178.1	-76.4	-12.2	0	0	0	112.3	K663 Q664 F665 L670 S671	K663-N667 PolarHBondContact O-N 2.98Å; Q664-N667 PolarHBondContact O-N 2.81Å; F665-N667 VanDerWaalsContact C-N 3.34Å; F665-N667 PolarHBondContact O-N 3.1Å; N667-L670 PolarHBondContact O-N 2.98Å; N667-S671 WeakPolarHBondContact O-CB 3.48Å; N667-S671 PolarHBondContact O-N 2.94Å; N667-S671 PolarHBondContact O-OG 2.7Å
668	E	75	Confident	66.6	Low	117 Å²	117	115.2 Å²	115.2	55%	0.547	60%	0.597	S	S	.	*	H	α-helix	trans	-63.8	-47.2	175.1	-166.7	171.4	-169.4	0	0	110.6	Q664 F665 I666 L670 S671 D672	Q664-E668 PolarHBondContact O-N 2.97Å; F665-E668 PolarHBondContact O-N 3.07Å; I666-E668 VanDerWaalsContact C-N 3.34Å; E668-L670 VanDerWaalsContact C-N 3.34Å; E668-L670 PolarHBondContact O-N 3.35Å; E668-S671 PolarHBondContact O-N 3.02Å; E668-S671 VanDerWaalsContact O-N 3.14Å; E668-D672 PolarHBondContact O-N 2.98Å
669	I	69.7	Low	63.9	Low	94 Å²	94	113.3 Å²	113.3	48%	0.482	61%	0.606	S	S	.	*	H	α-helix	trans	-60.5	-41.7	175.1	-67.1	171	0	0	0	111.8	F665 I666 S671 D672 S673	F665-I669 HydrophobicContact CD1-CD1 3.76Å; F665-I669 HydrophobicContact CE1-CD1 3.34Å; F665-I669 HydrophobicContact CE1-CG1 4.4Å; F665-I669 HydrophobicContact CE2-CD1 4.48Å; F665-I669 HydrophobicContact CG-CD1 4.5Å; F665-I669 HydrophobicContact CZ-CD1 3.75Å; F665-I669 HydrophobicContact CZ-CG1 4.49Å; F665-I669 WeakPolarHBondContact O-CG1 3.4Å; F665-I669 PolarHBondContact O-N 2.98Å; I666-I669 PolarHBondContact O-N 2.8Å; I669-S671 VanDerWaalsContact C-N 3.32Å; I669-D672 PolarHBondContact O-N 2.88Å; I669-S673 WeakPolarHBondContact O-CB 3.23Å; I669-S673 PolarHBondContact O-N 2.95Å; I669-S673 VanDerWaalsContact O-N 3.1Å
670	L	70.4	Confident	61.1	Low	117 Å²	117	114.6 Å²	114.6	61%	0.613	62%	0.616	S	S	*	*	H	α-helix	trans	-66.7	-37	177.9	-119.5	100.3	0	0	0	111.7	I666 N667 E668 S673	I666-L670 HydrophobicContact CG2-CD1 4.33Å; I666-L670 PolarHBondContact O-N 3.38Å; N667-L670 PolarHBondContact O-N 2.98Å; E668-L670 VanDerWaalsContact C-N 3.34Å; E668-L670 PolarHBondContact O-N 3.35Å; L670-S673 WeakPolarHBondContact CA-OG 3.41Å; L670-S673 PolarHBondContact O-N 2.97Å; L670-S673 PolarHBondContact O-OG 3.42Å
671	S	65.5	Low	58.4	Low	81 Å²	81	115.7 Å²	115.7	57%	0.566	63%	0.628	S	S	*	*	H	α-helix	trans	-70.1	-36.4	179.1	-55.8	0	0	0	0	111.8	N667 E668 I669 S673 V674	N667-S671 WeakPolarHBondContact O-CB 3.48Å; N667-S671 PolarHBondContact O-N 2.94Å; N667-S671 PolarHBondContact O-OG 2.7Å; E668-S671 PolarHBondContact O-N 3.02Å; E668-S671 VanDerWaalsContact O-N 3.14Å; I669-S671 VanDerWaalsContact C-N 3.32Å; S671-S673 VanDerWaalsContact C-N 3.25Å; S671-S673 PolarHBondContact O-N 3.45Å; S671-V674 WeakPolarHBondContact O-CG2 3.36Å
672	D	56.5	Low	55.5	Low	130 Å²	130	122.5 Å²	122.5	70%	0.695	65%	0.65	S	S	*	*	H	α-helix	trans	-73.4	-21.4	174.6	-74.4	-13.2	0	0	0	112.2	E668 I669 V674	E668-D672 PolarHBondContact O-N 2.98Å; I669-D672 PolarHBondContact O-N 2.88Å; D672-V674 PolarHBondContact O-N 3.09Å
673	S	44.8	Very low	52.8	Low	70 Å²	70	128.4 Å²	128.4	49%	0.49	67%	0.674	S	S	.	*	T	Hydrogen-bonded Turn	trans	-78.4	36.4	172.6	76.9	0	0	0	0	113.8	I669 L670 S671 L675	I669-S673 WeakPolarHBondContact O-CB 3.23Å; I669-S673 PolarHBondContact O-N 2.95Å; I669-S673 VanDerWaalsContact O-N 3.1Å; L670-S673 WeakPolarHBondContact CA-OG 3.41Å; L670-S673 PolarHBondContact O-N 2.97Å; L670-S673 PolarHBondContact O-OG 3.42Å; S671-S673 VanDerWaalsContact C-N 3.25Å; S671-S673 PolarHBondContact O-N 3.45Å; S673-L675 PolarHBondContact O-N 2.8Å
674	V	45.2	Very low	50	Low	120 Å²	120	128.5 Å²	128.5	73%	0.727	68%	0.681	S	S	*	*			trans	-64.5	87.7	158.2	177.7	0	0	0	0	107.1	S671 D672	S671-V674 WeakPolarHBondContact O-CG2 3.36Å; D672-V674 PolarHBondContact O-N 3.09Å
675	L	36.7	Very low	47.3	Very low	148 Å²	148	129.6 Å²	129.6	78%	0.775	69%	0.686	S	S	*	*			trans	-40.8	121.7	164.3	-90.9	149.4	0	0	0	108.2	S673 K677	S673-L675 PolarHBondContact O-N 2.8Å; L675-K677 PolarHBondContact O-N 3.07Å
676	P	35.8	Very low	44.6	Very low	108 Å²	108	128.7 Å²	128.7	70%	0.701	70%	0.695	S	S	*	*			trans	-55.2	118.2	169.6	-16.8	27.4	0	0	0	106.1	Q678	P676-Q678 VanDerWaalsContact C-N 3.33Å; P676-Q678 PolarHBondContact O-N 3.19Å
677	K	35	Very low	42.3	Very low	201 Å²	201	131.8 Å²	131.8	87%	0.874	71%	0.711	S	S	*	*			trans	-48.2	104.9	171	-72.8	177.2	179	175.3	0	106.5	L675 S679	L675-K677 PolarHBondContact O-N 3.07Å; K677-S679 PolarHBondContact O-N 2.83Å
678	Q	32.2	Very low	40.1	Very low	187 Å²	187	134 Å²	134	87%	0.874	72%	0.722	S	S	*	*			trans	-64.1	92.1	165.6	-75.8	-172.9	-23.8	0	0	104.9	P676 S680	P676-Q678 VanDerWaalsContact C-N 3.33Å; P676-Q678 PolarHBondContact O-N 3.19Å; Q678-S680 VanDerWaalsContact C-N 3.25Å; Q678-S680 PolarHBondContact O-N 3.22Å
679	S	27.6	Very low	37.8	Very low	107 Å²	107	133.2 Å²	133.2	75%	0.748	73%	0.726	S	S	*	*			trans	-61.7	100.1	160.1	41.9	0	0	0	0	105.4	K677	K677-S679 PolarHBondContact O-N 2.83Å
680	S	26.7	Very low	35.9	Very low	99 Å²	99	138.3 Å²	138.3	69%	0.692	75%	0.745	S	S	*	*			trans	-45.8	127.3	168.2	-61.2	0	0	0	0	108.1	Q678 R682	Q678-S680 VanDerWaalsContact C-N 3.25Å; Q678-S680 PolarHBondContact O-N 3.22Å; S680-R682 PolarHBondContact O-N 3.18Å
681	P	30.2	Very low	33.7	Very low	122 Å²	122	140.4 Å²	140.4	79%	0.792	75%	0.752	S	S	*	*			trans	-55.7	118.7	170.9	-16.3	28	0	0	0	106.2	L683	P681-L683 PolarHBondContact O-N 2.99Å
682	R	26.4	Very low	32	Very low	231 Å²	231	141.8 Å²	141.8	87%	0.872	76%	0.761	S	S	*	*			trans	-51.2	115	170.3	-82.1	179.6	168.8	175.3	-3.4	106.4	S680 D684	S680-R682 PolarHBondContact O-N 3.18Å; R682-D684 PolarHBondContact O-N 2.87Å
683	L	27.3	Very low	30.5	Very low	177 Å²	177	142.4 Å²	142.4	93%	0.927	76%	0.764	S	S	*	*			trans	-61.6	84.2	164.2	-86.2	155.5	0	0	0	106.1	P681 Q685	P681-L683 PolarHBondContact O-N 2.99Å; L683-Q685 PolarHBondContact O-N 3.04Å
684	D	28.4	Very low	29.7	Very low	137 Å²	137	144.2 Å²	144.2	73%	0.733	77%	0.773	S	S	*	*			trans	-64.9	104.8	168.9	-102.3	-17.1	0	0	0	107	R682	R682-D684 PolarHBondContact O-N 2.87Å
685	Q	28.3	Very low	28.9	Very low	160 Å²	160	144.5 Å²	144.5	75%	0.748	78%	0.777	S	S	*	*			trans	31.6	109.7	142.5	-61.7	-177.4	12.5	0	0	115.2	L683 I687	L683-Q685 PolarHBondContact O-N 3.04Å; Q685-I687 PolarHBondContact O-N 3.02Å
686	S	23.6	Very low	28.5	Very low	110 Å²	110	145 Å²	145	77%	0.769	78%	0.779	S	S	*	*			trans	-32.6	91.7	160.8	56.8	0	0	0	0	113.6	I688	S686-I688 VanDerWaalsContact C-N 3.33Å; S686-I688 PolarHBondContact O-N 3.28Å; S686-I688 VanDerWaalsContact O-N 3.14Å
