A0A077ZCH1_TRITR Loading...

Nuclear receptor corepressor 2

AlphaFold DB , UniProt , Accession A0A077ZCH1, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 1,181 aa.

						>A0A077ZCH1_TRITR|A0A077ZCH1
MWSQDLRSTPANGIGGVPTGGGQYLPWYSQQVPFWYQQLNYEPFEYARQLTGNYDSQSQLLQLPLFNTNESGAPSVQTEPLIAGIPTARTQSDGVTSEEDGGKFQELLRSIRSLSPSSAESDVGPNILFSESIVDIEDDDEEQEPPTSAYAKSAVSPNISISNSSPYSSSPIPRPTFPSPHPVSPSPSPQLCPTRETTEKEESPVACDFVRQLLADEAKEESPKSSFVTKLCASLVNRYIIRFQSFENLVLSASRQLPKCSPISSVFQERVRAWKMTRKQPGQLSPAFVGMKSSKLSSTSADRFKEKQLLREMGSLFSELLVAEEKLANSLKLPHETRGLRVGATFEKAGDADSALARKKKTAAIPPPLSDVTVRPIRYYRVKDPMKKWKVEDRTSRWFCEEEKTEFNKRFKQYSKSFDAIASFIPNKSASDCVKYYNFNKHAEDFKALRNRKKTAYSKHSRPAFPSNIISKMFQTSTVASPTSGVWLKSSSLIMLPRPYEDYITCCKCHTRIASNDLGILTRSSRNFMHPFGDSPRKNFRQNGGQFCANCRKQHVGKQSEKRSCPVFHCTARPRRCREHKSLPDEFFKLDMVLQERLLAEYHLSPLAFKCCFACFNKIKKKINNFLKFYNDEVSDDEPSSSTIGHFTKDEQNMLRDVLFSGCCSSWDEVANRIPNKSAKECRRYANENKSVIFDCTLLTSAVESVHEHAENNGGERNGSETIGAPSENTTTTSAKNAEPVAVQPPYTCLRAVLNAISSVEPVTTSEEAPCQGVEPSSNRTSPKPSWNMKFAFHPSSPCAKLQEEAMANTSAATKRNTDSRRSTDTSFTSPKDVGSSGVATLLENASVGRQSAVMSTSPSEVESSSFNARPISGGCSSISSETGSGVHLNHSNYPNNFATLPIMPLSFGPGHSMNDWYAGGISSTTNGAFGGQPIDLGRPRPTPIAERLYSNLCSPGVNGSTQYSIDSTFCRQQHLEPGTSASALSNVVPAAENRKRLVQGSPTEGINPKMICNGICASVPAVSAAYAGIGQNNLSAPFAGNAYQPLNGFTFNPSSHTFQYPSFAGYQAESANSLINQFNLNGYGANPFYAAGSDYHQAVQNGLLQSAGIPLFNYGFNPYGYGVDNVTNRRIAETLETAIPTAGGTSSSVVGSSSGGSCTRDKKRVEQMFTFLDCSDDENV
					

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	34.9	Very low	34.2	Very low	219 Å²	219	154.1 Å²	154.1	100%	1.079	80%	0.804	S	S	*	*				0	96.3	0	-76.2	172.3	63.2	0	0	109.1	S3	M1-S3 PolarHBondContact N-OG 3.17Å
2	W	46.3	Very low	33.9	Very low	271 Å²	271	155.3 Å²	155.3	100%	1.027	81%	0.812	S	S	*	*			cis	-68.7	173.8	-14.1	-67.8	-19.7	0	0	0	111.7
3	S	37.5	Very low	33.6	Very low	92 Å²	92	149 Å²	149	64%	0.643	81%	0.808	S	S	*	*			trans	-161.8	-177.5	-164.7	-67.2	0	0	0	0	109.6	M1	M1-S3 PolarHBondContact N-OG 3.17Å
4	Q	35.8	Very low	33.6	Very low	170 Å²	170	150.9 Å²	150.9	79%	0.794	82%	0.815	S	S	*	*			trans	74.1	150.1	171.6	-56.1	177.9	-90.4	0	0	115.4
5	D	31.6	Very low	33.4	Very low	129 Å²	129	146.2 Å²	146.2	69%	0.69	82%	0.816	S	S	*	*			cis	-155.4	146.4	-24.7	-88.5	-33.9	0	0	0	103.9
6	L	36.6	Very low	33.3	Very low	151 Å²	151	141.3 Å²	141.3	79%	0.791	81%	0.809	S	S	*	*			cis	57.4	77.7	33.2	-79.1	-177.8	0	0	0	116
7	R	27.5	Very low	33.4	Very low	226 Å²	226	141.6 Å²	141.6	85%	0.853	81%	0.814	S	S	*	*				169.4	158.8	124.2	-86.8	146.6	-160.1	-88.2	-0.1	113.9
8	S	26.9	Very low	33.6	Very low	99 Å²	99	139.8 Å²	139.8	69%	0.692	81%	0.807	S	S	*	*			trans	55	104.4	158.2	41.2	0	0	0	0	119.1
9	T	33.5	Very low	33.7	Very low	135 Å²	135	140.5 Å²	140.5	83%	0.828	81%	0.814	S	S	*	*				67.7	145.2	77	61	0	0	0	0	115.2
10	P	37	Very low	33.4	Very low	128 Å²	128	137.3 Å²	137.3	83%	0.831	81%	0.813	S	S	*	*			cis	-124.1	-159.5	4.9	47.4	-32.8	0	0	0	111
11	A	29	Very low	33.1	Very low	75 Å²	75	134.4 Å²	134.4	62%	0.62	81%	0.812	S	S	*	*			cis	-163.9	161.3	-20.7	0	0	0	0	0	110.1
12	N	30.2	Very low	32.8	Very low	168 Å²	168	128 Å²	128	90%	0.898	80%	0.802	S	S	*	*			trans	60.6	155.4	156.2	-60.6	-10	0	0	0	121.1
13	G	29.9	Very low	32.2	Very low	74 Å²	74	123.4 Å²	123.4	76%	0.763	79%	0.792	S	S	*	*			trans	124.2	53.3	144.9	0	0	0	0	0	121.2
14	I	33.6	Very low	31.8	Very low	175 Å²	175	130.6 Å²	130.6	90%	0.897	81%	0.807	S	S	*	*			trans	6.4	122.5	149.8	-57	170.3	0	0	0	117.9
15	G	31.1	Very low	31.7	Very low	81 Å²	81	129 Å²	129	84%	0.835	80%	0.803	S	S	*	*			trans	-81.9	-168.5	-177	0	0	0	0	0	119.5
16	G	31.3	Very low	31.7	Very low	68 Å²	68	128.4 Å²	128.4	70%	0.701	81%	0.806	S	S	*	*			trans	168.9	135.5	171	0	0	0	0	0	116.2
17	V	34.8	Very low	31.4	Very low	147 Å²	147	132.9 Å²	132.9	89%	0.891	81%	0.813	S	S	*	*			trans	58.1	179.3	157.4	-103.9	0	0	0	0	118.4
18	P	37.7	Very low	31.4	Very low	108 Å²	108	132 Å²	132	70%	0.701	81%	0.811	S	S	*	*				-118.5	170	-69.1	28.3	-10.5	0	0	0	113.7
19	T	34.7	Very low	31.6	Very low	153 Å²	153	132.6 Å²	132.6	94%	0.939	82%	0.815	S	S	*	*			trans	-173.9	156	137.4	14.5	0	0	0	0	112.5
20	G	28.2	Very low	31.7	Very low	76 Å²	76	134.8 Å²	134.8	78%	0.784	82%	0.816	S	S	*	*			trans	-123.1	171.2	172.4	0	0	0	0	0	112.5
21	G	27.6	Very low	31.6	Very low	77 Å²	77	137.8 Å²	137.8	79%	0.794	82%	0.819	S	S	*	*			trans	99.2	49.3	171.9	0	0	0	0	0	116.7
22	G	28.8	Very low	31.9	Very low	84 Å²	84	140.3 Å²	140.3	87%	0.866	83%	0.826	S	S	*	*			trans	-82.6	130.3	172.5	0	0	0	0	0	113.4
23	Q	33	Very low	32.1	Very low	175 Å²	175	137 Å²	137	82%	0.818	81%	0.814	S	S	*	*			trans	-90.4	153.2	-175.2	-61.2	178.3	11.4	0	0	113.4	L25	Q23-L25 PolarHBondContact O-N 2.98Å
24	Y	30	Very low	32.2	Very low	244 Å²	244	142.2 Å²	142.2	96%	0.957	82%	0.816	S	S	*	*			trans	-63.5	90.2	171.9	-104	-103.8	0	0	0	111.6
25	L	32.2	Very low	32.1	Very low	135 Å²	135	142.5 Å²	142.5	71%	0.707	81%	0.806	S	S	*	*			trans	-92	133.5	172.6	-78.8	171.4	0	0	0	111.6	Q23 W27	Q23-L25 PolarHBondContact O-N 2.98Å; L25-W27 PolarHBondContact O-N 3.4Å
26	P	31.8	Very low	32.2	Very low	117 Å²	117	149 Å²	149	76%	0.76	81%	0.806	S	S	*	*			trans	-85.6	108.2	180	32.5	-32.5	0	0	0	111.7	Y28	P26-Y28 PolarHBondContact O-N 3.13Å
27	W	29.9	Very low	32.4	Very low	246 Å²	246	153.5 Å²	153.5	93%	0.932	81%	0.809	S	S	*	*			trans	-73.2	90.4	176.4	-72.8	49.6	0	0	0	110.8	L25	L25-W27 PolarHBondContact O-N 3.4Å
28	Y	27.5	Very low	32.4	Very low	206 Å²	206	153 Å²	153	81%	0.808	80%	0.798	S	S	*	*			trans	-158.4	61.6	174.3	-123.8	-74.6	0	0	0	112.8	P26	P26-Y28 PolarHBondContact O-N 3.13Å
29	S	32.3	Very low	32.1	Very low	113 Å²	113	155 Å²	155	79%	0.79	80%	0.801	S	S	*	*			trans	-167.5	151.7	168.2	-175.3	0	0	0	0	110.2
30	Q	34.5	Very low	32	Very low	181 Å²	181	155.1 Å²	155.1	85%	0.846	80%	0.796	S	S	*	*			trans	79.4	52.1	175.7	-56.7	-176.9	-11	0	0	118.4
31	Q	36.4	Very low	32.3	Very low	191 Å²	191	162.3 Å²	162.3	89%	0.893	80%	0.801	S	S	*	*			trans	-140.7	117.4	132.4	-102.1	176.2	8.2	0	0	107.5
32	V	33.7	Very low	32.8	Very low	128 Å²	128	165.7 Å²	165.7	78%	0.776	80%	0.796	S	S	*	*			trans	-109.8	110.3	173.1	179.5	0	0	0	0	106.2	F34	V32-F34 PolarHBondContact O-N 3.1Å
33	P	35.1	Very low	33.1	Very low	97 Å²	97	167.1 Å²	167.1	63%	0.63	79%	0.791	S	S	*	*			trans	-60.3	134.5	174.4	-23.3	34.5	0	0	0	110.2	W35	P33-W35 PolarHBondContact O-N 2.98Å
34	F	32	Very low	33.1	Very low	184 Å²	184	163.7 Å²	163.7	81%	0.807	77%	0.773	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.6	20.1	-167.3	-152	-99.4	0	0	0	114.8	V32	V32-F34 PolarHBondContact O-N 3.1Å
35	W	32.5	Very low	33.5	Very low	182 Å²	182	156.9 Å²	156.9	69%	0.689	75%	0.75	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.4	-3.9	-167	-73.5	86.3	0	0	0	114.9	P33 Q37	P33-W35 PolarHBondContact O-N 2.98Å; W35-Q37 PolarHBondContact O-N 2.63Å
36	Y	32.6	Very low	33.5	Very low	216 Å²	216	159.4 Å²	159.4	85%	0.847	75%	0.751	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.1	8.2	-179.1	-112.1	-88.8	0	0	0	115
37	Q	34.4	Very low	33.8	Very low	164 Å²	164	156.8 Å²	156.8	77%	0.766	74%	0.74	S	S	*	*	T	Hydrogen-bonded Turn	trans	-121.3	2.2	-175.5	-150	166.8	6.7	0	0	113.9	W35	W35-Q37 PolarHBondContact O-N 2.63Å
38	Q	35.5	Very low	34.2	Very low	137 Å²	137	148.4 Å²	148.4	64%	0.64	71%	0.708	S	S	*	*	S	Bend	trans	-111.1	-7.6	173.3	-79.2	-175.4	-33.1	0	0	114.3	N40	Q38-N40 PolarHBondContact O-N 3.49Å
39	L	30.7	Very low	34.9	Very low	149 Å²	149	141.5 Å²	141.5	78%	0.78	68%	0.683	S	S	*	*			trans	-79.1	65.5	174.9	-69	175.5	0	0	0	111.4
40	N	33.2	Very low	35.2	Very low	155 Å²	155	144 Å²	144	83%	0.829	69%	0.686	S	S	*	*			trans	-130	33.6	174.9	-149.9	53.9	0	0	0	111.5	Q38	Q38-N40 PolarHBondContact O-N 3.49Å
41	Y	33.8	Very low	35.2	Very low	227 Å²	227	139.2 Å²	139.2	89%	0.89	67%	0.67	S	S	*	*			trans	-101.5	130.9	171.1	-101.3	-93.2	0	0	0	109.7
42	E	38.4	Very low	35	Very low	148 Å²	148	133 Å²	133	69%	0.692	66%	0.658	S	S	*	*			trans	-72.6	146.5	-179.6	-64.8	-158.4	138.3	0	0	112.4	F44	E42-F44 HydrophobicContact CB-CB 4.38Å; E42-F44 PolarHBondContact O-N 3.13Å
43	P	36.1	Very low	35	Very low	115 Å²	115	133.2 Å²	133.2	75%	0.747	65%	0.654	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.8	5.5	173.7	-21.9	34.2	0	0	0	115.8