687	I	30.5	Very low	28.1	Very low	162 Å²	162	149 Å²	149	83%	0.831	79%	0.785	S	S	*	*			trans	-80.9	94	160.6	-59.3	176.5	0	0	0	105.7	Q685	Q685-I687 PolarHBondContact O-N 3.02Å
688	I	25.6	Very low	27.5	Very low	136 Å²	136	151.5 Å²	151.5	70%	0.697	79%	0.789	S	S	*	*			trans	-52.8	124.7	170.8	-65.5	169.3	0	0	0	108	S686 K690	S686-I688 VanDerWaalsContact C-N 3.33Å; S686-I688 PolarHBondContact O-N 3.28Å; S686-I688 VanDerWaalsContact O-N 3.14Å; I688-K690 PolarHBondContact O-N 3.21Å
689	P	27.2	Very low	27.2	Very low	100 Å²	100	146 Å²	146	65%	0.649	78%	0.783	S	S	*	*			trans	-73.3	109.8	-172.2	26.9	-31.3	0	0	0	110.3	H691	P689-H691 PolarHBondContact O-N 3.31Å; P689-H691 VanDerWaalsContact O-N 3.17Å
690	K	29.3	Very low	26.9	Very low	201 Å²	201	153.1 Å²	153.1	87%	0.874	79%	0.793	S	S	*	*			trans	-75.5	104.1	167.4	-77.2	-173.7	178.1	178.7	0	109.1	I688 S692	I688-K690 PolarHBondContact O-N 3.21Å; K690-S692 PolarHBondContact O-N 3.13Å
691	H	25.8	Very low	27	Very low	162 Å²	162	154.1 Å²	154.1	75%	0.75	80%	0.8	S	S	*	*			trans	-43.8	116.6	165.1	-63.3	-84.8	0	0	0	112	P689	P689-H691 PolarHBondContact O-N 3.31Å; P689-H691 VanDerWaalsContact O-N 3.17Å
692	S	29.1	Very low	26.7	Very low	110 Å²	110	155.3 Å²	155.3	77%	0.769	80%	0.8	S	S	*	*			trans	-115.6	103.5	150.4	57.1	0	0	0	0	108.4	K690 T694	K690-S692 PolarHBondContact O-N 3.13Å; S692-T694 PolarHBondContact O-N 3.36Å
693	N	25.5	Very low	26.7	Very low	142 Å²	142	150.1 Å²	150.1	76%	0.759	79%	0.793	S	S	*	*			trans	-75.8	99.4	174.8	-71.7	-37.6	0	0	0	109.2
694	T	28.3	Very low	26.7	Very low	109 Å²	109	153.3 Å²	153.3	67%	0.669	79%	0.793	S	S	*	*			trans	-140.4	101.6	158.2	33.4	0	0	0	0	110.4	S692 I696	S692-T694 PolarHBondContact O-N 3.36Å; T694-I696 PolarHBondContact O-N 2.8Å
695	P	27.4	Very low	26.5	Very low	125 Å²	125	152 Å²	152	81%	0.812	80%	0.795	S	S	*	*			trans	-80.9	94.1	173.2	30.9	-28.7	0	0	0	108.9	K697	P695-K697 PolarHBondContact O-N 3.19Å
696	I	28.6	Very low	26.4	Very low	159 Å²	159	156.4 Å²	156.4	82%	0.815	81%	0.805	S	S	*	*			trans	-84.9	107.8	175.7	-60.7	179.4	0	0	0	109.3	T694	T694-I696 PolarHBondContact O-N 2.8Å
697	K	27.3	Very low	26.5	Very low	191 Å²	191	154.9 Å²	154.9	83%	0.83	81%	0.806	S	S	*	*			trans	-56.2	144.3	175.1	-74.7	172	173.5	173.8	0	112.6	P695 G699	P695-K697 PolarHBondContact O-N 3.19Å; K697-G699 PolarHBondContact O-N 3.41Å
698	R	22.7	Very low	26.2	Very low	254 Å²	254	153.6 Å²	153.6	96%	0.958	81%	0.806	S	S	*	*			trans	-20.9	114.7	159.5	-64.1	175.3	-177.9	167.6	0.3	114.5
699	G	25	Very low	26.1	Very low	73 Å²	73	152.4 Å²	152.4	75%	0.753	81%	0.81	S	S	*	*			trans	-117.6	97.4	162.2	0	0	0	0	0	110.4	K697 S701	K697-G699 PolarHBondContact O-N 3.41Å; G699-S701 PolarHBondContact O-N 3.26Å
700	R	22.3	Very low	26	Very low	255 Å²	255	158.4 Å²	158.4	96%	0.962	82%	0.819	S	S	*	*			trans	-65.5	111.3	159.4	-86.3	179.4	174.9	177.1	-2.2	106.9
701	S	27.7	Very low	25.8	Very low	120 Å²	120	154.5 Å²	154.5	84%	0.839	81%	0.812	S	S	*	*			trans	-110.8	109.5	159.5	55.9	0	0	0	0	108.6	G699	G699-S701 PolarHBondContact O-N 3.26Å
702	L	25.5	Very low	25.8	Very low	148 Å²	148	154.1 Å²	154.1	78%	0.775	82%	0.815	S	S	*	*			trans	-79.5	152.5	168.7	-145.7	82.7	0	0	0	107.9
703	T	25	Very low	25.6	Very low	121 Å²	121	155.1 Å²	155.1	74%	0.742	81%	0.811	S	S	*	*			trans	64.9	106.3	155	48.7	0	0	0	0	119.2
704	R	28.2	Very low	25.6	Very low	244 Å²	244	157 Å²	157	92%	0.921	82%	0.816	S	S	*	*				-153.1	107.1	127.7	-114.4	178.3	-174.8	-143.2	1.5	111.7
705	S	23.9	Very low	25.4	Very low	110 Å²	110	162.4 Å²	162.4	77%	0.769	82%	0.824	S	S	*	*			trans	-57.1	130	159.8	52.1	0	0	0	0	111.6
706	R	25.3	Very low	25.3	Very low	253 Å²	253	163.8 Å²	163.8	96%	0.955	82%	0.824	S	S	*	*			trans	177.9	111.8	145.4	-105.9	173.5	176.7	-176.9	-1.1	108.7
707	G	25.8	Very low	25.3	Very low	77 Å²	77	162.9 Å²	162.9	79%	0.794	82%	0.82	S	S	*	*			trans	169.3	67.8	179	0	0	0	0	0	111
708	T	25	Very low	25.3	Very low	135 Å²	135	158.8 Å²	158.8	83%	0.828	81%	0.813	S	S	*	*			trans	-32.3	129.3	175.6	42.3	0	0	0	0	116.2	R710	T708-R710 PolarHBondContact O-N 3.22Å; T708-R710 VanDerWaalsContact O-N 3.15Å
709	S	22.6	Very low	25.5	Very low	111 Å²	111	152.3 Å²	152.3	78%	0.776	80%	0.798	S	S	*	*			trans	-45.1	111.5	156	-66.4	0	0	0	0	111.4
710	R	26	Very low	25.6	Very low	227 Å²	227	154.3 Å²	154.3	86%	0.857	80%	0.796	S	S	*	*			trans	-99.3	93.3	146.8	-98.1	-175.5	179.7	177.4	0.8	107.3	T708 L712	T708-R710 PolarHBondContact O-N 3.22Å; T708-R710 VanDerWaalsContact O-N 3.15Å; R710-L712 PolarHBondContact O-N 2.93Å
711	V	24.5	Very low	25.7	Very low	118 Å²	118	151.2 Å²	151.2	72%	0.715	79%	0.785	S	S	*	*			trans	-62.7	91.1	158.9	178.5	0	0	0	0	106.1
712	L	26.5	Very low	25.8	Very low	154 Å²	154	152.8 Å²	152.8	81%	0.806	78%	0.782	S	S	*	*			trans	-91.6	109.3	164.9	-105.9	155.7	0	0	0	106.5	R710	R710-L712 PolarHBondContact O-N 2.93Å
713	N	24.6	Very low	25.9	Very low	131 Å²	131	151.5 Å²	151.5	70%	0.701	78%	0.781	S	S	*	*			trans	-40.6	134.7	-173.2	-73.3	-49.3	0	0	0	113.8	R715	N713-R715 PolarHBondContact O-N 3.37Å
714	Q	24.8	Very low	25.9	Very low	183 Å²	183	151.5 Å²	151.5	86%	0.855	78%	0.783	S	S	*	*			trans	-53.2	89	156.7	-64.8	174.5	-0	0	0	108.6	N716	Q714-N716 PolarHBondContact O-N 3.38Å
715	R	24.4	Very low	25.9	Very low	222 Å²	222	145.1 Å²	145.1	84%	0.838	78%	0.776	S	S	*	*			trans	-82.9	107.2	158.2	-90.8	-174.9	-179.8	155.3	0.4	106.3	N713 L717	N713-R715 PolarHBondContact O-N 3.37Å; R715-L717 PolarHBondContact O-N 3.19Å
716	N	24.9	Very low	26	Very low	153 Å²	153	144.7 Å²	144.7	82%	0.818	77%	0.773	S	S	*	*			trans	-51.2	89.6	161.1	-66	-38	0	0	0	108.7	Q714 P718	Q714-N716 PolarHBondContact O-N 3.38Å; N716-P718 WeakPolarHBondContact O-CD 3.21Å
717	L	28.7	Very low	26.4	Very low	140 Å²	140	138.2 Å²	138.2	73%	0.733	76%	0.764	S	S	*	*			trans	-89.4	109.3	160	-87	150	0	0	0	105.2	R715 N719	R715-L717 PolarHBondContact O-N 3.19Å; L717-N719 PolarHBondContact O-N 3.39Å
718	P	28.5	Very low	26.7	Very low	105 Å²	105	143.5 Å²	143.5	68%	0.682	77%	0.765	S	S	*	*			trans	-59.5	109.7	166.3	24	-29.1	0	0	0	106.2	N716 T720	N716-P718 WeakPolarHBondContact O-CD 3.21Å; P718-T720 PolarHBondContact O-N 2.96Å; P718-T720 PolarHBondContact O-OG1 3.48Å