44	F	32.8	Very low	34.8	Very low	103 Å²	103	139.9 Å²	139.9	45%	0.452	67%	0.669	S	S	.	*	H	α-helix	trans	-85.8	-13.2	-163.1	-89.1	-128.5	0	0	0	114.7	E42 R48 Y1120	E42-F44 HydrophobicContact CB-CB 4.38Å; E42-F44 PolarHBondContact O-N 3.13Å; F44-R48 WeakPolarHBondContact O-CG 3.36Å; F44-Y1120 VanDerWaalsContact CA-OH 3.27Å; F44-Y1120 WeakPolarHBondContact CA-OH 3.48Å; F44-Y1120 HydrophobicContact CB-CE2 4.48Å; F44-Y1120 WeakPolarHBondContact CB-OH 3.49Å; F44-Y1120 HydrophobicContact CD1-CD1 4.45Å; F44-Y1120 HydrophobicContact CD1-CD2 4.42Å; F44-Y1120 AromaticContact CD1-CE1 3.67Å; F44-Y1120 HydrophobicContact CD1-CE1 3.67Å; F44-Y1120 AromaticContact CD1-CE2 3.66Å; F44-Y1120 HydrophobicContact CD1-CE2 3.66Å; F44-Y1120 AromaticContact CD1-CZ 3.23Å; F44-Y1120 VanDerWaalsContact CD1-OH 3.25Å; F44-Y1120 WeakPolarHBondContact CD1-OH 3.25Å; F44-Y1120 AromaticContact CE1-CD1 4Å; F44-Y1120 HydrophobicContact CE1-CD1 4Å; F44-Y1120 AromaticContact CE1-CE1 3.38Å; F44-Y1120 HydrophobicContact CE1-CE1 3.38Å; F44-Y1120 HydrophobicContact CE1-CE2 4.17Å; F44-Y1120 AromaticContact CE1-CZ 3.52Å; F44-Y1120 HydrophobicContact CG-CE1 4.35Å; F44-Y1120 HydrophobicContact CG-CE2 4.31Å; F44-Y1120 AromaticContact CG-CZ 3.71Å; F44-Y1120 WeakPolarHBondContact CG-OH 3.32Å; F44-Y1120 AromaticContact CZ-CE1 3.86Å; F44-Y1120 HydrophobicContact CZ-CE1 3.86Å; F44-Y1120 PolarHBondContact O-OH 3.34Å
45	E	37.3	Very low	35	Very low	100 Å²	100	136.4 Å²	136.4	47%	0.467	66%	0.658	S	S	.	*	H	α-helix	trans	-96.9	-4.8	-172.6	-73.2	-96.3	124.1	0	0	115.6	R48 F1117	E45-R48 VanDerWaalsContact C-CB 3.45Å; E45-R48 WeakPolarHBondContact O-CA 3.1Å; E45-R48 WeakPolarHBondContact O-CB 3.45Å; E45-F1117 WeakPolarHBondContact OE1-CE1 3.22Å; E45-F1117 WeakPolarHBondContact OE2-CZ 3.36Å
46	Y	33.3	Very low	35.1	Very low	188 Å²	188	132.2 Å²	132.2	74%	0.737	66%	0.657	S	S	*	*	H	α-helix	trans	-106.6	-36.5	176.3	-158.5	-101.9	0	0	0	114.8	R48 Q49	Y46-R48 CarbonylContact O-C 3.59Å; Y46-R48 VanDerWaalsContact O-CA 3.27Å; Y46-R48 WeakPolarHBondContact O-CA 3.48Å; Y46-R48 PolarHBondContact O-N 3.13Å; Y46-Q49 PolarHBondContact O-N 2.9Å
47	A	38.9	Very low	35	Very low	62 Å²	62	130 Å²	130	51%	0.512	65%	0.654	S	S	.	*	H	α-helix	trans	-56.5	-30.7	159.4	0	0	0	0	0	110.8	Q49 N1118	A47-Q49 PolarHBondContact O-N 3.49Å; A47-N1118 PolarHBondContact O-ND2 3.49Å
48	R	38.4	Very low	34.9	Very low	71 Å²	71	126.5 Å²	126.5	27%	0.268	65%	0.648	S	S	.	*	G	3₁₀ helix		25.1	-105.1	119.2	-45.9	166.6	150.7	164.3	-6.4	115.3	F44 E45 Y46 L50 F1117 N1118	F44-R48 WeakPolarHBondContact O-CG 3.36Å; E45-R48 VanDerWaalsContact C-CB 3.45Å; E45-R48 WeakPolarHBondContact O-CA 3.1Å; E45-R48 WeakPolarHBondContact O-CB 3.45Å; Y46-R48 CarbonylContact O-C 3.59Å; Y46-R48 VanDerWaalsContact O-CA 3.27Å; Y46-R48 WeakPolarHBondContact O-CA 3.48Å; Y46-R48 PolarHBondContact O-N 3.13Å; R48-L50 PolarHBondContact O-N 2.89Å; R48-F1117 HydrophobicContact CB-CD1 4.45Å; R48-F1117 VanDerWaalsContact CD-CD1 3.47Å; R48-F1117 HydrophobicContact CG-CD1 4.12Å; R48-F1117 CarbonylContact O-C 3.59Å; R48-F1117 WeakPolarHBondContact O-CA 3.45Å; R48-N1118 HydrophobicContact CB-CB 3.88Å; R48-N1118 HydrophobicContact CG-CB 3.11Å; R48-N1118 PolarHBondContact NE-O 2.9Å; R48-N1118 PolarHBondContact NH2-O 3.44Å; R48-N1118 VanDerWaalsContact NH2-O 3.08Å; R48-N1118 VanDerWaalsContact O-CA 3.28Å; R48-N1118 WeakPolarHBondContact O-CA 3.46Å; R48-N1118 WeakPolarHBondContact O-CB 3.47Å; R48-N1118 PolarHBondContact O-N 3.06Å
49	Q	41.8	Very low	34.6	Very low	60 Å²	60	127.6 Å²	127.6	28%	0.28	65%	0.653	S	S	.	*	G	3₁₀ helix	trans	-89.6	31.1	-141.6	-50.7	-159.4	-14.8	0	0	117.7	Y46 A47	Y46-Q49 PolarHBondContact O-N 2.9Å; A47-Q49 PolarHBondContact O-N 3.49Å
50	L	37.6	Very low	34.6	Very low	165 Å²	165	127.7 Å²	127.7	86%	0.864	65%	0.653	S	S	*	*	G	3₁₀ helix	trans	-133	2.4	-173.4	-68.6	172	0	0	0	115.4	R48	R48-L50 PolarHBondContact O-N 2.89Å
51	T	34.9	Very low	34.6	Very low	81 Å²	81	126.5 Å²	126.5	50%	0.497	65%	0.646	S	S	.	*			trans	-148.2	60.3	-171.7	30.8	0	0	0	0	111.8	F1117 N1118	T51-F1117 CarbonylContact C-O 3.51Å; T51-F1117 PolarHBondContact N-O 3.28Å; T51-N1118 CarbonylContact O-C 3.55Å; T51-N1118 VanDerWaalsContact O-CA 3.22Å; T51-N1118 WeakPolarHBondContact O-CA 3.3Å; T51-N1118 WeakPolarHBondContact OG1-CA 3.3Å; T51-N1118 VanDerWaalsContact OG1-CG 3.3Å; T51-N1118 PolarHBondContact OG1-OD1 3.07Å
52	G	31.8	Very low	34.7	Very low	62 Å²	62	124 Å²	124	64%	0.639	64%	0.643	S	S	*	*			trans	-127.5	116	173.3	0	0	0	0	0	110.9	F1117	G52-F1117 PolarHBondContact N-O 3.34Å; G52-F1117 VanDerWaalsContact N-O 3.14Å
53	N	34	Very low	34.1	Very low	132 Å²	132	124.6 Å²	124.6	71%	0.706	65%	0.65	S	S	*	*			trans	-109.9	140.1	178.3	-171.2	48.8	0	0	0	110.3	D55	N53-D55 PolarHBondContact ND2-OD2 3.39Å
54	Y	31.6	Very low	34.1	Very low	237 Å²	237	123.8 Å²	123.8	93%	0.929	65%	0.645	S	S	*	*			trans	-152.6	128.3	165.4	-114.4	-78.3	0	0	0	111.3
55	D	36	Very low	34.1	Very low	111 Å²	111	125.1 Å²	125.1	59%	0.594	66%	0.656	S	S	*	*			trans	-94.4	129.8	-170.6	-83.7	-79.2	0	0	0	114.2	N53	N53-D55 PolarHBondContact ND2-OD2 3.39Å
56	S	33.9	Very low	33.9	Very low	94 Å²	94	128.3 Å²	128.3	66%	0.657	67%	0.668	S	S	*	*			trans	70.9	151.5	139.5	79.6	0	0	0	0	121.7
57	Q	31	Very low	33.7	Very low	170 Å²	170	125.6 Å²	125.6	79%	0.794	67%	0.666	S	S	*	*			trans	70.9	146.4	169.8	-46.8	-167.2	29	0	0	115.1
58	S	31.5	Very low	33.5	Very low	90 Å²	90	128.2 Å²	128.2	63%	0.629	68%	0.677	S	S	*	*			cis	-139.5	150.2	21.6	-60.6	0	0	0	0	114
59	Q	30.5	Very low	33.2	Very low	159 Å²	159	130.8 Å²	130.8	74%	0.743	70%	0.696	S	S	*	*			trans	39.9	120.1	134	-55.4	168.9	41.1	0	0	116.9
60	L	30.8	Very low	32.9	Very low	151 Å²	151	135.4 Å²	135.4	79%	0.791	72%	0.717	S	S	*	*				-156.3	180	58.1	-75.8	172.6	0	0	0	109.8
61	L	33.3	Very low	32.6	Very low	130 Å²	130	133.3 Å²	133.3	68%	0.681	72%	0.716	S	S	*	*			cis	-155	-174.1	4.8	-133.2	164.8	0	0	0	109
62	Q	34.2	Very low	32.6	Very low	176 Å²	176	133.5 Å²	133.5	82%	0.822	73%	0.734	S	S	*	*			trans	45.9	74.5	157.2	-90.4	156.8	13.6	0	0	119.8
63	L	27.4	Very low	32.6	Very low	159 Å²	159	135.2 Å²	135.2	83%	0.832	74%	0.742	S	S	*	*			trans	-62.2	-169.1	135.5	-64.8	164.1	0	0	0	111.3
64	P	35.2	Very low	32.7	Very low	99 Å²	99	134.1 Å²	134.1	64%	0.643	74%	0.743	S	S	*	*			cis	-134.8	-156.5	-23.1	19	7.9	0	0	0	113.5
65	L	32.1	Very low	32.6	Very low	130 Å²	130	127.8 Å²	127.8	68%	0.681	73%	0.733	S	S	*	*			trans	84.8	149.2	150.4	-46.9	178	0	0	0	117.9
66	F	34.1	Very low	32.6	Very low	167 Å²	167	128.4 Å²	128.4	73%	0.732	74%	0.74	S	S	*	*			cis	-138.9	147.7	-20.2	-86.1	-61.8	0	0	0	105.3
67	N	29.7	Very low	32.4	Very low	131 Å²	131	132.2 Å²	132.2	70%	0.701	75%	0.748	S	S	*	*			cis	85.2	145.8	46.3	-152.2	26.8	0	0	0	114.8
68	T	34.1	Very low	32.6	Very low	118 Å²	118	130.1 Å²	130.1	72%	0.724	75%	0.747	S	S	*	*			trans	63.2	158.1	178.8	66.6	0	0	0	0	118.5
69	N	31.2	Very low	32.8	Very low	125 Å²	125	134.5 Å²	134.5	67%	0.668	76%	0.757	S	S	*	*			cis	-169.9	173.6	-45.3	-116.3	28.4	0	0	0	108.7
70	E	35.4	Very low	33.3	Very low	157 Å²	157	131.6 Å²	131.6	73%	0.734	75%	0.752	S	S	*	*			trans	60.5	99.9	150.6	-75.2	149.2	-120.2	0	0	121.6
71	S	31.7	Very low	33.5	Very low	121 Å²	121	131.9 Å²	131.9	85%	0.846	75%	0.754	S	S	*	*				18.9	120.4	124.7	55	0	0	0	0	120.8
72	G	35	Very low	33.6	Very low	84 Å²	84	132.6 Å²	132.6	87%	0.866	76%	0.757	S	S	*	*			trans	-174.5	143.5	160.8	0	0	0	0	0	113.4
73	A	31.3	Very low	33.6	Very low	99 Å²	99	129 Å²	129	82%	0.818	76%	0.757	S	S	*	*			trans	-134.3	-178.8	171.5	0	0	0	0	0	108
74	P	36.3	Very low	34	Very low	109 Å²	109	124.7 Å²	124.7	71%	0.708	75%	0.751	S	S	*	*			cis	-139.3	-179.1	-2.7	42.4	-24.9	0	0	0	116.1
75	S	30.7	Very low	33.8	Very low	104 Å²	104	128.1 Å²	128.1	73%	0.727	76%	0.762	S	S	*	*			trans	74.3	172.2	144.6	76.3	0	0	0	0	121.9
76	V	34.7	Very low	33.9	Very low	123 Å²	123	127.7 Å²	127.7	75%	0.745	77%	0.767	S	S	*	*			trans	70.6	109.4	-177	-167.9	0	0	0	0	113.6
77	Q	30.7	Very low	33.7	Very low	174 Å²	174	126.2 Å²	126.2	81%	0.813	77%	0.772	S	S	*	*			cis	92.2	152.3	44.7	-72.6	-164.8	3.7	0	0	115.3
78	T	34.2	Very low	33.8	Very low	127 Å²	127	125 Å²	125	78%	0.779	78%	0.781	S	S	*	*			trans	64.3	139.6	176.3	55.2	0	0	0	0	117.7
79	E	37.3	Very low	33.6	Very low	181 Å²	181	130.4 Å²	130.4	85%	0.846	79%	0.788	S	S	*	*			cis	-161	177.2	-24.3	-114.9	-125.6	124.3	0	0	109.9
80	P	40.6	Very low	33.5	Very low	99 Å²	99	130 Å²	130	64%	0.643	79%	0.79	S	S	*	*			trans	-108.6	-170.9	-156.5	43.6	-39.2	0	0	0	115.1
81	L	35.2	Very low	33.3	Very low	157 Å²	157	130.3 Å²	130.3	82%	0.822	79%	0.791	S	S	*	*			trans	-152	104.6	153.8	-108	163.9	0	0	0	112.5
82	I	35.2	Very low	33.4	Very low	145 Å²	145	128.5 Å²	128.5	74%	0.744	78%	0.778	S	S	*	*			trans	40.8	110.7	135.8	-62	178.5	0	0	0	117.2
83	A	34.3	Very low	33.4	Very low	99 Å²	99	132 Å²	132	82%	0.818	78%	0.777	S	S	*	*				59.3	148.4	74.6	0	0	0	0	0	114.9
84	G	34.5	Very low	33.5	Very low	69 Å²	69	130.3 Å²	130.3	71%	0.711	77%	0.77	S	S	*	*			cis	-176.4	176.8	-2.3	0	0	0	0	0	112.4
85	I	31.1	Very low	33.5	Very low	171 Å²	171	131.3 Å²	131.3	88%	0.877	77%	0.774	S	S	*	*			trans	-37.2	133	176.1	-67.3	157.7	0	0	0	114.4
86	P	35.3	Very low	33.6	Very low	122 Å²	122	132 Å²	132	79%	0.792	77%	0.774	S	S	*	*				-149.6	169.2	102.9	39.1	-21.3	0	0	0	118.1
87	T	29.1	Very low	33.7	Very low	135 Å²	135	130.5 Å²	130.5	83%	0.828	77%	0.769	S	S	*	*			trans	-78.5	143.5	178.9	49	0	0	0	0	115.2
88	A	31.7	Very low	34	Very low	107 Å²	107	130.5 Å²	130.5	88%	0.884	77%	0.769	S	S	*	*			trans	-159.6	162.4	147	0	0	0	0	0	113.2
89	R	29.3	Very low	34.2	Very low	230 Å²	230	132.9 Å²	132.9	87%	0.868	77%	0.771	S	S	*	*			trans	-85.8	171.3	-175.1	-70.2	167.6	154.3	164.7	-9.3	114.1
90	T	29.2	Very low	34.2	Very low	117 Å²	117	132.6 Å²	132.6	72%	0.718	78%	0.775	S	S	*	*			trans	69.6	152.9	148.5	36.7	0	0	0	0	117.1
91	Q	32.3	Very low	33.9	Very low	164 Å²	164	130.7 Å²	130.7	77%	0.766	77%	0.774	S	S	*	*			cis	-153	150	6.1	-138.4	150.7	1.9	0	0	112.5
92	S	32.6	Very low	33.9	Very low	82 Å²	82	127 Å²	127	57%	0.573	77%	0.774	S	S	*	*			trans	41.5	165	144.1	65	0	0	0	0	125.1
93	D	35.5	Very low	34.2	Very low	157 Å²	157	128.5 Å²	128.5	84%	0.84	78%	0.775	S	S	*	*			trans	74.5	134	157.2	-45.2	-50.8	0	0	0	119.3
94	G	34.4	Very low	34.2	Very low	65 Å²	65	131.6 Å²	131.6	67%	0.67	77%	0.77	S	S	*	*			cis	174.1	-177.5	-5.5	0	0	0	0	0	112.9
95	V	35.9	Very low	34.8	Very low	129 Å²	129	136 Å²	136	78%	0.782	77%	0.772	S	S	*	*			trans	69.8	120.9	169.4	-174.7	0	0	0	0	115.3
96	T	32.1	Very low	35.5	Very low	118 Å²	118	134 Å²	134	72%	0.724	76%	0.759	S	S	*	*			cis	87.4	156.8	28.4	77.4	0	0	0	0	116.5
97	S	37.5	Very low	35.8	Very low	92 Å²	92	134.3 Å²	134.3	64%	0.643	75%	0.753	S	S	*	*			trans	74	145.7	170.2	-62.1	0	0	0	0	117.8
98	E	36.6	Very low	36.4	Very low	174 Å²	174	135.3 Å²	135.3	81%	0.813	75%	0.753	S	S	*	*			cis	-162.8	-171.1	-24.4	-128.1	136.5	-169.3	0	0	112.5
99	E	37.5	Very low	36.8	Very low	178 Å²	178	139 Å²	139	83%	0.832	74%	0.744	S	S	*	*			trans	-83.6	153.9	-167.8	-47.8	173.4	121.3	0	0	115
100	D	38.9	Very low	37.3	Very low	174 Å²	174	133 Å²	133	93%	0.93	74%	0.737	S	S	*	*			trans	179.2	158.4	139.1	-110.8	-27.7	0	0	0	111.5
101	G	34.3	Very low	37.9	Very low	59 Å²	59	135.5 Å²	135.5	61%	0.608	75%	0.745	S	S	*	*			cis	-176.9	36.2	5.7	0	0	0	0	0	117.1
102	G	33.8	Very low	38	Very low	80 Å²	80	139.6 Å²	139.6	83%	0.825	75%	0.753	S	S	*	*			trans	77.2	-161.3	156.8	0	0	0	0	0	121.2
103	K	43	Very low	38.1	Very low	176 Å²	176	140.8 Å²	140.8	77%	0.765	76%	0.761	S	S	*	*			trans	72.8	79	174.6	-60.1	-179.2	-178.1	173.2	0	120.3
104	F	34.2	Very low	38	Very low	164 Å²	164	141.3 Å²	141.3	72%	0.719	76%	0.763	S	S	*	*	S	Bend	trans	-135.3	-13.2	145.6	-158.7	-104	0	0	0	115.1	E106 L107	F104-E106 PolarHBondContact O-N 3.49Å; F104-E106 VanDerWaalsContact O-N 3.14Å; F104-L107 HydrophobicContact CE2-CD1 3.94Å; F104-L107 HydrophobicContact CZ-CD1 4.11Å
105	Q	45.8	Very low	37.9	Very low	163 Å²	163	144 Å²	144	76%	0.762	77%	0.771	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69	-6.4	176.4	-72.1	-162.9	2	0	0	114.8	L107	Q105-L107 VanDerWaalsContact C-N 3.29Å; Q105-L107 PolarHBondContact O-N 3.14Å
106	E	46.8	Very low	37.9	Very low	129 Å²	129	143.1 Å²	143.1	60%	0.603	77%	0.769	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.7	-30.4	177.5	-137.9	87.5	-100.7	0	0	112.6	F104 R109	F104-E106 PolarHBondContact O-N 3.49Å; F104-E106 VanDerWaalsContact O-N 3.14Å; E106-R109 IonicContact OE1-NH1 3.17Å
107	L	41.2	Very low	37.8	Very low	127 Å²	127	142.8 Å²	142.8	67%	0.665	77%	0.771	S	S	*	*	G	3₁₀ helix	trans	-82.2	-18.9	-167.4	-118.1	164.8	0	0	0	114.6	F104 Q105 R109	F104-L107 HydrophobicContact CE2-CD1 3.94Å; F104-L107 HydrophobicContact CZ-CD1 4.11Å; Q105-L107 VanDerWaalsContact C-N 3.29Å; Q105-L107 PolarHBondContact O-N 3.14Å; L107-R109 VanDerWaalsContact C-N 3.33Å; L107-R109 PolarHBondContact O-N 3.42Å
108	L	41.6	Very low	37.7	Very low	157 Å²	157	143.3 Å²	143.3	82%	0.822	78%	0.775	S	S	*	*	G	3₁₀ helix	trans	-87.7	8.4	-173.5	-73.6	172.8	0	0	0	114.7
109	R	39.8	Very low	37.4	Very low	184 Å²	184	138.9 Å²	138.9	69%	0.694	77%	0.768	S	S	*	*	G	3₁₀ helix	trans	-102.6	0.5	-170.2	-154.1	172.5	-76.1	125	-5.8	115.1	E106 L107	E106-R109 IonicContact OE1-NH1 3.17Å; L107-R109 VanDerWaalsContact C-N 3.33Å; L107-R109 PolarHBondContact O-N 3.42Å
110	S	41.6	Very low	37.3	Very low	104 Å²	104	139.1 Å²	139.1	73%	0.727	77%	0.769	S	S	*	*	S	Bend	trans	-110.6	-3.4	-165.1	-162.5	0	0	0	0	117.7
111	I	41.3	Very low	36.9	Very low	170 Å²	170	135.2 Å²	135.2	87%	0.872	76%	0.755	S	S	*	*			trans	-127.7	66.6	-175.6	-45.5	-178.9	0	0	0	110.7
112	R	33.3	Very low	36.7	Very low	250 Å²	250	139 Å²	139	94%	0.943	76%	0.762	S	S	*	*			trans	-150.1	67.2	176.4	-147.8	179	-163.2	-179.2	5.2	112.2
113	S	35.6	Very low	36.7	Very low	107 Å²	107	141 Å²	141	75%	0.748	76%	0.758	S	S	*	*			trans	-149.9	158.1	175.7	50.4	0	0	0	0	111.3
114	L	33.3	Very low	36.1	Very low	168 Å²	168	135.6 Å²	135.6	88%	0.88	75%	0.751	S	S	*	*			trans	84.9	103.3	-177.8	-55.6	174.2	0	0	0	117.1
115	S	31.8	Very low	36.1	Very low	120 Å²	120	133.5 Å²	133.5	84%	0.839	75%	0.754	S	S	*	*			trans	-144.9	141.9	154.9	-56	0	0	0	0	107.6
116	P	36.4	Very low	35.3	Very low	112 Å²	112	133.4 Å²	133.4	73%	0.727	76%	0.759	S	S	*	*			trans	-129	146.4	135.8	11.4	11.2	0	0	0	109.4
117	S	30.6	Very low	34.5	Very low	111 Å²	111	134.2 Å²	134.2	78%	0.776	77%	0.766	S	S	*	*				49.9	139.7	70.1	77.8	0	0	0	0	113.2
118	S	34.6	Very low	33.7	Very low	103 Å²	103	135.4 Å²	135.4	72%	0.72	77%	0.772	S	S	*	*			cis	-171.4	163	33.3	49	0	0	0	0	112.1
119	A	30.6	Very low	33.2	Very low	80 Å²	80	136.8 Å²	136.8	66%	0.661	77%	0.772	S	S	*	*			trans	65.7	159.8	150.5	0	0	0	0	0	117.8
120	E	34.8	Very low	32.6	Very low	183 Å²	183	132.2 Å²	132.2	86%	0.855	77%	0.769	S	S	*	*			cis	-149.6	-166.6	-4.1	-139.8	147	-133.6	0	0	111.4
121	S	30.3	Very low	32.3	Very low	93 Å²	93	136.1 Å²	136.1	65%	0.65	78%	0.775	S	S	*	*			trans	-78.3	-174.2	179.8	64	0	0	0	0	112.6
122	D	30	Very low	31.8	Very low	138 Å²	138	132 Å²	132	74%	0.738	76%	0.762	S	S	*	*			cis	-165.7	178.3	21.9	-134.1	-38.4	0	0	0	113.8
123	V	33.6	Very low	31.6	Very low	122 Å²	122	128.1 Å²	128.1	74%	0.739	76%	0.758	S	S	*	*			trans	50.3	120	149.7	174.2	0	0	0	0	120.4
124	G	31.4	Very low	31.5	Very low	62 Å²	62	127.2 Å²	127.2	64%	0.639	75%	0.747	S	S	*	*			trans	-89.5	171.8	153.7	0	0	0	0	0	112.2
125	P	34.8	Very low	31.4	Very low	120 Å²	120	126.2 Å²	126.2	78%	0.779	74%	0.743	S	S	*	*				-153.3	-163.4	79.1	42.8	-23.9	0	0	0	114.9
126	N	28.5	Very low	31.6	Very low	161 Å²	161	126.9 Å²	126.9	86%	0.861	74%	0.736	S	S	*	*			trans	-53	131.6	172.9	-53.3	-48.4	0	0	0	113.5
127	I	29	Very low	31.6	Very low	146 Å²	146	129.8 Å²	129.8	75%	0.749	74%	0.74	S	S	*	*			trans	-133.9	132.1	149.9	-65.3	-174.9	0	0	0	108.2	F129	I127-F129 HydrophobicContact CG2-CD2 4.27Å; I127-F129 HydrophobicContact CG2-CE2 4.18Å
128	L	25.5	Very low	32	Very low	152 Å²	152	130.6 Å²	130.6	80%	0.796	74%	0.735	S	S	*	*			trans	-78	138.1	172	-75.4	151.5	0	0	0	110
129	F	30.8	Very low	32.1	Very low	186 Å²	186	132.5 Å²	132.5	82%	0.816	74%	0.737	S	S	*	*			trans	-126	84.5	151.9	-94.8	-78.3	0	0	0	109.9	I127	I127-F129 HydrophobicContact CG2-CD2 4.27Å; I127-F129 HydrophobicContact CG2-CE2 4.18Å
130	S	27.7	Very low	32.5	Very low	89 Å²	89	135.1 Å²	135.1	62%	0.622	74%	0.74	S	S	*	*			trans	-84.1	109.8	157.6	49.9	0	0	0	0	108.7