719	N	26.9	Very low	27	Very low	118 Å²	118	142.1 Å²	142.1	63%	0.631	76%	0.758	S	S	*	*			trans	-65.9	86.8	164.9	-81.8	-10	0	0	0	106.4	L717 Y721	L717-N719 PolarHBondContact O-N 3.39Å; N719-Y721 HydrophobicContact CB-CD2 3.94Å; N719-Y721 HydrophobicContact CB-CE2 3.63Å; N719-Y721 WeakPolarHBondContact O-CD2 3.28Å; N719-Y721 PolarHBondContact O-N 3.38Å
720	T	26.4	Very low	27.5	Very low	116 Å²	116	142.9 Å²	142.9	71%	0.712	76%	0.76	S	S	*	*			trans	-64.8	86.2	161.1	-36.7	0	0	0	0	105.4	P718 I722	P718-T720 PolarHBondContact O-N 2.96Å; P718-T720 PolarHBondContact O-OG1 3.48Å; T720-I722 VanDerWaalsContact C-N 3.34Å; T720-I722 PolarHBondContact O-N 3.35Å
721	Y	25.2	Very low	27.7	Very low	190 Å²	190	137.5 Å²	137.5	75%	0.745	75%	0.753	S	S	*	*			trans	-63.3	105.1	163.7	-75.8	-84.5	0	0	0	106.1	N719 T723	N719-Y721 HydrophobicContact CB-CD2 3.94Å; N719-Y721 HydrophobicContact CB-CE2 3.63Å; N719-Y721 WeakPolarHBondContact O-CD2 3.28Å; N719-Y721 PolarHBondContact O-N 3.38Å; Y721-T723 PolarHBondContact O-N 3.27Å
722	I	28.6	Very low	27.9	Very low	152 Å²	152	137.5 Å²	137.5	78%	0.779	76%	0.756	S	S	*	*			trans	-67.3	93.3	165.6	-59.8	170.7	0	0	0	104.6	T720 P724	T720-I722 VanDerWaalsContact C-N 3.34Å; T720-I722 PolarHBondContact O-N 3.35Å; I722-P724 WeakPolarHBondContact O-CD 3.25Å
723	T	27.3	Very low	28	Very low	122 Å²	122	135.3 Å²	135.3	75%	0.748	75%	0.748	S	S	*	*			trans	-57.9	119.2	163.5	21.7	0	0	0	0	107	Y721 S725	Y721-T723 PolarHBondContact O-N 3.27Å; T723-S725 PolarHBondContact O-N 3.05Å
724	P	26	Very low	28	Very low	120 Å²	120	139 Å²	139	78%	0.779	75%	0.752	S	S	*	*			trans	-61.3	112.3	175.1	23.8	-29.7	0	0	0	107.6	I722 S726	I722-P724 WeakPolarHBondContact O-CD 3.25Å; P724-S726 PolarHBondContact O-N 3.33Å; P724-S726 VanDerWaalsContact O-N 3.17Å
725	S	27.1	Very low	28.1	Very low	111 Å²	111	137.7 Å²	137.7	78%	0.776	74%	0.744	S	S	*	*			trans	-59.9	119.1	171.5	52.4	0	0	0	0	108.2	T723	T723-S725 PolarHBondContact O-N 3.05Å
726	S	26.4	Very low	28.2	Very low	101 Å²	101	133.6 Å²	133.6	71%	0.706	73%	0.734	S	S	*	*			trans	-44.8	137.4	166.9	176.9	0	0	0	0	110.2	P724 K728	P724-S726 PolarHBondContact O-N 3.33Å; P724-S726 VanDerWaalsContact O-N 3.17Å; S726-K728 PolarHBondContact O-N 2.96Å
727	P	34.4	Very low	28.2	Very low	117 Å²	117	136.2 Å²	136.2	76%	0.76	73%	0.734	S	S	*	*			trans	-57.9	115.4	-175.9	22.8	-32.3	0	0	0	109.7
728	K	32.2	Very low	28.2	Very low	187 Å²	187	136.5 Å²	136.5	81%	0.813	74%	0.736	S	S	*	*			trans	-56.2	134	169.8	-86.6	176.1	176.2	172.3	0	108.3	S726	S726-K728 PolarHBondContact O-N 2.96Å
729	P	31.7	Very low	27.9	Very low	107 Å²	107	134.7 Å²	134.7	70%	0.695	74%	0.737	S	S	*	*			trans	-54.8	144.5	172.9	22.5	-31.5	0	0	0	109.3	T731	P729-T731 PolarHBondContact O-N 2.7Å
730	P	32.9	Very low	27.8	Very low	126 Å²	126	140.6 Å²	140.6	82%	0.818	75%	0.75	S	S	*	*			trans	-56.1	112.5	-176.1	20.7	-30.5	0	0	0	109.1
731	T	29.9	Very low	27.9	Very low	115 Å²	115	141.8 Å²	141.8	71%	0.706	75%	0.751	S	S	*	*			trans	-63	127.2	174.1	-40.6	0	0	0	0	106.1	P729 V733	P729-T731 PolarHBondContact O-N 2.7Å; T731-V733 PolarHBondContact O-N 2.82Å
732	P	29.6	Very low	27.8	Very low	118 Å²	118	136.3 Å²	136.3	77%	0.766	75%	0.753	S	S	*	*			trans	-54.4	115.7	-176.8	17.9	-30	0	0	0	108.9	R734	P732-R734 VanDerWaalsContact C-N 3.35Å; P732-R734 PolarHBondContact O-N 3.25Å
733	V	28	Very low	27.8	Very low	107 Å²	107	138 Å²	138	65%	0.648	75%	0.754	S	S	*	*			trans	-61.6	104.3	175.6	175.3	0	0	0	0	105.9	T731 F735	T731-V733 PolarHBondContact O-N 2.82Å; V733-F735 HydrophobicContact CB-CD2 4.44Å; V733-F735 HydrophobicContact CB-CE2 4.13Å; V733-F735 HydrophobicContact CG1-CD2 4.16Å; V733-F735 HydrophobicContact CG1-CE1 4.36Å; V733-F735 HydrophobicContact CG1-CE2 3.97Å; V733-F735 HydrophobicContact CG1-CG 4.46Å; V733-F735 HydrophobicContact CG1-CZ 4.07Å; V733-F735 WeakPolarHBondContact O-CD2 3.46Å; V733-F735 PolarHBondContact O-N 2.88Å
734	R	24.1	Very low	27.9	Very low	208 Å²	208	138.1 Å²	138.1	79%	0.785	76%	0.755	S	S	*	*			trans	-64.6	89.8	172.9	-158.4	-178	-159.8	-168.5	6.1	106	P732 H736	P732-R734 VanDerWaalsContact C-N 3.35Å; P732-R734 PolarHBondContact O-N 3.25Å; R734-H736 PolarHBondContact O-N 2.96Å
735	F	26.9	Very low	28	Very low	157 Å²	157	137.3 Å²	137.3	69%	0.689	76%	0.759	S	S	*	*			trans	-64.4	95.7	170.6	-77.4	-80.6	0	0	0	107.1	V733 Y737	V733-F735 HydrophobicContact CB-CD2 4.44Å; V733-F735 HydrophobicContact CB-CE2 4.13Å; V733-F735 HydrophobicContact CG1-CD2 4.16Å; V733-F735 HydrophobicContact CG1-CE1 4.36Å; V733-F735 HydrophobicContact CG1-CE2 3.97Å; V733-F735 HydrophobicContact CG1-CG 4.46Å; V733-F735 HydrophobicContact CG1-CZ 4.07Å; V733-F735 WeakPolarHBondContact O-CD2 3.46Å; V733-F735 PolarHBondContact O-N 2.88Å; F735-Y737 HydrophobicContact CB-CD2 3.84Å; F735-Y737 HydrophobicContact CB-CE2 3.92Å; F735-Y737 HydrophobicContact CD1-CE2 4.46Å; F735-Y737 HydrophobicContact CG-CE2 4.36Å; F735-Y737 PolarHBondContact O-N 3.05Å
736	H	25.7	Very low	28.1	Very low	136 Å²	136	143.4 Å²	143.4	63%	0.63	77%	0.765	S	S	*	*			trans	-63.6	84.2	159.5	-79.2	-83.6	0	0	0	107	R734 N738	R734-H736 PolarHBondContact O-N 2.96Å; H736-N738 PolarHBondContact O-N 3.45Å
737	Y	25.9	Very low	28	Very low	208 Å²	208	142 Å²	142	82%	0.816	77%	0.766	S	S	*	*			trans	-69.7	89.5	162.2	-91.1	-86.9	0	0	0	107.1	F735 G739	F735-Y737 HydrophobicContact CB-CD2 3.84Å; F735-Y737 HydrophobicContact CB-CE2 3.92Å; F735-Y737 HydrophobicContact CD1-CE2 4.46Å; F735-Y737 HydrophobicContact CG-CE2 4.36Å; F735-Y737 PolarHBondContact O-N 3.05Å; Y737-G739 PolarHBondContact O-N 2.87Å; Y737-G739 VanDerWaalsContact O-N 3.09Å
738	N	28	Very low	27.6	Very low	145 Å²	145	141.1 Å²	141.1	78%	0.775	77%	0.769	S	S	*	*			trans	-56.3	113	161.6	-79.5	-21.2	0	0	0	107.3	H736	H736-N738 PolarHBondContact O-N 3.45Å
739	G	23.6	Very low	27.3	Very low	68 Å²	68	143 Å²	143	70%	0.701	77%	0.771	S	S	*	*			trans	-58	148.1	176	0	0	0	0	0	111.8	Y737	Y737-G739 PolarHBondContact O-N 2.87Å; Y737-G739 VanDerWaalsContact O-N 3.09Å
740	R	24.6	Very low	27.2	Very low	241 Å²	241	146 Å²	146	91%	0.909	78%	0.781	S	S	*	*			trans	111.5	92.8	173.1	-71.5	-177.9	178.8	-160.7	0.7	111.2
741	I	27	Very low	27	Very low	141 Å²	141	147.2 Å²	147.2	72%	0.723	78%	0.779	S	S	*	*				-160.7	103.5	128	-90.3	140	0	0	0	104.2	F743	I741-F743 HydrophobicContact CG2-CD2 3.21Å; I741-F743 HydrophobicContact CG2-CE2 3.17Å; I741-F743 HydrophobicContact CG2-CG 4.32Å; I741-F743 HydrophobicContact CG2-CZ 4.26Å; I741-F743 PolarHBondContact O-N 3.22Å
742	G	24.5	Very low	26.8	Very low	76 Å²	76	147.5 Å²	147.5	78%	0.784	79%	0.786	S	S	*	*			trans	-71.6	116	169.6	0	0	0	0	0	108.1
743	F	29.1	Very low	26.7	Very low	186 Å²	186	145 Å²	145	82%	0.816	78%	0.781	S	S	*	*			trans	-117	101.4	155.8	-79.7	-68.8	0	0	0	107.3	I741 A745	I741-F743 HydrophobicContact CG2-CD2 3.21Å; I741-F743 HydrophobicContact CG2-CE2 3.17Å; I741-F743 HydrophobicContact CG2-CG 4.32Å; I741-F743 HydrophobicContact CG2-CZ 4.26Å; I741-F743 PolarHBondContact O-N 3.22Å; F743-A745 PolarHBondContact O-N 3.36Å
744	T	28.8	Very low	26.6	Very low	125 Å²	125	148.4 Å²	148.4	77%	0.767	80%	0.796	S	S	*	*			trans	-40.2	128.4	165.8	44.7	0	0	0	0	110.8	R746	T744-R746 PolarHBondContact O-N 2.77Å
745	A	28.2	Very low	26.9	Very low	103 Å²	103	148.8 Å²	148.8	85%	0.851	80%	0.797	S	S	*	*			trans	-46.3	109.5	164.2	0	0	0	0	0	108.5	F743 G747	F743-A745 PolarHBondContact O-N 3.36Å; A745-G747 PolarHBondContact O-N 3.44Å
746	R	28.8	Very low	26.7	Very low	240 Å²	240	152.7 Å²	152.7	91%	0.906	81%	0.807	S	S	*	*			trans	-63.9	104.3	170.1	-91.5	-174.3	176.5	-167.1	0.6	106.4	T744 A748	T744-R746 PolarHBondContact O-N 2.77Å; R746-A748 PolarHBondContact O-N 3.28Å
747	G	23.9	Very low	26.9	Very low	70 Å²	70	154.4 Å²	154.4	72%	0.722	82%	0.816	S	S	*	*			trans	-53.3	112.1	160.4	0	0	0	0	0	108.5	A745 R749	A745-G747 PolarHBondContact O-N 3.44Å; G747-R749 PolarHBondContact O-N 2.97Å
748	A	27	Very low	26.9	Very low	100 Å²	100	152.4 Å²	152.4	83%	0.826	81%	0.814	S	S	*	*			trans	-70.4	112.4	162.8	0	0	0	0	0	106.6	R746	R746-A748 PolarHBondContact O-N 3.28Å
749	R	25.8	Very low	26.7	Very low	227 Å²	227	150.6 Å²	150.6	86%	0.857	81%	0.808	S	S	*	*			trans	-56.1	137.5	-177.7	-74.6	172.8	179.8	164.1	-1.1	111.7	G747 I751	G747-R749 PolarHBondContact O-N 2.97Å; R749-I751 PolarHBondContact O-N 3.44Å
750	N	28.5	Very low	27	Very low	168 Å²	168	156.8 Å²	156.8	90%	0.898	82%	0.816	S	S	*	*			trans	-57.2	105.2	155.6	-66.3	-37.1	0	0	0	108.7	S752	N750-S752 PolarHBondContact O-N 3.12Å
751	I	29.2	Very low	27.2	Very low	153 Å²	153	152.6 Å²	152.6	79%	0.785	81%	0.81	S	S	*	*			trans	-85.9	99.2	169.9	-46.9	176.5	0	0	0	106.3	R749 G753	R749-I751 PolarHBondContact O-N 3.44Å; I751-G753 PolarHBondContact O-N 3.43Å
752	S	26.5	Very low	27.3	Very low	121 Å²	121	152 Å²	152	85%	0.846	81%	0.812	S	S	*	*			trans	-67.9	111.6	162.7	69.5	0	0	0	0	107.9	N750	N750-S752 PolarHBondContact O-N 3.12Å
753	G	26.9	Very low	27.4	Very low	65 Å²	65	156.6 Å²	156.6	67%	0.67	81%	0.813	S	S	*	*			trans	-139.8	65.9	-177.4	0	0	0	0	0	111.3	I751 R755	I751-G753 PolarHBondContact O-N 3.43Å; G753-R755 PolarHBondContact O-N 3.44Å
754	N	26.5	Very low	27.2	Very low	178 Å²	178	157.3 Å²	157.3	95%	0.952	82%	0.816	S	S	*	*			trans	-58.7	98.5	159.5	-93	-25.5	0	0	0	108.7
755	R	28.9	Very low	27.2	Very low	216 Å²	216	156.8 Å²	156.8	82%	0.815	82%	0.815	S	S	*	*			trans	-141.4	90.3	159.7	-155.7	173.4	-160.7	179.6	5	110	G753 Q757	G753-R755 PolarHBondContact O-N 3.44Å; R755-Q757 PolarHBondContact O-N 3.36Å
756	R	23	Very low	27.1	Very low	239 Å²	239	157 Å²	157	90%	0.902	81%	0.81	S	S	*	*			trans	-46.2	116.3	160	-72.9	174.5	171.8	175.1	-3.6	109
757	Q	30.5	Very low	27.1	Very low	173 Å²	173	152.1 Å²	152.1	81%	0.808	81%	0.807	S	S	*	*			trans	-121.4	124.8	147.4	-72.8	-160.8	-5.5	0	0	107.7	R755	R755-Q757 PolarHBondContact O-N 3.36Å
758	Q	26	Very low	27.4	Very low	166 Å²	166	153.2 Å²	153.2	78%	0.776	80%	0.799	S	S	*	*			trans	-77.4	143.4	-171.2	-64.2	173.9	-17.3	0	0	110.6
759	T	23.3	Very low	27.3	Very low	107 Å²	107	153.8 Å²	153.8	66%	0.656	80%	0.797	S	S	*	*			trans	48.2	107.9	137.8	57.6	0	0	0	0	119.2
760	K	30	Very low	27.4	Very low	198 Å²	198	150.8 Å²	150.8	86%	0.861	79%	0.793	S	S	*	*				-132.8	95.8	123.1	-79.2	-170.4	179.2	177.7	0	108.7	V762	K760-V762 PolarHBondContact O-N 3.06Å; K760-V762 VanDerWaalsContact O-N 3.12Å
761	I	27.9	Very low	27.4	Very low	152 Å²	152	148 Å²	148	78%	0.779	79%	0.786	S	S	*	*			trans	-70.3	97.6	165.7	-64.1	164.9	0	0	0	105.4
762	V	30.4	Very low	27.1	Very low	128 Å²	128	148.8 Å²	148.8	78%	0.776	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-92	118.9	166.5	178.4	0	0	0	0	106.5	K760	K760-V762 PolarHBondContact O-N 3.06Å; K760-V762 VanDerWaalsContact O-N 3.12Å
763	Q	26.8	Very low	27.4	Very low	173 Å²	173	148.1 Å²	148.1	81%	0.808	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-54.8	130.3	-171.1	-70	164.8	-15.2	0	0	111.8
764	K	25.5	Very low	27.7	Very low	201 Å²	201	152.4 Å²	152.4	87%	0.874	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-62.4	126.7	162.8	-76.7	179.9	175.7	179.7	0	108.1	S766	K764-S766 PolarHBondContact O-N 3.46Å
765	P	27.2	Very low	27.8	Very low	115 Å²	115	151.1 Å²	151.1	75%	0.747	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-65.3	126.4	165	26.4	-29.2	0	0	0	108.2	V767	P765-V767 PolarHBondContact O-N 2.93Å
766	S	26.8	Very low	28	Very low	107 Å²	107	146.2 Å²	146.2	75%	0.748	77%	0.774	S	S	*	*			trans	-47.9	102.4	168.8	147.7	0	0	0	0	109.7	K764 V768	K764-S766 PolarHBondContact O-N 3.46Å; S766-V768 PolarHBondContact O-N 3.5Å
767	V	29.4	Very low	28.4	Very low	138 Å²	138	144.1 Å²	144.1	84%	0.836	77%	0.771	S	S	*	*			trans	-69.6	104	162.8	176.7	0	0	0	0	105.7	P765 S769	P765-V767 PolarHBondContact O-N 2.93Å; V767-S769 PolarHBondContact O-N 3.44Å; V767-S769 VanDerWaalsContact O-N 3.17Å
768	V	30.1	Very low	28.4	Very low	92 Å²	92	144.2 Å²	144.2	56%	0.558	77%	0.772	S	S	*	*			trans	-45.2	118.9	172.9	171.6	0	0	0	0	108.4	S766 H770	S766-V768 PolarHBondContact O-N 3.5Å; V768-H770 PolarHBondContact O-N 3.14Å; V768-H770 PolarHBondContact O-ND1 3.23Å
769	S	25.1	Very low	28.7	Very low	112 Å²	112	144 Å²	144	78%	0.783	78%	0.775	S	S	*	*			trans	-53.2	98.7	171.7	54	0	0	0	0	109.1	V767 S771	V767-S769 PolarHBondContact O-N 3.44Å; V767-S769 VanDerWaalsContact O-N 3.17Å; S769-S771 PolarHBondContact O-N 3.33Å
770	H	26.5	Very low	29.2	Very low	165 Å²	165	143.6 Å²	143.6	76%	0.764	77%	0.773	S	S	*	*			trans	-74.5	121.9	166	-74.7	48.4	0	0	0	106.3	V768 H772	V768-H770 PolarHBondContact O-N 3.14Å; V768-H770 PolarHBondContact O-ND1 3.23Å; H770-H772 PolarHBondContact O-N 3.03Å
771	S	28	Very low	29.2	Very low	108 Å²	108	144.2 Å²	144.2	76%	0.755	77%	0.771	S	S	*	*			trans	-45.3	130	175.1	43.9	0	0	0	0	110.5	S769 P773	S769-S771 PolarHBondContact O-N 3.33Å; S771-P773 WeakPolarHBondContact O-CD 3.43Å; S771-P773 VanDerWaalsContact O-N 3.14Å