131	E	33.8	Very low	32.6	Very low	185 Å²	185	134.5 Å²	134.5	86%	0.864	74%	0.737	S	S	*	*			trans	-107.9	76.1	156.5	-74	-162.1	147.2	0	0	109
132	S	31.7	Very low	32.9	Very low	84 Å²	84	137 Å²	137	59%	0.587	74%	0.739	S	S	*	*			trans	-68.5	139.2	153.5	49.6	0	0	0	0	109.7
133	I	28.8	Very low	33	Very low	169 Å²	169	137.8 Å²	137.8	87%	0.867	74%	0.738	S	S	*	*			trans	-119.7	129.5	140.9	-66.5	-176	0	0	0	105.9
134	V	34.1	Very low	33.1	Very low	87 Å²	87	140.4 Å²	140.4	53%	0.527	74%	0.742	S	S	.	*			trans	-94.9	-151.6	-178.1	-153.4	0	0	0	0	106.7	I136	V134-I136 HydrophobicContact CG1-CD1 4.09Å; V134-I136 HydrophobicContact CG1-CG1 4Å
135	D	30.1	Very low	33.2	Very low	148 Å²	148	142.2 Å²	142.2	79%	0.791	74%	0.743	S	S	*	*			cis	-139.9	171.2	36.4	-75.1	-58.7	0	0	0	111.9
136	I	36	Very low	33.3	Very low	134 Å²	134	141.5 Å²	141.5	69%	0.687	74%	0.738	S	S	*	*			trans	-115.3	-167.4	-175.8	-61.2	160.4	0	0	0	107	V134	V134-I136 HydrophobicContact CG1-CD1 4.09Å; V134-I136 HydrophobicContact CG1-CG1 4Å
137	E	36.2	Very low	33.5	Very low	173 Å²	173	140.1 Å²	140.1	81%	0.808	74%	0.736	S	S	*	*			trans	84.3	141.2	161.8	-51.2	178.1	-173.8	0	0	116.1
138	D	38.7	Very low	33.6	Very low	127 Å²	127	138.7 Å²	138.7	68%	0.679	74%	0.739	S	S	*	*			cis	-167.6	177.5	-37.2	-107	-30.3	0	0	0	107.3
139	D	38.5	Very low	34	Very low	143 Å²	143	136.2 Å²	136.2	77%	0.765	74%	0.74	S	S	*	*			trans	64	155.1	160.5	-60.5	-13.8	0	0	0	118.1
140	D	38	Very low	34.1	Very low	136 Å²	136	138.4 Å²	138.4	73%	0.727	75%	0.745	S	S	*	*			cis	-156.2	165.3	-26.9	-134.3	-25.9	0	0	0	109.3
141	E	37.9	Very low	34.2	Very low	169 Å²	169	137.8 Å²	137.8	79%	0.79	75%	0.745	S	S	*	*			trans	55.9	173.4	160.4	-73.4	-171.7	171	0	0	118.9
142	E	35.8	Very low	34.2	Very low	146 Å²	146	138.6 Å²	138.6	68%	0.682	75%	0.746	S	S	*	*				-143.7	170.8	-59	-135.4	-163.9	-173.9	0	0	110.5
143	Q	31.8	Very low	34.2	Very low	155 Å²	155	139.8 Å²	139.8	72%	0.724	75%	0.754	S	S	*	*			trans	65.4	114.1	156.7	-66.4	176.1	38.5	0	0	123.3
144	E	35	Very low	34.2	Very low	176 Å²	176	136 Å²	136	82%	0.822	75%	0.748	S	S	*	*			trans	79.3	150.8	131.2	-66.2	-69.5	106.2	0	0	123.2
145	P	35.3	Very low	34.2	Very low	100 Å²	100	138.7 Å²	138.7	65%	0.649	76%	0.764	S	S	*	*			trans	-118.5	-169.3	-176.8	45.9	-34.8	0	0	0	113.3
146	P	36.5	Very low	34.2	Very low	105 Å²	105	136.8 Å²	136.8	68%	0.682	76%	0.762	S	S	*	*			cis	-128.5	-172.2	-29.6	22.7	1.1	0	0	0	113.4
147	T	32.6	Very low	34.5	Very low	133 Å²	133	135.4 Å²	135.4	82%	0.816	76%	0.762	S	S	*	*			trans	91.2	146.9	154.8	76.6	0	0	0	0	121.2
148	S	31.8	Very low	34.4	Very low	116 Å²	116	133.9 Å²	133.9	81%	0.811	76%	0.76	S	S	*	*			trans	66.2	98.2	151.1	-176.5	0	0	0	0	121
149	A	33.6	Very low	34.1	Very low	100 Å²	100	135.1 Å²	135.1	83%	0.826	77%	0.765	S	S	*	*				178.2	167	118.1	0	0	0	0	0	113.5
150	Y	31.9	Very low	33.9	Very low	231 Å²	231	132.8 Å²	132.8	91%	0.906	76%	0.76	S	S	*	*			trans	-91	148.4	-170.6	-104.5	-112.8	0	0	0	115.4
151	A	31	Very low	33.7	Very low	77 Å²	77	134.2 Å²	134.2	64%	0.636	77%	0.766	S	S	*	*			trans	82.3	122.1	134.2	0	0	0	0	0	124.2
152	K	33.1	Very low	33.5	Very low	201 Å²	201	130.1 Å²	130.1	87%	0.874	76%	0.755	S	S	*	*			trans	75.5	115.1	130.3	-70.5	178	178.8	-177.4	0	122.4
153	S	30.6	Very low	33.4	Very low	110 Å²	110	130.2 Å²	130.2	77%	0.769	76%	0.761	S	S	*	*				94.8	94.3	117.6	-167.6	0	0	0	0	123.1
154	A	30.3	Very low	33.7	Very low	88 Å²	88	127.7 Å²	127.7	73%	0.727	76%	0.76	S	S	*	*				79.9	155.5	125.3	0	0	0	0	0	123.9
155	V	33.3	Very low	33.8	Very low	145 Å²	145	124.8 Å²	124.8	88%	0.879	76%	0.76	S	S	*	*			trans	93.2	144.5	163.6	-166.1	0	0	0	0	118.4
156	S	30.7	Very low	34.5	Very low	107 Å²	107	124.7 Å²	124.7	75%	0.748	76%	0.759	S	S	*	*			trans	-108.2	-158.9	-167.7	-36.4	0	0	0	0	112.5
157	P	42.8	Very low	34.8	Very low	106 Å²	106	130 Å²	130	69%	0.688	77%	0.767	S	S	*	*			cis	-144.5	-178.2	-11.8	41.7	-21.7	0	0	0	118.9
158	N	33.4	Very low	35	Very low	141 Å²	141	128 Å²	128	75%	0.754	76%	0.758	S	S	*	*			trans	86.8	126.4	143.5	-71.5	-15.7	0	0	0	127.3
159	I	33.1	Very low	35.4	Very low	152 Å²	152	127.2 Å²	127.2	78%	0.779	75%	0.753	S	S	*	*			trans	81.9	152.3	136.6	-75.4	169.1	0	0	0	122.3
160	S	33.3	Very low	35.6	Very low	95 Å²	95	128.2 Å²	128.2	66%	0.664	75%	0.753	S	S	*	*			cis	-177.9	166.3	-42.1	-76.8	0	0	0	0	113.8
161	I	32.9	Very low	36.6	Very low	166 Å²	166	122.8 Å²	122.8	85%	0.851	75%	0.747	S	S	*	*			trans	81.2	154.4	152.4	-87.7	162.2	0	0	0	121.7
162	S	34.2	Very low	37.1	Very low	82 Å²	82	127.3 Å²	127.3	57%	0.573	76%	0.758	S	S	*	*			cis	-176.2	171.6	-46.9	74.6	0	0	0	0	114.7
163	N	34.3	Very low	37.4	Very low	149 Å²	149	123.1 Å²	123.1	80%	0.797	75%	0.752	S	S	*	*			trans	80.8	160.2	159.2	-57.9	6.7	0	0	0	122
164	S	37.2	Very low	37.8	Very low	101 Å²	101	128.2 Å²	128.2	71%	0.706	75%	0.754	S	S	*	*			cis	179.7	141.4	-37.3	63.4	0	0	0	0	116.8
165	S	38.8	Very low	38.2	Very low	116 Å²	116	129.7 Å²	129.7	81%	0.811	76%	0.756	S	S	*	*			trans	70.9	-176.5	152.1	-129	0	0	0	0	120.6
166	P	49.7	Very low	38.2	Very low	97 Å²	97	127 Å²	127	63%	0.63	74%	0.74	S	S	*	*			cis	-146.7	-170.4	-4.5	26.8	2.4	0	0	0	119.9
167	Y	43	Very low	38.5	Very low	218 Å²	218	131.2 Å²	131.2	86%	0.855	75%	0.745	S	S	*	*			trans	79.4	152.2	163.2	-68.2	-92.5	0	0	0	122.2
168	S	37	Very low	38.2	Very low	91 Å²	91	131.7 Å²	131.7	64%	0.636	75%	0.748	S	S	*	*			cis	-179.1	159	-22.2	175.7	0	0	0	0	117.6
169	S	39.4	Very low	38.5	Very low	99 Å²	99	129.6 Å²	129.6	69%	0.692	75%	0.745	S	S	*	*			trans	86.3	111.5	140.2	35.7	0	0	0	0	127.9
170	S	37.8	Very low	39.1	Very low	120 Å²	120	128.2 Å²	128.2	84%	0.839	75%	0.746	S	S	*	*				105.3	152.5	115	-63.6	0	0	0	0	125.4
171	P	53.2	Low	39.2	Very low	118 Å²	118	131.8 Å²	131.8	77%	0.766	75%	0.751	S	S	*	*			trans	-134.9	-177.7	-162.7	44	-25.5	0	0	0	118.2
172	I	40.9	Very low	39.5	Very low	172 Å²	172	129.3 Å²	129.3	88%	0.882	75%	0.746	S	S	*	*			trans	-166.4	158.8	162.6	-107.9	152.4	0	0	0	114.9
173	P	40.4	Very low	39.7	Very low	113 Å²	113	131.8 Å²	131.8	73%	0.734	76%	0.758	S	S	*	*			trans	-139.7	170.7	-164.5	43.2	-25.1	0	0	0	121.4
174	R	38	Very low	39.8	Very low	216 Å²	216	129.8 Å²	129.8	82%	0.815	76%	0.755	S	S	*	*			trans	70.7	166.1	157.9	-111.4	-175	-165.9	-131.3	5.1	118.7	T176	R174-T176 PolarHBondContact NH1-OG1 2.77Å
175	P	38.9	Very low	39.8	Very low	120 Å²	120	130.7 Å²	130.7	78%	0.779	76%	0.759	S	S	*	*			cis	-133.2	-160.2	48.2	42.8	-24.3	0	0	0	117.2
176	T	34.2	Very low	39.5	Very low	87 Å²	87	130.2 Å²	130.2	53%	0.534	76%	0.755	S	S	.	*			trans	-153.6	146.7	-168.2	-46.9	0	0	0	0	111.5	R174	R174-T176 PolarHBondContact NH1-OG1 2.77Å
177	F	36.4	Very low	38.8	Very low	197 Å²	197	131.6 Å²	131.6	86%	0.864	77%	0.765	S	S	*	*			trans	-152.1	165.4	174.5	-94.3	-57.7	0	0	0	111.8
178	P	36.2	Very low	38.3	Very low	115 Å²	115	126.6 Å²	126.6	75%	0.747	76%	0.761	S	S	*	*				-127.2	170.1	-116.5	43.3	-30.4	0	0	0	117.5
179	S	38.9	Very low	38.4	Very low	98 Å²	98	127.6 Å²	127.6	69%	0.685	77%	0.765	S	S	*	*			trans	-77.6	167.9	166.1	-46.7	0	0	0	0	113.2
180	P	46	Very low	37.9	Very low	123 Å²	123	131.4 Å²	131.4	80%	0.799	77%	0.772	S	S	*	*				-130.7	135.5	129	36	-27.5	0	0	0	114.3
181	H	35.4	Very low	37.5	Very low	169 Å²	169	132.3 Å²	132.3	78%	0.782	77%	0.767	S	S	*	*			trans	-86.4	-173	152.2	-58.7	-89.5	0	0	0	108.3
182	P	40	Very low	36.3	Very low	115 Å²	115	132.1 Å²	132.1	75%	0.747	77%	0.767	S	S	*	*			cis	-132.6	-171.4	-5.5	36	-14.9	0	0	0	113.9
183	V	38.8	Very low	36.2	Very low	134 Å²	134	129.1 Å²	129.1	81%	0.812	76%	0.759	S	S	*	*				159.7	125.3	125	162.2	0	0	0	0	110.3
184	S	34.7	Very low	35.6	Very low	107 Å²	107	129.5 Å²	129.5	75%	0.748	76%	0.76	S	S	*	*			trans	-96.2	-176.4	174.3	-37.1	0	0	0	0	110.3
185	P	39.1	Very low	35.3	Very low	120 Å²	120	129 Å²	129	78%	0.779	76%	0.757	S	S	*	*			cis	-134	-162.4	-3.1	41.1	-21.2	0	0	0	114.1
186	S	31	Very low	35.1	Very low	105 Å²	105	129.7 Å²	129.7	73%	0.734	75%	0.75	S	S	*	*			trans	-54.4	160.6	178	-37	0	0	0	0	115.7
187	P	36.1	Very low	34.8	Very low	127 Å²	127	131 Å²	131	83%	0.825	76%	0.759	S	S	*	*				-138.1	174	92.6	40.1	-29.2	0	0	0	116.2
188	S	32	Very low	34.7	Very low	112 Å²	112	127.5 Å²	127.5	78%	0.783	75%	0.753	S	S	*	*			trans	-81.8	174.6	-176.6	-50.7	0	0	0	0	113.2