772	H	24.6	Very low	29.5	Very low	171 Å²	171	144 Å²	144	79%	0.792	77%	0.766	S	S	*	*			trans	-43	116.4	173.9	-139.7	-51.8	0	0	0	109.6	H770 D774	H770-H772 PolarHBondContact O-N 3.03Å; H772-D774 PolarHBondContact O-N 3.36Å
773	P	31.3	Very low	29.8	Very low	107 Å²	107	144.2 Å²	144.2	70%	0.695	76%	0.763	S	S	*	*			trans	-63.4	136.9	168.4	26.2	-29.4	0	0	0	107	S771 I775	S771-P773 WeakPolarHBondContact O-CD 3.43Å; S771-P773 VanDerWaalsContact O-N 3.14Å; P773-I775 PolarHBondContact O-N 3.34Å
774	D	33.5	Very low	30.3	Very low	155 Å²	155	143.1 Å²	143.1	83%	0.829	76%	0.763	S	S	*	*			trans	-39.7	131.7	-176.4	-65	-57.3	0	0	0	112	H772 P776	H772-D774 PolarHBondContact O-N 3.36Å; D774-P776 VanDerWaalsContact O-N 3.11Å
775	I	29.6	Very low	30.8	Very low	150 Å²	150	141 Å²	141	77%	0.769	76%	0.761	S	S	*	*			trans	-39.6	120.4	171.4	-66.5	160.7	0	0	0	107.7	P773 K777	P773-I775 PolarHBondContact O-N 3.34Å; I775-K777 PolarHBondContact O-N 2.84Å
776	P	32.3	Very low	31	Very low	114 Å²	114	144.1 Å²	144.1	74%	0.74	77%	0.765	S	S	*	*			trans	-54.1	119.9	179	19.5	-28.9	0	0	0	107	D774 H778	D774-P776 VanDerWaalsContact O-N 3.11Å; P776-H778 PolarHBondContact O-N 2.88Å
777	K	31.6	Very low	31.3	Very low	194 Å²	194	143.9 Å²	143.9	84%	0.843	76%	0.759	S	S	*	*			trans	-38.1	118.5	177.2	-70.8	175.1	179.7	175.8	0	107.3	I775 L779	I775-K777 PolarHBondContact O-N 2.84Å; K777-L779 VanDerWaalsContact C-N 3.27Å; K777-L779 PolarHBondContact O-N 3.31Å
778	H	30	Very low	31.5	Very low	176 Å²	176	142.7 Å²	142.7	82%	0.815	75%	0.753	S	S	*	*			trans	-38.2	95.9	174.7	-143.9	-91.4	0	0	0	107.5	P776 T780	P776-H778 PolarHBondContact O-N 2.88Å; H778-T780 PolarHBondContact O-N 3.46Å
779	L	33	Very low	31.7	Very low	160 Å²	160	143.1 Å²	143.1	84%	0.838	75%	0.751	S	S	*	*			trans	-67.2	99.7	167.4	-87.2	158.6	0	0	0	101.5	K777 Y781	K777-L779 VanDerWaalsContact C-N 3.27Å; K777-L779 PolarHBondContact O-N 3.31Å; L779-Y781 PolarHBondContact O-N 2.79Å
780	T	33.3	Very low	31.9	Very low	100 Å²	100	142.1 Å²	142.1	61%	0.613	74%	0.736	S	S	*	*			trans	-48.8	103.7	168.3	-45.3	0	0	0	0	104.6	H778 E782	H778-T780 PolarHBondContact O-N 3.46Å; T780-E782 PolarHBondContact O-N 2.87Å
781	Y	29.3	Very low	32.2	Very low	210 Å²	210	137.6 Å²	137.6	82%	0.824	72%	0.723	S	S	*	*			trans	-67	86.7	171.1	-148.3	-93	0	0	0	102.5	L779 D783	L779-Y781 PolarHBondContact O-N 2.79Å; Y781-D783 PolarHBondContact O-N 3.48Å
782	E	34.2	Very low	32.5	Very low	147 Å²	147	137.9 Å²	137.9	69%	0.687	72%	0.716	S	S	*	*			trans	-59.2	103.4	165.9	-75.3	-69.5	149.8	0	0	103.3	T780 D784	T780-E782 PolarHBondContact O-N 2.87Å; E782-D784 PolarHBondContact O-N 3.38Å
783	D	37.3	Very low	32.7	Very low	133 Å²	133	140.4 Å²	140.4	71%	0.711	72%	0.719	S	S	*	*			trans	-50.4	98.4	168.9	-112	-21.2	0	0	0	105.2	Y781 L785	Y781-D783 PolarHBondContact O-N 3.48Å; D783-L785 PolarHBondContact O-N 3.41Å
784	D	38	Very low	32.9	Very low	150 Å²	150	137.2 Å²	137.2	80%	0.802	70%	0.699	S	S	*	*			trans	-54.3	98	167	-89.1	-28.8	0	0	0	104.5	E782 Q786	E782-D784 PolarHBondContact O-N 3.38Å; D784-Q786 VanDerWaalsContact C-N 3.26Å; D784-Q786 PolarHBondContact O-N 3.09Å
785	L	35	Very low	33.1	Very low	157 Å²	157	134 Å²	134	82%	0.822	68%	0.682	S	S	*	*			trans	-49.1	95.9	-179.5	-87.5	139.8	0	0	0	107.1	D783 T787	D783-L785 PolarHBondContact O-N 3.41Å; L785-T787 PolarHBondContact O-N 3.29Å
786	Q	32.9	Very low	33.5	Very low	180 Å²	180	135.2 Å²	135.2	84%	0.841	68%	0.684	S	S	*	*			trans	-66.9	80.4	170.7	-71	-173.3	-0.4	0	0	105.9	D784 T788	D784-Q786 VanDerWaalsContact C-N 3.26Å; D784-Q786 PolarHBondContact O-N 3.09Å; Q786-T788 PolarHBondContact O-N 2.79Å
787	T	32.8	Very low	33.4	Very low	103 Å²	103	131.9 Å²	131.9	63%	0.632	66%	0.663	S	S	*	*			trans	-63.9	97	159.5	41.4	0	0	0	0	104.4	L785 I789	L785-T787 PolarHBondContact O-N 3.29Å; T787-I789 PolarHBondContact O-N 3.26Å
788	T	33.2	Very low	33.4	Very low	113 Å²	113	130.3 Å²	130.3	69%	0.693	66%	0.664	S	S	*	*			trans	-65.7	83	168.6	-54.3	0	0	0	0	105.5	Q786 L790	Q786-T788 PolarHBondContact O-N 2.79Å; T788-L790 VanDerWaalsContact C-N 3.33Å; T788-L790 PolarHBondContact O-N 3.48Å
789	I	33.7	Very low	33.7	Very low	100 Å²	100	125.3 Å²	125.3	51%	0.513	65%	0.646	S	S	.	*			trans	-72.7	97.9	175	-61.6	172.5	0	0	0	104.9	T787 S791	T787-I789 PolarHBondContact O-N 3.26Å; I789-S791 VanDerWaalsContact C-N 3.33Å; I789-S791 PolarHBondContact O-N 2.88Å
790	L	30.1	Very low	33.7	Very low	91 Å²	91	125.8 Å²	125.8	48%	0.476	64%	0.636	S	S	.	*			trans	-56.5	101	165.5	-74	162.2	0	0	0	106.9	T788	T788-L790 VanDerWaalsContact C-N 3.33Å; T788-L790 PolarHBondContact O-N 3.48Å
791	S	32	Very low	33.5	Very low	70 Å²	70	129.7 Å²	129.7	49%	0.49	64%	0.64	S	S	.	*			trans	-58.5	142.2	171.9	-36.2	0	0	0	0	108.2	I789 W793 S794	I789-S791 VanDerWaalsContact C-N 3.33Å; I789-S791 PolarHBondContact O-N 2.88Å; S791-W793 PolarHBondContact O-N 2.96Å; S791-S794 WeakPolarHBondContact O-CB 3.15Å; S791-S794 PolarHBondContact O-N 3.35Å
792	D	34.1	Very low	33.9	Very low	115 Å²	115	126.4 Å²	126.4	62%	0.615	64%	0.635	S	S	*	*	T	Hydrogen-bonded Turn	trans	-55.9	-22.9	-179	-64.4	-32.6	0	0	0	112.9	S794 L795 E796	D792-S794 PolarHBondContact O-N 2.94Å; D792-L795 PolarHBondContact O-N 3.3Å; D792-E796 PolarHBondContact O-N 3.12Å
793	W	29.6	Very low	34	Very low	223 Å²	223	126.3 Å²	126.3	85%	0.845	64%	0.639	S	S	*	*	H	α-helix	trans	-60.8	-24.6	171.9	-67.4	67.1	0	0	0	113.8	S791 S797	S791-W793 PolarHBondContact O-N 2.96Å; W793-S797 WeakPolarHBondContact O-CB 3.31Å; W793-S797 PolarHBondContact O-N 3.01Å; W793-S797 PolarHBondContact O-OG 3.06Å
794	S	36.2	Very low	33.8	Very low	41 Å²	41	126.7 Å²	126.7	29%	0.287	63%	0.631	S	S	.	*	H	α-helix	trans	-86.5	-10.4	175.7	-66.8	0	0	0	0	113.9	S791 D792	S791-S794 WeakPolarHBondContact O-CB 3.15Å; S791-S794 PolarHBondContact O-N 3.35Å; D792-S794 PolarHBondContact O-N 2.94Å
795	L	36.4	Very low	33.3	Very low	88 Å²	88	122.2 Å²	122.2	46%	0.461	62%	0.62	S	S	.	*	H	α-helix	trans	-91	-36.9	175.8	-70.6	174.2	0	0	0	112.1	D792	D792-L795 PolarHBondContact O-N 3.3Å
796	E	38.5	Very low	33.4	Very low	175 Å²	175	119 Å²	119	82%	0.818	60%	0.604	S	S	*	*	H	α-helix	trans	-80.4	-26.9	174.8	-105.6	90.1	-145.1	0	0	113.4	D792	D792-E796 PolarHBondContact O-N 3.12Å
797	S	30.6	Very low	33.7	Very low	44 Å²	44	114.7 Å²	114.7	31%	0.308	58%	0.584	S	S	.	*	S	Bend	trans	-83.2	136	172.8	66.8	0	0	0	0	109.3	W793 V799	W793-S797 WeakPolarHBondContact O-CB 3.31Å; W793-S797 PolarHBondContact O-N 3.01Å; W793-S797 PolarHBondContact O-OG 3.06Å; S797-V799 PolarHBondContact O-N 3.05Å; S797-V799 VanDerWaalsContact OG-CG2 3.23Å; S797-V799 WeakPolarHBondContact OG-CG2 3.45Å