189	P	38.4	Very low	34.5	Very low	112 Å²	112	129.1 Å²	129.1	73%	0.727	75%	0.751	S	S	*	*			trans	-91.3	165.9	-158.9	37.7	-37.6	0	0	0	115.2
190	Q	29.7	Very low	34.3	Very low	179 Å²	179	131.5 Å²	131.5	84%	0.836	75%	0.749	S	S	*	*			trans	-173.4	155.1	142.4	-106.3	164.6	91.2	0	0	114.7
191	L	29.7	Very low	33.7	Very low	140 Å²	140	133.3 Å²	133.3	73%	0.733	75%	0.747	S	S	*	*			trans	50	125.5	155.2	-86.3	69.2	0	0	0	122.6
192	C	28.6	Very low	33.7	Very low	113 Å²	113	134.9 Å²	134.9	76%	0.764	76%	0.755	S	S	*	*				24.8	159.1	103.5	-53.8	0	0	0	0	119.9
193	P	37.7	Very low	33.4	Very low	110 Å²	110	134.1 Å²	134.1	71%	0.714	75%	0.752	S	S	*	*			cis	-149.1	177	25	44.1	-23.5	0	0	0	119.3
194	T	27.7	Very low	33.4	Very low	121 Å²	121	133.1 Å²	133.1	74%	0.742	75%	0.748	S	S	*	*			trans	33.7	131.5	145.3	56.8	0	0	0	0	123.3
195	R	31.7	Very low	33.3	Very low	204 Å²	204	134.8 Å²	134.8	77%	0.77	75%	0.753	S	S	*	*				166.8	144.4	117.5	-88.8	173.7	106.3	136.5	17.5	108.6
196	E	34.7	Very low	32.9	Very low	135 Å²	135	133.3 Å²	133.3	63%	0.631	75%	0.752	S	S	*	*			cis	-154	171.2	-2.6	-135.9	153.9	-177.4	0	0	111.7
197	T	28.8	Very low	32.9	Very low	116 Å²	116	133.9 Å²	133.9	71%	0.712	75%	0.754	S	S	*	*			trans	-46.5	148.3	174.2	49.3	0	0	0	0	114.9
198	T	33.5	Very low	32.7	Very low	122 Å²	122	134.1 Å²	134.1	75%	0.748	75%	0.749	S	S	*	*				-164.9	156.9	67.9	26.7	0	0	0	0	114.4
199	E	32	Very low	32.8	Very low	149 Å²	149	137 Å²	137	70%	0.696	75%	0.748	S	S	*	*			trans	-5.8	150.4	143.2	-67	172.5	-131.7	0	0	118.7
200	K	34.2	Very low	32.8	Very low	148 Å²	148	136.9 Å²	136.9	64%	0.643	74%	0.744	S	S	*	*			cis	-160.9	166.6	29.2	-137.5	174.4	-171.8	89.5	0	113
201	E	33.6	Very low	33.3	Very low	162 Å²	162	138.2 Å²	138.2	76%	0.757	74%	0.742	S	S	*	*			trans	21.3	119.9	152.8	-70.1	158	156.3	0	0	121.4
202	E	35.8	Very low	33.7	Very low	202 Å²	202	139 Å²	139	94%	0.944	74%	0.742	S	S	*	*				-165.9	165.7	111.8	-109.4	179.3	-171.1	0	0	112.6
203	S	32.8	Very low	34	Very low	99 Å²	99	140.2 Å²	140.2	69%	0.692	74%	0.74	S	S	*	*			trans	-122.9	166.4	-175.1	83.7	0	0	0	0	110.4
204	P	38.9	Very low	34.2	Very low	113 Å²	113	142.3 Å²	142.3	73%	0.734	74%	0.744	S	S	*	*				-153.3	148	63.6	38.6	-16.7	0	0	0	119.5
205	V	33.4	Very low	34.8	Very low	141 Å²	141	140.1 Å²	140.1	86%	0.855	74%	0.739	S	S	*	*			trans	32.1	110.6	131.7	-169.8	0	0	0	0	120.2
206	A	30.5	Very low	35	Very low	90 Å²	90	137.6 Å²	137.6	74%	0.744	74%	0.74	S	S	*	*			trans	-158.2	143.2	140.4	0	0	0	0	0	113.1
207	C	31	Very low	35.1	Very low	117 Å²	117	141 Å²	141	79%	0.791	76%	0.756	S	S	*	*			trans	70.2	44.3	157	-63.9	0	0	0	0	121.6	F209	C207-F209 PolarHBondContact O-N 2.78Å
208	D	32.8	Very low	35.5	Very low	132 Å²	132	139.6 Å²	139.6	71%	0.706	76%	0.757	S	S	*	*	G	3₁₀ helix	trans	-72.7	-8.8	166.1	-110	-43.9	0	0	0	115	V210 R211	D208-V210 PolarHBondContact O-N 3.2Å; D208-R211 PolarHBondContact O-N 2.77Å
209	F	33.3	Very low	36	Very low	173 Å²	173	143.1 Å²	143.1	76%	0.759	76%	0.761	S	S	*	*	G	3₁₀ helix	trans	-66.5	-7.2	-167.9	-149.7	-97.6	0	0	0	115.7	C207 L213	C207-F209 PolarHBondContact O-N 2.78Å; F209-L213 HydrophobicContact CE1-CD1 4.49Å
210	V	37.7	Very low	36.1	Very low	109 Å²	109	145.8 Å²	145.8	66%	0.661	77%	0.774	S	S	*	*	G	3₁₀ helix	trans	-100.5	-20	-173.3	-176.9	0	0	0	0	113.1	D208	D208-V210 PolarHBondContact O-N 3.2Å
211	R	39.8	Very low	36.3	Very low	206 Å²	206	146.5 Å²	146.5	78%	0.777	78%	0.78	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.4	-35.7	179.5	-83.5	-178.2	170.3	151.9	-2.2	114	D208 L213 L214	D208-R211 PolarHBondContact O-N 2.77Å; R211-L213 VanDerWaalsContact C-N 3.33Å; R211-L213 PolarHBondContact O-N 3.31Å; R211-L214 PolarHBondContact O-N 3.46Å
212	Q	39.3	Very low	36.3	Very low	158 Å²	158	142.7 Å²	142.7	74%	0.738	77%	0.771	S	S	*	*	G	3₁₀ helix	trans	-71.2	-24.1	-177	-75	178.5	-23.6	0	0	114	L214	Q212-L214 PolarHBondContact O-N 3.27Å
213	L	34.5	Very low	36.5	Very low	137 Å²	137	138.3 Å²	138.3	72%	0.717	76%	0.76	S	S	*	*	G	3₁₀ helix	trans	-75.9	-4.3	175.3	-83	167.3	0	0	0	114.6	F209 R211	F209-L213 HydrophobicContact CE1-CD1 4.49Å; R211-L213 VanDerWaalsContact C-N 3.33Å; R211-L213 PolarHBondContact O-N 3.31Å
214	L	41.3	Very low	36.9	Very low	154 Å²	154	141.8 Å²	141.8	81%	0.806	76%	0.763	S	S	*	*	G	3₁₀ helix	trans	-106.5	5.7	178.2	-75.2	165.7	0	0	0	113.6	R211 Q212	R211-L214 PolarHBondContact O-N 3.46Å; Q212-L214 PolarHBondContact O-N 3.27Å
215	A	40.4	Very low	37.1	Very low	76 Å²	76	138.9 Å²	138.9	63%	0.628	75%	0.745	S	S	*	*	S	Bend	trans	-101.4	-13.7	-177.1	0	0	0	0	0	114.8
216	D	36.8	Very low	37.8	Very low	151 Å²	151	134.5 Å²	134.5	81%	0.807	72%	0.721	S	S	*	*	S	Bend	trans	-97.5	-11.3	-164.3	-121.5	15.1	0	0	0	115	A218	D216-A218 PolarHBondContact O-N 3.08Å; D216-A218 VanDerWaalsContact O-N 3.09Å
217	E	36.7	Very low	38.7	Very low	205 Å²	205	136.9 Å²	136.9	96%	0.958	71%	0.714	S	S	*	*			trans	-86.2	49.6	176.7	-67.3	-156.6	146.4	0	0	112.8
218	A	37.5	Very low	39.7	Very low	88 Å²	88	135.4 Å²	135.4	73%	0.727	70%	0.701	S	S	*	*			trans	-111.6	46.8	176.7	0	0	0	0	0	112.6	D216	D216-A218 PolarHBondContact O-N 3.08Å; D216-A218 VanDerWaalsContact O-N 3.09Å
219	K	43.7	Very low	40.8	Very low	195 Å²	195	133.7 Å²	133.7	85%	0.848	70%	0.696	S	S	*	*			trans	-135.5	120.3	169.6	-73	-174.9	177.7	174.2	0	110.7	E221	K219-E221 PolarHBondContact O-N 2.94Å
220	E	33.8	Very low	42	Very low	206 Å²	206	132.3 Å²	132.3	96%	0.963	69%	0.69	S	S	*	*			trans	-69.7	111	176.6	-67.4	-175	98	0	0	111.3
221	E	37.8	Very low	42.7	Very low	163 Å²	163	130.9 Å²	130.9	76%	0.762	68%	0.678	S	S	*	*			trans	-117.7	137.5	157.9	-79.2	-162.2	-174.5	0	0	110.5	K219	K219-E221 PolarHBondContact O-N 2.94Å
222	S	34.5	Very low	42.9	Very low	81 Å²	81	124.2 Å²	124.2	57%	0.566	66%	0.662	S	S	*	*			trans	-58.8	142.1	-166.8	74.8	0	0	0	0	113.6	K224 S225	S222-K224 PolarHBondContact O-N 2.86Å; S222-S225 PolarHBondContact O-N 3.24Å; S222-S225 PolarHBondContact O-OG 3.26Å
223	P	40.1	Very low	43.7	Very low	111 Å²	111	119.1 Å²	119.1	72%	0.721	65%	0.647	S	S	*	*	H	α-helix	trans	-63.2	-12	-167.6	22.3	-34.2	0	0	0	115.5
224	K	41.9	Very low	44.5	Very low	172 Å²	172	115.1 Å²	115.1	75%	0.748	63%	0.63	S	S	*	*	H	α-helix	trans	-71.6	-31.2	-179.8	-65	177.9	-178.4	174	0	113	S222	S222-K224 PolarHBondContact O-N 2.86Å
225	S	41.6	Very low	44.8	Very low	51 Å²	51	111.7 Å²	111.7	36%	0.357	61%	0.612	S	S	.	*	H	α-helix	trans	-69	-47.3	-179.4	65	0	0	0	0	111.7	S222 F227 V228 T229	S222-S225 PolarHBondContact O-N 3.24Å; S222-S225 PolarHBondContact O-OG 3.26Å; S225-F227 VanDerWaalsContact C-N 3.29Å; S225-F227 PolarHBondContact O-N 3.39Å; S225-V228 PolarHBondContact O-N 3.11Å; S225-T229 PolarHBondContact O-N 3.48Å; S225-T229 VanDerWaalsContact O-N 3.07Å; S225-T229 PolarHBondContact O-OG1 2.91Å
226	S	49.2	Very low	45.7	Very low	50 Å²	50	112.1 Å²	112.1	35%	0.35	61%	0.607	S	S	.	*	H	α-helix	trans	-64	-32.8	-175.6	94.5	0	0	0	0	112.9	K230	S226-K230 VanDerWaalsContact O-CB 3.3Å; S226-K230 WeakPolarHBondContact O-CB 3.24Å; S226-K230 WeakPolarHBondContact O-CD 3.25Å; S226-K230 WeakPolarHBondContact O-CG 3.34Å; S226-K230 PolarHBondContact O-N 3.45Å; S226-K230 PolarHBondContact OG-NZ 2.88Å
227	F	48.7	Very low	46.6	Very low	139 Å²	139	109.5 Å²	109.5	61%	0.61	59%	0.593	S	S	*	*	H	α-helix	trans	-64.7	-48.9	176.5	-177.4	-99.1	0	0	0	111.7	S225 T229 K230 L231	S225-F227 VanDerWaalsContact C-N 3.29Å; S225-F227 PolarHBondContact O-N 3.39Å; F227-T229 PolarHBondContact O-N 3.41Å; F227-K230 PolarHBondContact O-N 2.86Å; F227-L231 HydrophobicContact CD1-CD1 4.49Å; F227-L231 HydrophobicContact CE1-CD1 3.66Å; F227-L231 HydrophobicContact CZ-CD1 3.79Å; F227-L231 VanDerWaalsContact O-CB 3.28Å; F227-L231 WeakPolarHBondContact O-CB 3.43Å; F227-L231 PolarHBondContact O-N 3.4Å
228	V	53	Low	47.4	Very low	86 Å²	86	106 Å²	106	52%	0.521	57%	0.571	S	S	.	*	H	α-helix	trans	-61.4	-45.1	178	178.8	0	0	0	0	110.4	S225 K230 L231 C232	S225-V228 PolarHBondContact O-N 3.11Å; V228-K230 PolarHBondContact O-N 3.26Å; V228-L231 PolarHBondContact O-N 3.13Å; V228-C232 WeakPolarHBondContact O-CB 3.35Å; V228-C232 PolarHBondContact O-N 3.04Å; V228-C232 PolarHBondContact O-SG 3.24Å; V228-C232 VanDerWaalsContact O-SG 3.36Å
229	T	54.8	Low	47.9	Very low	97 Å²	97	109.8 Å²	109.8	60%	0.595	57%	0.568	S	S	*	*	H	α-helix	trans	-61.9	-44.9	178.1	-57.3	0	0	0	0	112.4	S225 F227 L231 C232 A233	S225-T229 PolarHBondContact O-N 3.48Å; S225-T229 VanDerWaalsContact O-N 3.07Å; S225-T229 PolarHBondContact O-OG1 2.91Å; F227-T229 PolarHBondContact O-N 3.41Å; T229-L231 VanDerWaalsContact C-N 3.34Å; T229-L231 PolarHBondContact O-N 2.85Å; T229-C232 PolarHBondContact O-N 3.34Å; T229-A233 WeakPolarHBondContact O-CB 3.34Å; T229-A233 PolarHBondContact O-N 3.31Å
230	K	59.3	Low	48.6	Very low	143 Å²	143	104.4 Å²	104.4	62%	0.622	55%	0.548	S	S	*	.	H	α-helix	trans	-63.4	-38.2	175.5	-73.4	163.9	-176.6	161.7	0	111.8	S226 F227 V228 S234	S226-K230 VanDerWaalsContact O-CB 3.3Å; S226-K230 WeakPolarHBondContact O-CB 3.24Å; S226-K230 WeakPolarHBondContact O-CD 3.25Å; S226-K230 WeakPolarHBondContact O-CG 3.34Å; S226-K230 PolarHBondContact O-N 3.45Å; S226-K230 PolarHBondContact OG-NZ 2.88Å; F227-K230 PolarHBondContact O-N 2.86Å; V228-K230 PolarHBondContact O-N 3.26Å; K230-S234 WeakPolarHBondContact O-CB 3.44Å; K230-S234 PolarHBondContact O-N 2.92Å
231	L	51	Low	49.9	Very low	80 Å²	80	100 Å²	100	42%	0.419	53%	0.529	S	S	.	.	H	α-helix	trans	-71.2	-40.7	178.4	-161.5	151.4	0	0	0	111.5	F227 V228 T229 S234 L235	F227-L231 HydrophobicContact CD1-CD1 4.49Å; F227-L231 HydrophobicContact CE1-CD1 3.66Å; F227-L231 HydrophobicContact CZ-CD1 3.79Å; F227-L231 VanDerWaalsContact O-CB 3.28Å; F227-L231 WeakPolarHBondContact O-CB 3.43Å; F227-L231 PolarHBondContact O-N 3.4Å; V228-L231 PolarHBondContact O-N 3.13Å; T229-L231 VanDerWaalsContact C-N 3.34Å; T229-L231 PolarHBondContact O-N 2.85Å; L231-S234 WeakPolarHBondContact O-CB 3.44Å; L231-S234 PolarHBondContact O-N 3.32Å; L231-L235 HydrophobicContact CD2-CD1 3.69Å; L231-L235 HydrophobicContact CD2-CG 4.2Å; L231-L235 WeakPolarHBondContact O-CG 3.35Å; L231-L235 PolarHBondContact O-N 2.94Å
232	C	45.7	Very low	50.4	Low	66 Å²	66	99.3 Å²	99.3	45%	0.446	52%	0.52	S	S	.	.	H	α-helix	trans	-61.2	-46.5	171.2	-73.6	0	0	0	0	112.2	V228 T229 S234 L235 V236	V228-C232 WeakPolarHBondContact O-CB 3.35Å; V228-C232 PolarHBondContact O-N 3.04Å; V228-C232 PolarHBondContact O-SG 3.24Å; V228-C232 VanDerWaalsContact O-SG 3.36Å; T229-C232 PolarHBondContact O-N 3.34Å; C232-S234 VanDerWaalsContact C-N 3.34Å; C232-S234 PolarHBondContact O-N 2.83Å; C232-L235 PolarHBondContact O-N 3.33Å; C232-V236 WeakPolarHBondContact O-CG2 3.25Å; C232-V236 PolarHBondContact O-N 3Å
233	A	55.5	Low	51.3	Low	50 Å²	50	97.5 Å²	97.5	41%	0.413	50%	0.502	S	S	.	.	H	α-helix	trans	-61.2	-41.2	176.2	0	0	0	0	0	112.2	T229 V236 N237	T229-A233 WeakPolarHBondContact O-CB 3.34Å; T229-A233 PolarHBondContact O-N 3.31Å; A233-V236 PolarHBondContact O-N 3.09Å; A233-N237 WeakPolarHBondContact O-CB 3.44Å; A233-N237 PolarHBondContact O-N 2.87Å
234	S	50.7	Low	52.4	Low	53 Å²	53	97.5 Å²	97.5	37%	0.371	49%	0.492	S	S	.	.	H	α-helix	trans	-61.1	-42.4	173.8	-174.2	0	0	0	0	112.4	K230 L231 C232 R238	K230-S234 WeakPolarHBondContact O-CB 3.44Å; K230-S234 PolarHBondContact O-N 2.92Å; L231-S234 WeakPolarHBondContact O-CB 3.44Å; L231-S234 PolarHBondContact O-N 3.32Å; C232-S234 VanDerWaalsContact C-N 3.34Å; C232-S234 PolarHBondContact O-N 2.83Å; S234-R238 WeakPolarHBondContact O-CB 3.22Å; S234-R238 VanDerWaalsContact O-CG 3.28Å; S234-R238 WeakPolarHBondContact O-CG 3.28Å; S234-R238 PolarHBondContact O-N 2.67Å
235	L	48	Very low	53.4	Low	82 Å²	82	93.1 Å²	93.1	43%	0.429	48%	0.483	S	S	.	.	H	α-helix	trans	-65.8	-45.2	175.1	-73.7	173.2	0	0	0	112.3	L231 C232 N237 R238 Y239	L231-L235 HydrophobicContact CD2-CD1 3.69Å; L231-L235 HydrophobicContact CD2-CG 4.2Å; L231-L235 WeakPolarHBondContact O-CG 3.35Å; L231-L235 PolarHBondContact O-N 2.94Å; C232-L235 PolarHBondContact O-N 3.33Å; L235-N237 PolarHBondContact O-N 3.23Å; L235-R238 PolarHBondContact O-N 2.98Å; L235-Y239 WeakPolarHBondContact O-CD2 3.27Å; L235-Y239 PolarHBondContact O-N 3.31Å
236	V	59.2	Low	54.2	Low	85 Å²	85	93.4 Å²	93.4	52%	0.515	48%	0.478	S	S	.	.	H	α-helix	trans	-60.3	-46.9	177.9	170.1	0	0	0	0	110.9	C232 A233 R238 Y239 I240	C232-V236 WeakPolarHBondContact O-CG2 3.25Å; C232-V236 PolarHBondContact O-N 3Å; A233-V236 PolarHBondContact O-N 3.09Å; V236-R238 PolarHBondContact O-N 2.77Å; V236-Y239 WeakPolarHBondContact O-CB 3.34Å; V236-Y239 PolarHBondContact O-N 3.14Å; V236-Y239 VanDerWaalsContact O-N 3.13Å; V236-I240 HydrophobicContact CG1-CD1 3.86Å; V236-I240 HydrophobicContact CG1-CG1 4.49Å; V236-I240 WeakPolarHBondContact O-CG1 3.12Å; V236-I240 PolarHBondContact O-N 3.47Å
237	N	56.4	Low	54.9	Low	97 Å²	97	93.7 Å²	93.7	52%	0.519	47%	0.474	S	S	.	.	H	α-helix	trans	-62.6	-39.5	176.6	-77.6	-22.6	0	0	0	112.5	A233 L235 Y239 I240 I241	A233-N237 WeakPolarHBondContact O-CB 3.44Å; A233-N237 PolarHBondContact O-N 2.87Å; L235-N237 PolarHBondContact O-N 3.23Å; N237-Y239 VanDerWaalsContact C-N 3.34Å; N237-Y239 PolarHBondContact O-N 3.26Å; N237-I240 PolarHBondContact O-N 3.3Å; N237-I241 VanDerWaalsContact O-CG1 3.29Å; N237-I241 WeakPolarHBondContact O-CG1 3.27Å; N237-I241 PolarHBondContact O-N 3.27Å
238	R	52.7	Low	55.9	Low	132 Å²	132	92.1 Å²	92.1	50%	0.498	47%	0.472	S	S	.	.	H	α-helix	trans	-63.3	-37.8	172.8	-73.7	175.9	-171.8	-163.5	4.5	112.5	S234 L235 V236 R242	S234-R238 WeakPolarHBondContact O-CB 3.22Å; S234-R238 VanDerWaalsContact O-CG 3.28Å; S234-R238 WeakPolarHBondContact O-CG 3.28Å; S234-R238 PolarHBondContact O-N 2.67Å; L235-R238 PolarHBondContact O-N 2.98Å; V236-R238 PolarHBondContact O-N 2.77Å; R238-R242 WeakPolarHBondContact O-CB 3.37Å; R238-R242 PolarHBondContact O-N 3.49Å
239	Y	47.7	Very low	56.6	Low	167 Å²	167	92.7 Å²	92.7	66%	0.655	47%	0.471	S	S	*	.	H	α-helix	trans	-65.1	-47.4	174.7	-98	-82.2	0	0	0	111.6	L235 V236 N237 I241 R242 F243	L235-Y239 WeakPolarHBondContact O-CD2 3.27Å; L235-Y239 PolarHBondContact O-N 3.31Å; V236-Y239 WeakPolarHBondContact O-CB 3.34Å; V236-Y239 PolarHBondContact O-N 3.14Å; V236-Y239 VanDerWaalsContact O-N 3.13Å; N237-Y239 VanDerWaalsContact C-N 3.34Å; N237-Y239 PolarHBondContact O-N 3.26Å; Y239-I241 PolarHBondContact O-N 3.32Å; Y239-R242 PolarHBondContact O-N 2.86Å; Y239-F243 WeakPolarHBondContact O-CB 3.18Å; Y239-F243 PolarHBondContact O-N 3.17Å
240	I	60.1	Low	57.3	Low	82 Å²	82	88.3 Å²	88.3	42%	0.421	44%	0.444	S	S	.	.	H	α-helix	trans	-58	-46.5	177.6	-67.3	166.3	0	0	0	111	V236 N237 F243 Q244	V236-I240 HydrophobicContact CG1-CD1 3.86Å; V236-I240 HydrophobicContact CG1-CG1 4.49Å; V236-I240 WeakPolarHBondContact O-CG1 3.12Å; V236-I240 PolarHBondContact O-N 3.47Å; N237-I240 PolarHBondContact O-N 3.3Å; I240-F243 WeakPolarHBondContact O-CB 3.48Å; I240-F243 PolarHBondContact O-N 2.94Å; I240-F243 VanDerWaalsContact O-N 3.16Å; I240-Q244 PolarHBondContact O-N 3.23Å
241	I	59.8	Low	57.8	Low	112 Å²	112	84.5 Å²	84.5	57%	0.574	43%	0.431	S	S	*	.	H	α-helix	trans	-64.5	-41.4	178.6	-66.7	165.7	0	0	0	111.5	N237 Y239 F243 S245	N237-I241 VanDerWaalsContact O-CG1 3.29Å; N237-I241 WeakPolarHBondContact O-CG1 3.27Å; N237-I241 PolarHBondContact O-N 3.27Å; Y239-I241 PolarHBondContact O-N 3.32Å; I241-F243 VanDerWaalsContact C-N 3.31Å; I241-F243 PolarHBondContact O-N 3.25Å; I241-S245 WeakPolarHBondContact O-CB 3.27Å; I241-S245 PolarHBondContact O-N 2.84Å
242	R	49.7	Very low	58.5	Low	150 Å²	150	83 Å²	83	57%	0.566	43%	0.427	S	S	*	.	H	α-helix	trans	-61.7	-39.5	172.6	-81.1	-173.3	173	-176.9	-1.1	111.7	R238 Y239 S245 F246 D371	R238-R242 WeakPolarHBondContact O-CB 3.37Å; R238-R242 PolarHBondContact O-N 3.49Å; Y239-R242 PolarHBondContact O-N 2.86Å; R242-S245 PolarHBondContact O-N 3.02Å; R242-F246 WeakPolarHBondContact O-CB 3.48Å; R242-F246 PolarHBondContact O-N 3Å; R242-D371 IonicContact CZ-OD2 3.77Å; R242-D371 IonicContact NH1-OD2 3.72Å; R242-D371 PolarHBondContact NH1-OD2 3.09Å; R242-D371 IonicContact NH2-OD1 2.82Å; R242-D371 PolarHBondContact NH2-OD1 2.88Å; R242-D371 IonicContact NH2-OD2 2.7Å; R242-D371 PolarHBondContact NH2-OD2 3.38Å