798	N	32.3	Very low	34	Very low	160 Å²	160	117.7 Å²	117.7	86%	0.856	59%	0.591	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.2	21.2	174.5	-91.1	-29.4	0	0	0	114.1	R800 R801	N798-R800 PolarHBondContact O-N 3.49Å; N798-R801 PolarHBondContact O-N 3.43Å
799	V	35.1	Very low	34.2	Very low	71 Å²	71	118.9 Å²	118.9	43%	0.43	59%	0.593	S	S	.	*	T	Hydrogen-bonded Turn	trans	-72	-6.9	-178.2	-178.4	0	0	0	0	112.3	S797 R801 I802	S797-V799 PolarHBondContact O-N 3.05Å; S797-V799 VanDerWaalsContact OG-CG2 3.23Å; S797-V799 WeakPolarHBondContact OG-CG2 3.45Å; V799-R801 PolarHBondContact O-N 3.4Å; V799-I802 PolarHBondContact O-N 3.48Å
800	R	32.5	Very low	34.1	Very low	170 Å²	170	123.7 Å²	123.7	64%	0.642	60%	0.604	S	S	*	*	H	α-helix	trans	-53.3	-20.9	164.7	-82.7	-167.2	178.1	-156.7	0.7	113.5	N798 I802	N798-R800 PolarHBondContact O-N 3.49Å; R800-I802 PolarHBondContact O-N 3.41Å
801	R	30.6	Very low	34.2	Very low	182 Å²	182	127.2 Å²	127.2	69%	0.687	62%	0.616	S	S	*	*	H	α-helix	trans	-76.9	-15.2	-176.6	-132.5	179	-158.4	176.3	6.6	116	N798 V799	N798-R801 PolarHBondContact O-N 3.43Å; V799-R801 PolarHBondContact O-N 3.4Å
802	I	37.6	Very low	33.9	Very low	142 Å²	142	134 Å²	134	73%	0.728	63%	0.631	S	S	*	*	H	α-helix	trans	-98.4	-35.6	-172.4	-57.2	178.9	0	0	0	112.2	V799 R800	V799-I802 PolarHBondContact O-N 3.48Å; R800-I802 PolarHBondContact O-N 3.41Å
803	L	36	Very low	33.6	Very low	145 Å²	145	132.8 Å²	132.8	76%	0.759	63%	0.632	S	S	*	*	H	α-helix	trans	-92	-21.6	-177.4	-69	172.7	0	0	0	113.6
804	Y	32.2	Very low	33.6	Very low	141 Å²	141	128 Å²	128	55%	0.553	63%	0.629	S	S	*	*	S	Bend	trans	-118.5	91.8	173.4	-57.8	-79.9	0	0	0	106.7	D806	Y804-D806 PolarHBondContact O-N 3.29Å
805	G	28.6	Very low	33.1	Very low	55 Å²	55	130.8 Å²	130.8	57%	0.567	65%	0.649	S	S	*	*			trans	-50	133.9	169.8	0	0	0	0	0	108.9	E807	G805-E807 PolarHBondContact O-N 3.4Å
806	D	37.1	Very low	32.5	Very low	89 Å²	89	136.7 Å²	136.7	48%	0.476	67%	0.665	S	S	.	*			trans	-35.4	105.2	-171.8	-83.4	-31.6	0	0	0	111.1	Y804 E808 D809	Y804-D806 PolarHBondContact O-N 3.29Å; D806-E808 PolarHBondContact O-N 3.17Å; D806-D809 PolarHBondContact O-N 2.73Å
807	E	39.5	Very low	31.9	Very low	90 Å²	90	136 Å²	136	42%	0.421	66%	0.661	S	S	.	*	T	Hydrogen-bonded Turn	trans	-61.2	-13.1	-179.3	-77.6	-76.9	149.8	0	0	112.1	G805 D809 R810 F811	G805-E807 PolarHBondContact O-N 3.4Å; E807-D809 PolarHBondContact O-N 3.34Å; E807-R810 PolarHBondContact O-N 3.34Å; E807-F811 WeakPolarHBondContact O-CD2 3.04Å; E807-F811 PolarHBondContact O-N 2.69Å
808	E	38.3	Very low	31.6	Very low	167 Å²	167	141.9 Å²	141.9	78%	0.78	68%	0.684	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.7	-28.1	170.2	-66.3	-69.1	151.1	0	0	112.5	D806	D806-E808 PolarHBondContact O-N 3.17Å
809	D	37	Very low	31.2	Very low	138 Å²	138	138.4 Å²	138.4	74%	0.738	67%	0.672	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85	-16	177	-81.5	-21.9	0	0	0	113.3	D806 E807	D806-D809 PolarHBondContact O-N 2.73Å; E807-D809 PolarHBondContact O-N 3.34Å
810	R	32.7	Very low	30.6	Very low	200 Å²	200	139 Å²	139	76%	0.755	69%	0.693	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.2	-20	176.3	-85.2	-174	178.5	-177.9	1.3	114.3	E807	E807-R810 PolarHBondContact O-N 3.34Å
811	F	31.7	Very low	30.2	Very low	165 Å²	165	136.3 Å²	136.3	72%	0.724	70%	0.7	S	S	*	*	S	Bend	trans	-91.8	7.1	173.7	-70.1	-70.6	0	0	0	114.8	E807 S813	E807-F811 WeakPolarHBondContact O-CD2 3.04Å; E807-F811 PolarHBondContact O-N 2.69Å; F811-S813 PolarHBondContact O-N 2.77Å
812	R	25.9	Very low	29.9	Very low	214 Å²	214	130.7 Å²	130.7	81%	0.808	70%	0.699	S	S	*	*			trans	-80.5	69.9	157.4	-140.6	178.3	-162	-166	5.1	109.1	P814	R812-P814 VanDerWaalsContact O-N 3.14Å
813	S	26.5	Very low	29.2	Very low	89 Å²	89	132.4 Å²	132.4	62%	0.622	71%	0.708	S	S	*	*			trans	-45.1	126.7	156.4	-73.8	0	0	0	0	106.5	F811 S815	F811-S813 PolarHBondContact O-N 2.77Å; S813-S815 PolarHBondContact O-N 3.23Å
814	P	29.7	Very low	28.8	Very low	123 Å²	123	130.2 Å²	130.2	80%	0.799	71%	0.705	S	S	*	*			trans	-64.4	92.4	174.9	25.1	-29.3	0	0	0	105.5	R812 R816	R812-P814 VanDerWaalsContact O-N 3.14Å; P814-R816 PolarHBondContact O-N 3.46Å
815	S	26.5	Very low	28.3	Very low	99 Å²	99	130.4 Å²	130.4	69%	0.692	72%	0.715	S	S	*	*			trans	-61.3	91.9	157	51.1	0	0	0	0	103.3	S813 Q817	S813-S815 PolarHBondContact O-N 3.23Å; S815-Q817 PolarHBondContact O-N 3.13Å
816	R	24.2	Very low	28.2	Very low	211 Å²	211	136.7 Å²	136.7	80%	0.796	73%	0.727	S	S	*	*			trans	-55.5	87	162.7	-173.3	179.5	-169.3	-171	3.6	104.6	P814 Q818	P814-R816 PolarHBondContact O-N 3.46Å; R816-Q818 HydrophobicContact CG-CG 4.43Å; R816-Q818 PolarHBondContact O-N 3.43Å
817	Q	25.9	Very low	27.6	Very low	160 Å²	160	139.6 Å²	139.6	75%	0.748	74%	0.743	S	S	*	*			trans	-59.5	98	158.7	-78.2	-171.2	-18.4	0	0	103.7	S815 S819	S815-Q817 PolarHBondContact O-N 3.13Å; Q817-S819 PolarHBondContact O-N 3.41Å
818	Q	23.9	Very low	27	Very low	168 Å²	168	143.3 Å²	143.3	79%	0.785	76%	0.76	S	S	*	*			trans	-63.7	71.1	156.1	-70.1	-177.9	-15.7	0	0	106.5	R816 G820	R816-Q818 HydrophobicContact CG-CG 4.43Å; R816-Q818 PolarHBondContact O-N 3.43Å; Q818-G820 PolarHBondContact O-N 2.67Å
819	S	23.8	Very low	26.2	Very low	87 Å²	87	144.8 Å²	144.8	61%	0.608	77%	0.767	S	S	*	*			trans	-76.7	89	161.8	-56.5	0	0	0	0	104.4	Q817 S821	Q817-S819 PolarHBondContact O-N 3.41Å; S819-S821 PolarHBondContact O-N 2.88Å
820	G	21.5	Very low	25.8	Very low	84 Å²	84	142.8 Å²	142.8	87%	0.866	76%	0.764	S	S	*	*			trans	-55.5	107	164.9	0	0	0	0	0	107.9	Q818	Q818-G820 PolarHBondContact O-N 2.67Å
821	S	24.8	Very low	25.4	Very low	113 Å²	113	142.2 Å²	142.2	79%	0.79	77%	0.77	S	S	*	*			trans	-151.2	119.5	168.9	174.5	0	0	0	0	107.5	S819	S819-S821 PolarHBondContact O-N 2.88Å
822	G	24.9	Very low	25.2	Very low	65 Å²	65	141.6 Å²	141.6	67%	0.67	77%	0.773	S	S	*	*			trans	77.5	78.3	146.7	0	0	0	0	0	116.1	S824	G822-S824 PolarHBondContact O-N 3.49Å
823	I	22.5	Very low	25.3	Very low	178 Å²	178	137.4 Å²	137.4	91%	0.913	77%	0.773	S	S	*	*			trans	-57	111.4	142.5	-5.8	172.9	0	0	0	107.2
824	S	27.4	Very low	25.2	Very low	98 Å²	98	142 Å²	142	69%	0.685	79%	0.785	S	S	*	*			trans	-164.6	113.3	150.3	61.2	0	0	0	0	110	G822 F826	G822-S824 PolarHBondContact O-N 3.49Å; S824-F826 PolarHBondContact O-N 3.21Å