243	F	52.1	Low	59.3	Low	42 Å²	42	81.1 Å²	81.1	18%	0.184	42%	0.416	C	S	.	.	H	α-helix	trans	-67.5	-44.5	180	-134.7	-76.8	0	0	0	112.5	Y239 I240 I241 S245 F246 E247 W274 R278 E306	Y239-F243 WeakPolarHBondContact O-CB 3.18Å; Y239-F243 PolarHBondContact O-N 3.17Å; I240-F243 WeakPolarHBondContact O-CB 3.48Å; I240-F243 PolarHBondContact O-N 2.94Å; I240-F243 VanDerWaalsContact O-N 3.16Å; I241-F243 VanDerWaalsContact C-N 3.31Å; I241-F243 PolarHBondContact O-N 3.25Å; F243-S245 VanDerWaalsContact C-N 3.33Å; F243-S245 PolarHBondContact O-N 3.08Å; F243-F246 PolarHBondContact O-N 2.86Å; F243-E247 WeakPolarHBondContact O-CB 3.41Å; F243-E247 PolarHBondContact O-N 3.33Å; F243-W274 AromaticContact CE1-CZ2 3.99Å; F243-W274 HydrophobicContact CE1-CZ2 3.99Å; F243-R278 VanDerWaalsContact CE1-NH2 3.28Å; F243-E306 WeakPolarHBondContact CE2-OE1 3.37Å; F243-E306 WeakPolarHBondContact CZ-OE1 3.33Å
244	Q	63.2	Low	59.8	Low	111 Å²	111	80.8 Å²	80.8	52%	0.519	41%	0.41	S	S	.	.	H	α-helix	trans	-63.4	-38.1	174.5	-72.1	178.4	-13.2	0	0	111.9	I240 N248	I240-Q244 PolarHBondContact O-N 3.23Å; Q244-N248 PolarHBondContact O-N 2.88Å; Q244-N248 VanDerWaalsContact O-N 3.1Å; Q244-N248 PolarHBondContact O-ND2 3.39Å
245	S	62.8	Low	60.5	Low	81 Å²	81	88.7 Å²	88.7	57%	0.566	43%	0.432	S	S	*	.	H	α-helix	trans	-64.1	-44	174.2	-172	0	0	0	0	111.8	I241 R242 F243 N248 L249	I241-S245 WeakPolarHBondContact O-CB 3.27Å; I241-S245 PolarHBondContact O-N 2.84Å; R242-S245 PolarHBondContact O-N 3.02Å; F243-S245 VanDerWaalsContact C-N 3.33Å; F243-S245 PolarHBondContact O-N 3.08Å; S245-N248 PolarHBondContact O-N 3.39Å; S245-L249 PolarHBondContact O-N 2.97Å
246	F	58.8	Low	61.3	Low	57 Å²	57	92.6 Å²	92.6	25%	0.25	45%	0.448	C	S	.	.	H	α-helix	trans	-64.1	-41.4	176.2	-177.7	-102.2	0	0	0	112.7	R242 F243 N248 L249 V250 L310 M313	R242-F246 WeakPolarHBondContact O-CB 3.48Å; R242-F246 PolarHBondContact O-N 3Å; F243-F246 PolarHBondContact O-N 2.86Å; F246-N248 PolarHBondContact O-N 3.01Å; F246-L249 WeakPolarHBondContact O-CB 3.14Å; F246-L249 PolarHBondContact O-N 3.2Å; F246-L249 VanDerWaalsContact O-N 3.12Å; F246-V250 HydrophobicContact CD1-CG2 4.2Å; F246-V250 HydrophobicContact CE1-CG2 3.78Å; F246-V250 HydrophobicContact CE2-CG2 4.28Å; F246-V250 HydrophobicContact CZ-CG2 3.83Å; F246-V250 WeakPolarHBondContact O-CG2 3.24Å; F246-V250 PolarHBondContact O-N 2.67Å; F246-L310 HydrophobicContact CE1-CD2 4.2Å; F246-L310 HydrophobicContact CZ-CD2 4.48Å; F246-M313 HydrophobicContact CE1-CE 3.86Å; F246-M313 HydrophobicContact CZ-CE 4.07Å
247	E	64.8	Low	61.2	Low	56 Å²	56	90.5 Å²	90.5	26%	0.262	43%	0.434	S	S	.	.	H	α-helix	trans	-61.1	-42.6	175.4	-179.7	158.6	-141	0	0	112	F243 L249 V250 L251 W274 R278	F243-E247 WeakPolarHBondContact O-CB 3.41Å; F243-E247 PolarHBondContact O-N 3.33Å; E247-L249 VanDerWaalsContact C-N 3.34Å; E247-L249 PolarHBondContact O-N 3.11Å; E247-V250 PolarHBondContact O-N 2.89Å; E247-L251 HydrophobicContact CG-CD1 4.3Å; E247-L251 WeakPolarHBondContact O-CB 3.38Å; E247-L251 VanDerWaalsContact O-CG 3.25Å; E247-L251 WeakPolarHBondContact O-CG 3.46Å; E247-L251 PolarHBondContact O-N 2.98Å; E247-W274 HydrophobicContact CB-CH2 4.26Å; E247-W274 HydrophobicContact CG-CH2 3.99Å; E247-W274 WeakPolarHBondContact OE1-CH2 3.36Å; E247-R278 IonicContact OE1-NH1 3.95Å; E247-R278 PolarHBondContact OE1-NH1 2.77Å; E247-R278 IonicContact OE2-CZ 3.49Å; E247-R278 IonicContact OE2-NH1 2.76Å; E247-R278 PolarHBondContact OE2-NH1 2.97Å
248	N	68.5	Low	61.2	Low	105 Å²	105	90.1 Å²	90.1	56%	0.561	44%	0.437	S	S	*	.	H	α-helix	trans	-63.9	-37.1	172	-80.3	-75.2	0	0	0	112.6	Q244 S245 F246 S252	Q244-N248 PolarHBondContact O-N 2.88Å; Q244-N248 VanDerWaalsContact O-N 3.1Å; Q244-N248 PolarHBondContact O-ND2 3.39Å; S245-N248 PolarHBondContact O-N 3.39Å; F246-N248 PolarHBondContact O-N 3.01Å; N248-S252 WeakPolarHBondContact O-CB 3.2Å; N248-S252 PolarHBondContact O-N 3.41Å
249	L	68.6	Low	61.5	Low	98 Å²	98	93 Å²	93	51%	0.513	45%	0.453	S	S	.	.	H	α-helix	trans	-64.1	-48.8	176.2	-169.7	75.3	0	0	0	111.2	S245 F246 E247 L251 S252 A253	S245-L249 PolarHBondContact O-N 2.97Å; F246-L249 WeakPolarHBondContact O-CB 3.14Å; F246-L249 PolarHBondContact O-N 3.2Å; F246-L249 VanDerWaalsContact O-N 3.12Å; E247-L249 VanDerWaalsContact C-N 3.34Å; E247-L249 PolarHBondContact O-N 3.11Å; L249-L251 PolarHBondContact O-N 3.27Å; L249-S252 PolarHBondContact O-N 3.06Å; L249-S252 PolarHBondContact O-OG 3.03Å; L249-A253 PolarHBondContact O-N 3.4Å
250	V	69.2	Low	61.4	Low	5 Å²	5	91.3 Å²	91.3	3%	0.03	46%	0.464	C	S	.	.	H	α-helix	trans	-61.4	-42.4	177.7	172.1	0	0	0	0	111.1	F246 E247 S252 A253 S254 F267 V271 F317	F246-V250 HydrophobicContact CD1-CG2 4.2Å; F246-V250 HydrophobicContact CE1-CG2 3.78Å; F246-V250 HydrophobicContact CE2-CG2 4.28Å; F246-V250 HydrophobicContact CZ-CG2 3.83Å; F246-V250 WeakPolarHBondContact O-CG2 3.24Å; F246-V250 PolarHBondContact O-N 2.67Å; E247-V250 PolarHBondContact O-N 2.89Å; V250-S252 VanDerWaalsContact C-N 3.32Å; V250-S252 PolarHBondContact O-N 3.34Å; V250-A253 PolarHBondContact O-N 3.01Å; V250-S254 WeakPolarHBondContact O-CB 3.19Å; V250-S254 PolarHBondContact O-N 3.18Å; V250-F267 HydrophobicContact CG1-CZ 4.36Å; V250-V271 HydrophobicContact CG1-CG1 4.38Å; V250-V271 HydrophobicContact CG1-CG2 3.81Å; V250-F317 HydrophobicContact CG2-CZ 4.42Å
251	L	68.5	Low	61.4	Low	64 Å²	64	89.2 Å²	89.2	34%	0.335	46%	0.457	S	S	.	.	H	α-helix	trans	-60.9	-39.7	172.4	-72	169.3	0	0	0	111.9	E247 L249 S254	E247-L251 HydrophobicContact CG-CD1 4.3Å; E247-L251 WeakPolarHBondContact O-CB 3.38Å; E247-L251 VanDerWaalsContact O-CG 3.25Å; E247-L251 WeakPolarHBondContact O-CG 3.46Å; E247-L251 PolarHBondContact O-N 2.98Å; L249-L251 PolarHBondContact O-N 3.27Å; L251-S254 PolarHBondContact O-OG 3.32Å
252	S	66.3	Low	61.5	Low	49 Å²	49	88.8 Å²	88.8	34%	0.343	46%	0.461	S	S	.	.	H	α-helix	trans	-68.6	-40	177.9	82	0	0	0	0	112.9	N248 L249 V250 R255	N248-S252 WeakPolarHBondContact O-CB 3.2Å; N248-S252 PolarHBondContact O-N 3.41Å; L249-S252 PolarHBondContact O-N 3.06Å; L249-S252 PolarHBondContact O-OG 3.03Å; V250-S252 VanDerWaalsContact C-N 3.32Å; V250-S252 PolarHBondContact O-N 3.34Å; S252-R255 PolarHBondContact O-N 3.27Å
253	A	63.7	Low	62	Low	25 Å²	25	84.7 Å²	84.7	21%	0.207	45%	0.45	C	S	.	.	H	α-helix	trans	-65.1	-42.6	175.8	0	0	0	0	0	111.7	L249 V250 R255 Q256 L257 F267 F317	L249-A253 PolarHBondContact O-N 3.4Å; V250-A253 PolarHBondContact O-N 3.01Å; A253-R255 PolarHBondContact O-N 2.76Å; A253-Q256 PolarHBondContact O-N 3.37Å; A253-L257 PolarHBondContact O-N 3.34Å; A253-F267 HydrophobicContact CB-CZ 4.35Å; A253-F317 HydrophobicContact CB-CE1 4.43Å
254	S	65.3	Low	62.9	Low	43 Å²	43	82.7 Å²	82.7	30%	0.301	44%	0.441	S	S	.	.	H	α-helix	trans	-61.1	-17	177.2	74.4	0	0	0	0	114.4	V250 L251	V250-S254 WeakPolarHBondContact O-CB 3.19Å; V250-S254 PolarHBondContact O-N 3.18Å; L251-S254 PolarHBondContact O-OG 3.32Å
255	R	65.5	Low	63.3	Low	219 Å²	219	80.3 Å²	80.3	83%	0.826	44%	0.437	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.1	-13.3	175.3	-67.8	179.7	-179	-164	0.9	114.3	S252 A253	S252-R255 PolarHBondContact O-N 3.27Å; A253-R255 PolarHBondContact O-N 2.76Å
256	Q	64.7	Low	63.8	Low	164 Å²	164	79.4 Å²	79.4	77%	0.766	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.2	-17.8	-176	-67.8	-174.3	53.1	0	0	113.8	A253	A253-Q256 PolarHBondContact O-N 3.37Å
257	L	57.5	Low	64.5	Low	41 Å²	41	76.9 Å²	76.9	22%	0.215	42%	0.417	C	S	.	.	S	Bend	trans	-67.5	129.9	176.6	-74.3	167.9	0	0	0	111.5	A253 F267 L320	A253-L257 PolarHBondContact O-N 3.34Å; L257-F267 HydrophobicContact CD1-CB 4.29Å; L257-F267 HydrophobicContact CD1-CD1 3.46Å; L257-F267 VanDerWaalsContact CD1-CD1 3.46Å; L257-F267 HydrophobicContact CD1-CE1 3.98Å; L257-F267 HydrophobicContact CD1-CG 3.99Å; L257-L320 HydrophobicContact CD2-CD2 3.88Å
258	P	56.7	Low	64.9	Low	90 Å²	90	78 Å²	78	58%	0.584	42%	0.422	S	S	*	.			trans	-63.5	140.8	170.5	27.2	-33.4	0	0	0	110	C260 S264	P258-C260 PolarHBondContact O-N 2.83Å; P258-S264 WeakPolarHBondContact O-CB 3.45Å; P258-S264 PolarHBondContact O-OG 3.41Å
259	K	58.2	Low	65.3	Low	193 Å²	193	78.5 Å²	78.5	84%	0.839	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.4	-9.2	-174.4	-65.8	-175.9	178.6	-179.2	0	115
260	C	46.1	Very low	65.5	Low	130 Å²	130	77.7 Å²	77.7	88%	0.878	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	-115	26.9	-163.8	-50.3	0	0	0	0	114.4	P258	P258-C260 PolarHBondContact O-N 2.83Å