825	N	22.4	Very low	25	Very low	145 Å²	145	141.5 Å²	141.5	78%	0.775	78%	0.784	S	S	*	*			trans	-47.6	123.2	167.7	-58.8	-33.8	0	0	0	110.4
826	F	26.3	Very low	25.2	Very low	188 Å²	188	142 Å²	142	83%	0.825	79%	0.785	S	S	*	*			trans	-129.9	97.2	152.8	-112.3	-86.8	0	0	0	107.2	S824 Q828	S824-F826 PolarHBondContact O-N 3.21Å; F826-Q828 PolarHBondContact O-N 3.48Å
827	D	24.5	Very low	25.3	Very low	149 Å²	149	141.3 Å²	141.3	80%	0.797	79%	0.79	S	S	*	*			trans	-58.5	112.3	163.1	-65.9	-54.3	0	0	0	108.3
828	Q	26.6	Very low	25.3	Very low	168 Å²	168	138.6 Å²	138.6	79%	0.785	79%	0.789	S	S	*	*			trans	-134.7	75.4	160.3	-119.2	170.1	7.2	0	0	109.4	F826 S830	F826-Q828 PolarHBondContact O-N 3.48Å; Q828-S830 PolarHBondContact O-N 3.44Å
829	E	22.2	Very low	25.4	Very low	198 Å²	198	137.6 Å²	137.6	93%	0.925	79%	0.786	S	S	*	*			trans	-39.2	99	149.6	-164.5	172.8	-149.7	0	0	110.5
830	S	27.8	Very low	25.6	Very low	97 Å²	97	139 Å²	139	68%	0.678	79%	0.793	S	S	*	*			trans	-148.6	106.2	163.6	59	0	0	0	0	111.9	Q828	Q828-S830 PolarHBondContact O-N 3.44Å
831	Q	25.1	Very low	25.9	Very low	188 Å²	188	143.1 Å²	143.1	88%	0.879	79%	0.79	S	S	*	*			trans	57.4	81	145.1	-58.9	-175	9.8	0	0	117.2	P833	Q831-P833 WeakPolarHBondContact O-CD 3.39Å
832	I	26.5	Very low	26.2	Very low	152 Å²	152	143 Å²	143	78%	0.779	78%	0.784	S	S	*	*			trans	-68.5	118.2	150.6	-62.5	166.5	0	0	0	107.3	Q834	I832-Q834 PolarHBondContact O-N 3.45Å
833	P	27.7	Very low	26.5	Very low	125 Å²	125	146.6 Å²	146.6	81%	0.812	79%	0.788	S	S	*	*			trans	-70.4	103.5	166.2	-7.3	24.7	0	0	0	107.5	Q831 S835	Q831-P833 WeakPolarHBondContact O-CD 3.39Å; P833-S835 PolarHBondContact O-N 3.4Å
834	Q	24.3	Very low	26.8	Very low	187 Å²	187	145.4 Å²	145.4	87%	0.874	78%	0.783	S	S	*	*			trans	-68	114.7	165	-71.5	-179.9	-18.2	0	0	108.7	I832	I832-Q834 PolarHBondContact O-N 3.45Å
835	S	25.6	Very low	27.1	Very low	112 Å²	112	148.3 Å²	148.3	78%	0.783	79%	0.79	S	S	*	*			trans	-154.4	138	152.6	-170.7	0	0	0	0	108.9	P833	P833-S835 PolarHBondContact O-N 3.4Å
836	P	31.5	Very low	27.5	Very low	109 Å²	109	147 Å²	147	71%	0.708	79%	0.787	S	S	*	*			trans	-84	132.9	-148.3	6.3	9.7	0	0	0	111.7	S838	P836-S838 PolarHBondContact O-N 3.39Å
837	H	26.7	Very low	27.7	Very low	197 Å²	197	146.5 Å²	146.5	91%	0.912	79%	0.788	S	S	*	*			trans	-63.2	84.2	153.7	-78.7	-52.7	0	0	0	109.1	M839	H837-M839 PolarHBondContact O-N 3.25Å
838	S	26.2	Very low	28.1	Very low	103 Å²	103	147 Å²	147	72%	0.72	79%	0.789	S	S	*	*			trans	-76.8	98	154.3	55.7	0	0	0	0	106.8	P836 P840	P836-S838 PolarHBondContact O-N 3.39Å; S838-P840 WeakPolarHBondContact O-CD 2.95Å
839	M	24.1	Very low	28.2	Very low	146 Å²	146	141.6 Å²	141.6	72%	0.719	78%	0.778	S	S	*	*			trans	-53.5	124	164.8	-79.3	-173.1	68.1	0	0	108.5	H837 E841	H837-M839 PolarHBondContact O-N 3.25Å; M839-E841 PolarHBondContact O-N 3.34Å
840	P	29.7	Very low	28.4	Very low	116 Å²	116	136 Å²	136	75%	0.753	77%	0.774	S	S	*	*			trans	-65.8	122.6	153.4	27.9	-26.8	0	0	0	106.1	S838 T842	S838-P840 WeakPolarHBondContact O-CD 2.95Å; P840-T842 PolarHBondContact O-N 2.88Å; P840-T842 VanDerWaalsContact O-N 3.08Å
841	E	27.1	Very low	28.7	Very low	172 Å²	172	137.1 Å²	137.1	80%	0.804	78%	0.776	S	S	*	*			trans	-44.3	117.2	173	-68	168.3	154.4	0	0	108.5	M839 D843	M839-E841 PolarHBondContact O-N 3.34Å; E841-D843 PolarHBondContact O-N 3.48Å
842	T	30.3	Very low	29	Very low	109 Å²	109	133.4 Å²	133.4	67%	0.669	77%	0.768	S	S	*	*			trans	-58.2	92.8	160.8	24.1	0	0	0	0	106.5	P840 L844	P840-T842 PolarHBondContact O-N 2.88Å; P840-T842 VanDerWaalsContact O-N 3.08Å; T842-L844 PolarHBondContact O-N 3Å
843	D	31.2	Very low	29.3	Very low	142 Å²	142	132 Å²	132	76%	0.759	77%	0.772	S	S	*	*			trans	-56.5	100.6	158.3	-84	-31.1	0	0	0	106.2	E841 L845	E841-D843 PolarHBondContact O-N 3.48Å; D843-L845 PolarHBondContact O-N 3.21Å
844	L	30.2	Very low	29.7	Very low	153 Å²	153	130.7 Å²	130.7	80%	0.801	76%	0.762	S	S	*	*			trans	-62.1	73.4	168.5	-72.3	160.6	0	0	0	108.3	T842	T842-L844 PolarHBondContact O-N 3Å
845	L	32	Very low	30.4	Very low	158 Å²	158	126.8 Å²	126.8	83%	0.827	76%	0.755	S	S	*	*			trans	-95	93.2	155.1	-70.5	-180	0	0	0	106.9	D843 E847	D843-L845 PolarHBondContact O-N 3.21Å; L845-E847 PolarHBondContact O-N 2.84Å
846	T	32	Very low	31.1	Very low	117 Å²	117	130.3 Å²	130.3	72%	0.718	76%	0.757	S	S	*	*			trans	-54.1	70.1	163	-40.4	0	0	0	0	109.7	I848	T846-I848 VanDerWaalsContact C-N 3.31Å; T846-I848 HydrophobicContact CG2-CD1 4.19Å; T846-I848 HydrophobicContact CG2-CG1 4.12Å; T846-I848 PolarHBondContact O-N 2.85Å; T846-I848 VanDerWaalsContact O-N 3.1Å
847	E	30.9	Very low	31.6	Very low	179 Å²	179	129.8 Å²	129.8	84%	0.836	75%	0.747	S	S	*	*			trans	-84.2	85.8	171	-151.8	171	-155.4	0	0	108.3	L845 G849	L845-E847 PolarHBondContact O-N 2.84Å; E847-G849 VanDerWaalsContact C-N 3.27Å; E847-G849 PolarHBondContact O-N 3.32Å
848	I	32.3	Very low	33.3	Very low	160 Å²	160	124.8 Å²	124.8	82%	0.821	73%	0.726	S	S	*	*			trans	-60.4	91.8	163.2	-63.9	159.1	0	0	0	106.2	T846	T846-I848 VanDerWaalsContact C-N 3.31Å; T846-I848 HydrophobicContact CG2-CD1 4.19Å; T846-I848 HydrophobicContact CG2-CG1 4.12Å; T846-I848 PolarHBondContact O-N 2.85Å; T846-I848 VanDerWaalsContact O-N 3.1Å
849	G	28.2	Very low	34.7	Very low	54 Å²	54	127.7 Å²	127.7	56%	0.557	72%	0.722	S	S	*	*			trans	177.1	24.3	-175.3	0	0	0	0	0	115.8	E847 V851	E847-G849 VanDerWaalsContact C-N 3.27Å; E847-G849 PolarHBondContact O-N 3.32Å; G849-V851 PolarHBondContact O-N 2.89Å
850	G	26	Very low	36.7	Very low	81 Å²	81	126.6 Å²	126.6	84%	0.835	72%	0.719	S	S	*	*			trans	-71.4	76	168.2	0	0	0	0	0	110
851	V	34.2	Very low	38.5	Very low	120 Å²	120	127 Å²	127	73%	0.727	71%	0.711	S	S	*	*			trans	-58.1	124.3	168.5	177.9	0	0	0	0	106.6	G849 S853	G849-V851 PolarHBondContact O-N 2.89Å; V851-S853 PolarHBondContact O-N 3Å
852	P	32.9	Very low	40	Very low	109 Å²	109	121.6 Å²	121.6	71%	0.708	69%	0.687	S	S	*	*			trans	-55.3	129.2	-178.2	21.1	-31.7	0	0	0	109.1	T854	P852-T854 VanDerWaalsContact C-N 3.34Å; P852-T854 PolarHBondContact O-N 3Å
853	S	31.2	Very low	41.6	Very low	124 Å²	124	121.4 Å²	121.4	87%	0.867	68%	0.681	S	S	*	*			trans	-46.9	95.7	179.7	-48.3	0	0	0	0	110.1	V851 S855	V851-S853 PolarHBondContact O-N 3Å; S853-S855 PolarHBondContact O-N 3.21Å; S853-S855 VanDerWaalsContact O-N 3.11Å
854	T	36.1	Very low	43.1	Very low	97 Å²	97	121.7 Å²	121.7	60%	0.595	68%	0.678	S	S	*	*			trans	-68.5	110.3	162.5	50.7	0	0	0	0	103.8	P852 F856	P852-T854 VanDerWaalsContact C-N 3.34Å; P852-T854 PolarHBondContact O-N 3Å; T854-F856 WeakPolarHBondContact O-CD2 3.43Å; T854-F856 PolarHBondContact O-N 3.4Å
855	S	39	Very low	44.2	Very low	105 Å²	105	119.6 Å²	119.6	73%	0.734	67%	0.668	S	S	*	*			trans	-55.3	99	167.4	51.3	0	0	0	0	106.2	S853 I857	S853-S855 PolarHBondContact O-N 3.21Å; S853-S855 VanDerWaalsContact O-N 3.11Å; S855-I857 PolarHBondContact O-N 2.87Å
856	F	40.2	Very low	45.7	Very low	186 Å²	186	116.9 Å²	116.9	82%	0.816	65%	0.653	S	S	*	*			trans	-60.5	108.4	166.8	-86.6	-95.1	0	0	0	105.1	T854 D858	T854-F856 WeakPolarHBondContact O-CD2 3.43Å; T854-F856 PolarHBondContact O-N 3.4Å; F856-D858 PolarHBondContact O-N 3.11Å; F856-D858 VanDerWaalsContact O-N 3.12Å
857	I	42.6	Very low	46.6	Very low	98 Å²	98	114.2 Å²	114.2	50%	0.503	65%	0.649	S	S	.	*			trans	-66.8	109.4	167.2	-66.4	168.8	0	0	0	104.2	S855 W859 I862	S855-I857 PolarHBondContact O-N 2.87Å; I857-W859 HydrophobicContact CG2-CD2 4.31Å; I857-W859 HydrophobicContact CG2-CZ2 4.46Å; I857-W859 VanDerWaalsContact O-CD1 3.28Å; I857-W859 PolarHBondContact O-N 3.13Å; I857-W859 VanDerWaalsContact O-N 3.08Å; I857-I862 HydrophobicContact CG2-CD1 3.42Å; I857-I862 VanDerWaalsContact CG2-CD1 3.42Å; I857-I862 HydrophobicContact CG2-CG1 4.39Å
858	D	62.9	Low	47.6	Very low	91 Å²	91	113.1 Å²	113.1	49%	0.487	65%	0.648	S	S	.	*			trans	-72.3	98.8	174.5	-162.5	-15	0	0	0	107.5	F856 D860 E861 I862	F856-D858 PolarHBondContact O-N 3.11Å; F856-D858 VanDerWaalsContact O-N 3.12Å; D858-D860 PolarHBondContact O-N 3.02Å; D858-D860 PolarHBondContact OD1-N 3.16Å; D858-E861 HydrophobicContact CB-CB 4.23Å; D858-E861 PolarHBondContact O-N 3.36Å; D858-I862 PolarHBondContact O-N 3.35Å
859	W	56.4	Low	47.9	Very low	165 Å²	165	115 Å²	115	63%	0.625	66%	0.659	S	S	*	*	H	α-helix	trans	-65.8	-23.5	-178.2	-70.6	97.1	0	0	0	111.6	I857 E861 I862 D863	I857-W859 HydrophobicContact CG2-CD2 4.31Å; I857-W859 HydrophobicContact CG2-CZ2 4.46Å; I857-W859 VanDerWaalsContact O-CD1 3.28Å; I857-W859 PolarHBondContact O-N 3.13Å; I857-W859 VanDerWaalsContact O-N 3.08Å; W859-E861 VanDerWaalsContact C-N 3.31Å; W859-E861 PolarHBondContact O-N 3.44Å; W859-I862 HydrophobicContact CE3-CD1 4.21Å; W859-I862 HydrophobicContact CZ3-CD1 4.31Å; W859-I862 PolarHBondContact O-N 3.33Å; W859-D863 WeakPolarHBondContact O-CB 3.26Å; W859-D863 PolarHBondContact O-N 2.91Å
860	D	65	Low	48.9	Very low	123 Å²	123	118 Å²	118	66%	0.658	66%	0.664	S	S	*	*	H	α-helix	trans	-66.4	-36.6	175.6	-65.8	-20.5	0	0	0	110.6	D858 D863 E864	D858-D860 PolarHBondContact O-N 3.02Å; D858-D860 PolarHBondContact OD1-N 3.16Å; D860-D863 PolarHBondContact O-N 3Å; D860-E864 PolarHBondContact O-N 3.09Å
861	E	67.9	Low	50.1	Low	125 Å²	125	119.9 Å²	119.9	58%	0.584	66%	0.655	S	S	*	*	H	α-helix	trans	-68.6	-35.7	174.9	-168.2	178.4	-164.1	0	0	111.7	D858 W859 L865	D858-E861 HydrophobicContact CB-CB 4.23Å; D858-E861 PolarHBondContact O-N 3.36Å; W859-E861 VanDerWaalsContact C-N 3.31Å; W859-E861 PolarHBondContact O-N 3.44Å; E861-L865 WeakPolarHBondContact O-CB 3.35Å; E861-L865 PolarHBondContact O-N 2.98Å
862	I	58.3	Low	51	Low	57 Å²	57	119.9 Å²	119.9	29%	0.292	65%	0.651	S	S	.	*	H	α-helix	trans	-71	-40.7	175.6	-64.4	-174.8	0	0	0	111.2	I857 D858 W859 E864 L865 I866	I857-I862 HydrophobicContact CG2-CD1 3.42Å; I857-I862 VanDerWaalsContact CG2-CD1 3.42Å; I857-I862 HydrophobicContact CG2-CG1 4.39Å; D858-I862 PolarHBondContact O-N 3.35Å; W859-I862 HydrophobicContact CE3-CD1 4.21Å; W859-I862 HydrophobicContact CZ3-CD1 4.31Å; W859-I862 PolarHBondContact O-N 3.33Å; I862-E864 VanDerWaalsContact C-N 3.34Å; I862-L865 WeakPolarHBondContact O-CB 3.36Å; I862-L865 PolarHBondContact O-N 3.42Å; I862-I866 HydrophobicContact CG2-CD1 3.64Å; I862-I866 HydrophobicContact CG2-CG1 4.22Å; I862-I866 WeakPolarHBondContact O-CB 3.25Å; I862-I866 VanDerWaalsContact O-CG1 3.29Å; I862-I866 WeakPolarHBondContact O-CG1 3.37Å; I862-I866 PolarHBondContact O-N 3.3Å
863	D	65.1	Low	52.1	Low	105 Å²	105	120.6 Å²	120.6	56%	0.561	65%	0.647	S	S	*	*	H	α-helix	trans	-68.3	-33.9	178.2	-80.3	-15.2	0	0	0	111.5	W859 D860 G867	W859-D863 WeakPolarHBondContact O-CB 3.26Å; W859-D863 PolarHBondContact O-N 2.91Å; D860-D863 PolarHBondContact O-N 3Å; D863-G867 PolarHBondContact O-N 3.42Å
864	E	62.8	Low	53.4	Low	149 Å²	149	120.4 Å²	120.4	70%	0.696	63%	0.634	S	S	*	*	H	α-helix	trans	-62.7	-46.3	167.3	-96.3	-171.4	162	0	0	111.8	D860 I862 I866 G867 D868	D860-E864 PolarHBondContact O-N 3.09Å; I862-E864 VanDerWaalsContact C-N 3.34Å; E864-I866 VanDerWaalsContact C-N 3.32Å; E864-I866 PolarHBondContact O-N 2.93Å; E864-G867 PolarHBondContact O-N 3.31Å; E864-D868 PolarHBondContact O-N 3.39Å
865	L	52.4	Low	54.5	Low	109 Å²	109	121.9 Å²	121.9	57%	0.571	64%	0.636	S	S	*	*	H	α-helix	trans	-62.3	-36.1	177.9	-90.6	157.8	0	0	0	113.3	E861 I862	E861-L865 WeakPolarHBondContact O-CB 3.35Å; E861-L865 PolarHBondContact O-N 2.98Å; I862-L865 WeakPolarHBondContact O-CB 3.36Å; I862-L865 PolarHBondContact O-N 3.42Å
866	I	63.7	Low	55.6	Low	101 Å²	101	123.1 Å²	123.1	52%	0.518	63%	0.629	S	S	.	*	H	α-helix	trans	-77.6	-34.4	176.7	-66.9	170.4	0	0	0	110.7	I862 E864 D868 L869	I862-I866 HydrophobicContact CG2-CD1 3.64Å; I862-I866 HydrophobicContact CG2-CG1 4.22Å; I862-I866 WeakPolarHBondContact O-CB 3.25Å; I862-I866 VanDerWaalsContact O-CG1 3.29Å; I862-I866 WeakPolarHBondContact O-CG1 3.37Å; I862-I866 PolarHBondContact O-N 3.3Å; E864-I866 VanDerWaalsContact C-N 3.32Å; E864-I866 PolarHBondContact O-N 2.93Å; I866-D868 VanDerWaalsContact C-N 3.28Å; I866-D868 PolarHBondContact O-N 3.39Å; I866-L869 PolarHBondContact O-N 3.49Å
867	G	49.8	Very low	56.8	Low	61 Å²	61	118.3 Å²	118.3	63%	0.629	62%	0.615	S	S	*	*	H	α-helix	trans	-65.2	-30.3	176	0	0	0	0	0	113.6	D863 E864	D863-G867 PolarHBondContact O-N 3.42Å; E864-G867 PolarHBondContact O-N 3.31Å
868	D	52.5	Low	58	Low	155 Å²	155	120 Å²	120	83%	0.829	62%	0.624	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84	-8.9	177.2	-85.3	-8.5	0	0	0	114.4	E864 I866	E864-D868 PolarHBondContact O-N 3.39Å; I866-D868 VanDerWaalsContact C-N 3.28Å; I866-D868 PolarHBondContact O-N 3.39Å
869	L	39.6	Very low	57.6	Low	199 Å²	199	122.6 Å²	122.6	100%	1.042	64%	0.637	S	S	*	*			trans	-90.6	0	175.2	-88.2	162.5	0	0	0	112.2	I866	I866-L869 PolarHBondContact O-N 3.49Å

Retrieved 869 of 869 residues in 195.8 ms (Link to these results)

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