261	S	59.4	Low	65.7	Low	39 Å²	39	78 Å²	78	27%	0.273	41%	0.413	S	S	.	.	S	Bend	trans	-117.5	145.6	171.4	74.8	0	0	0	0	111.2	I263 S264	S261-I263 PolarHBondContact O-N 3.29Å; S261-S264 WeakPolarHBondContact O-CB 3.15Å; S261-S264 PolarHBondContact O-N 2.88Å; S261-S264 WeakPolarHBondContact OG-CB 3.06Å; S261-S264 PolarHBondContact OG-N 3.36Å
262	P	62.6	Low	66.1	Low	103 Å²	103	80.9 Å²	80.9	67%	0.669	42%	0.419	S	S	*	.	H	α-helix	trans	-64.1	-26.1	177.4	25.6	-34	0	0	0	112.5	S264 S265 V266	P262-S264 VanDerWaalsContact C-N 3.26Å; P262-S264 PolarHBondContact O-N 3.15Å; P262-S265 PolarHBondContact O-N 3.28Å; P262-S265 PolarHBondContact O-OG 2.94Å; P262-V266 PolarHBondContact O-N 3.33Å
263	I	60.2	Low	66.4	Low	63 Å²	63	80.8 Å²	80.8	32%	0.323	42%	0.421	S	S	.	.	H	α-helix	trans	-66.4	-31.8	173.6	-48.5	176.4	0	0	0	110.7	S261 F267 L320 A323	S261-I263 PolarHBondContact O-N 3.29Å; I263-F267 WeakPolarHBondContact O-CB 3.29Å; I263-F267 PolarHBondContact O-N 3.35Å; I263-L320 HydrophobicContact CG2-CD2 3.61Å; I263-L320 HydrophobicContact CG2-CG 4.09Å; I263-A323 HydrophobicContact CD1-CB 4.16Å
264	S	69.5	Low	66.6	Low	0 Å²	0	80.3 Å²	80.3	0%	0	41%	0.414	C	S	.	.	H	α-helix	trans	-67	-37.7	176.7	-163.8	0	0	0	0	112.4	P258 S261 P262 Q268	P258-S264 WeakPolarHBondContact O-CB 3.45Å; P258-S264 PolarHBondContact O-OG 3.41Å; S261-S264 WeakPolarHBondContact O-CB 3.15Å; S261-S264 PolarHBondContact O-N 2.88Å; S261-S264 WeakPolarHBondContact OG-CB 3.06Å; S261-S264 PolarHBondContact OG-N 3.36Å; P262-S264 VanDerWaalsContact C-N 3.26Å; P262-S264 PolarHBondContact O-N 3.15Å; S264-Q268 WeakPolarHBondContact O-CB 3.34Å; S264-Q268 VanDerWaalsContact O-CG 3.23Å; S264-Q268 WeakPolarHBondContact O-CG 3.47Å; S264-Q268 PolarHBondContact O-N 2.88Å; S264-Q268 PolarHBondContact OG-NE2 3.12Å
265	S	72.5	Confident	67	Low	61 Å²	61	82.4 Å²	82.4	43%	0.427	42%	0.418	S	S	.	.	H	α-helix	trans	-69	-49.9	176.2	56.5	0	0	0	0	111.5	P262 F267 Q268 E269	P262-S265 PolarHBondContact O-N 3.28Å; P262-S265 PolarHBondContact O-OG 2.94Å; S265-F267 VanDerWaalsContact C-N 3.32Å; S265-F267 PolarHBondContact O-N 3.04Å; S265-Q268 PolarHBondContact O-N 3.42Å; S265-Q268 VanDerWaalsContact O-N 3.15Å; S265-E269 WeakPolarHBondContact O-CB 3.17Å; S265-E269 PolarHBondContact O-N 3.04Å
266	V	73.8	Confident	67.3	Low	63 Å²	63	78.5 Å²	78.5	38%	0.382	41%	0.411	S	S	.	.	H	α-helix	trans	-58.4	-42.4	178.6	177.7	0	0	0	0	111.8	P262 E269 R270	P262-V266 PolarHBondContact O-N 3.33Å; V266-E269 PolarHBondContact O-N 3.49Å; V266-R270 PolarHBondContact O-N 3.32Å
267	F	73.1	Confident	67.4	Low	4 Å²	4	74.8 Å²	74.8	2%	0.018	40%	0.399	C	S	.	.	H	α-helix	trans	-64.4	-46.4	175.5	-179.1	-97.7	0	0	0	112	V250 A253 L257 I263 S265 E269 R270 V271 F317 L320	V250-F267 HydrophobicContact CG1-CZ 4.36Å; A253-F267 HydrophobicContact CB-CZ 4.35Å; L257-F267 HydrophobicContact CD1-CB 4.29Å; L257-F267 HydrophobicContact CD1-CD1 3.46Å; L257-F267 VanDerWaalsContact CD1-CD1 3.46Å; L257-F267 HydrophobicContact CD1-CE1 3.98Å; L257-F267 HydrophobicContact CD1-CG 3.99Å; I263-F267 WeakPolarHBondContact O-CB 3.29Å; I263-F267 PolarHBondContact O-N 3.35Å; S265-F267 VanDerWaalsContact C-N 3.32Å; S265-F267 PolarHBondContact O-N 3.04Å; F267-E269 VanDerWaalsContact C-N 3.26Å; F267-E269 PolarHBondContact O-N 2.81Å; F267-R270 PolarHBondContact O-N 2.88Å; F267-V271 HydrophobicContact CD1-CG2 4.29Å; F267-V271 HydrophobicContact CE1-CG2 3.93Å; F267-V271 HydrophobicContact CE2-CG2 4.31Å; F267-V271 HydrophobicContact CZ-CG2 3.94Å; F267-V271 WeakPolarHBondContact O-CB 3.33Å; F267-V271 VanDerWaalsContact O-CG2 3.27Å; F267-V271 WeakPolarHBondContact O-CG2 3.45Å; F267-V271 PolarHBondContact O-N 3Å; F267-F317 HydrophobicContact CE2-CE1 4.4Å; F267-F317 HydrophobicContact CE2-CZ 4.08Å; F267-F317 HydrophobicContact CZ-CZ 4.33Å; F267-L320 HydrophobicContact CD2-CD1 4.3Å
268	Q	74	Confident	67.4	Low	80 Å²	80	78.1 Å²	78.1	37%	0.374	41%	0.409	S	S	.	.	H	α-helix	trans	-62.1	-34.2	175.7	-75.7	179	45.9	0	0	112.6	S264 S265 R272	S264-Q268 WeakPolarHBondContact O-CB 3.34Å; S264-Q268 VanDerWaalsContact O-CG 3.23Å; S264-Q268 WeakPolarHBondContact O-CG 3.47Å; S264-Q268 PolarHBondContact O-N 2.88Å; S264-Q268 PolarHBondContact OG-NE2 3.12Å; S265-Q268 PolarHBondContact O-N 3.42Å; S265-Q268 VanDerWaalsContact O-N 3.15Å; Q268-R272 WeakPolarHBondContact O-CB 3.29Å; Q268-R272 WeakPolarHBondContact O-CG 3.5Å; Q268-R272 PolarHBondContact O-N 3.28Å
269	E	75.4	Confident	67.3	Low	114 Å²	114	81.4 Å²	81.4	53%	0.533	41%	0.414	S	S	.	.	H	α-helix	trans	-69.3	-48.6	179.1	-162	123.3	-91.6	0	0	111.9	S265 V266 F267 V271 R272 A273	S265-E269 WeakPolarHBondContact O-CB 3.17Å; S265-E269 PolarHBondContact O-N 3.04Å; V266-E269 PolarHBondContact O-N 3.49Å; F267-E269 VanDerWaalsContact C-N 3.26Å; F267-E269 PolarHBondContact O-N 2.81Å; E269-V271 VanDerWaalsContact C-N 3.3Å; E269-V271 PolarHBondContact O-N 2.87Å; E269-R272 CarbonylContact O-C 3.43Å; E269-R272 WeakPolarHBondContact O-CA 3.24Å; E269-R272 WeakPolarHBondContact O-CB 3.45Å; E269-R272 PolarHBondContact O-N 2.88Å; E269-R272 IonicContact OE1-CZ 3.8Å; E269-R272 IonicContact OE1-NH1 2.63Å; E269-R272 PolarHBondContact OE1-NH1 3.24Å; E269-A273 PolarHBondContact O-N 3.04Å
270	R	73.6	Confident	66.3	Low	82 Å²	82	80.2 Å²	80.2	31%	0.309	41%	0.412	S	S	.	.	H	α-helix	trans	-63.8	-35.1	173.4	-68.1	-162.6	-174.1	159.3	-0.5	112	V266 F267 A273 W274 E312	V266-R270 PolarHBondContact O-N 3.32Å; F267-R270 PolarHBondContact O-N 2.88Å; R270-A273 PolarHBondContact O-N 3.5Å; R270-W274 WeakPolarHBondContact O-CB 3.36Å; R270-W274 PolarHBondContact O-N 3.49Å; R270-E312 PolarHBondContact NH1-O 2.96Å
271	V	74.2	Confident	65.6	Low	11 Å²	11	79.6 Å²	79.6	7%	0.067	41%	0.406	C	S	.	.	H	α-helix	trans	-68	-31.6	171.8	171	0	0	0	0	112.2	V250 F267 E269 K275	V250-V271 HydrophobicContact CG1-CG1 4.38Å; V250-V271 HydrophobicContact CG1-CG2 3.81Å; F267-V271 HydrophobicContact CD1-CG2 4.29Å; F267-V271 HydrophobicContact CE1-CG2 3.93Å; F267-V271 HydrophobicContact CE2-CG2 4.31Å; F267-V271 HydrophobicContact CZ-CG2 3.94Å; F267-V271 WeakPolarHBondContact O-CB 3.33Å; F267-V271 VanDerWaalsContact O-CG2 3.27Å; F267-V271 WeakPolarHBondContact O-CG2 3.45Å; F267-V271 PolarHBondContact O-N 3Å; E269-V271 VanDerWaalsContact C-N 3.3Å; E269-V271 PolarHBondContact O-N 2.87Å; V271-K275 HydrophobicContact CG1-CD 4.42Å; V271-K275 WeakPolarHBondContact O-CB 3.49Å; V271-K275 VanDerWaalsContact O-CG 3.28Å; V271-K275 WeakPolarHBondContact O-CG 3.33Å; V271-K275 PolarHBondContact O-N 3.13Å
272	R	75.2	Confident	64.3	Low	124 Å²	124	80.7 Å²	80.7	47%	0.468	42%	0.424	S	S	.	.	H	α-helix	trans	-68.2	-46	169	-80.2	-174.7	-118.1	112	1.2	111.2	Q268 E269 W274 K275 M276	Q268-R272 WeakPolarHBondContact O-CB 3.29Å; Q268-R272 WeakPolarHBondContact O-CG 3.5Å; Q268-R272 PolarHBondContact O-N 3.28Å; E269-R272 CarbonylContact O-C 3.43Å; E269-R272 WeakPolarHBondContact O-CA 3.24Å; E269-R272 WeakPolarHBondContact O-CB 3.45Å; E269-R272 PolarHBondContact O-N 2.88Å; E269-R272 IonicContact OE1-CZ 3.8Å; E269-R272 IonicContact OE1-NH1 2.63Å; E269-R272 PolarHBondContact OE1-NH1 3.24Å; R272-W274 PolarHBondContact O-N 3.34Å; R272-K275 CarbonylContact O-C 3.2Å; R272-K275 WeakPolarHBondContact O-CA 3.19Å; R272-K275 WeakPolarHBondContact O-CB 3.4Å; R272-K275 PolarHBondContact O-N 3.42Å; R272-K275 VanDerWaalsContact O-N 3.12Å; R272-M276 WeakPolarHBondContact O-CG 3.37Å; R272-M276 PolarHBondContact O-N 2.84Å
273	A	73.7	Confident	62.8	Low	47 Å²	47	84.9 Å²	84.9	39%	0.388	43%	0.434	S	S	.	.	H	α-helix	trans	-59.3	-46.1	177.4	0	0	0	0	0	112	E269 R270 K275 M276 T277	E269-A273 PolarHBondContact O-N 3.04Å; R270-A273 PolarHBondContact O-N 3.5Å; A273-K275 VanDerWaalsContact C-N 3.32Å; A273-K275 PolarHBondContact O-N 3.01Å; A273-M276 WeakPolarHBondContact O-CB 3.38Å; A273-M276 PolarHBondContact O-N 2.84Å; A273-M276 VanDerWaalsContact O-N 3.08Å; A273-T277 PolarHBondContact O-N 3.24Å; A273-T277 PolarHBondContact O-OG1 2.88Å
274	W	68.4	Low	61.4	Low	15 Å²	15	90.5 Å²	90.5	6%	0.057	46%	0.464	C	S	.	.	H	α-helix	trans	-62.6	-35.5	173.7	-178.6	85.4	0	0	0	112.9	F243 E247 R270 R272 T277 R278	F243-W274 AromaticContact CE1-CZ2 3.99Å; F243-W274 HydrophobicContact CE1-CZ2 3.99Å; E247-W274 HydrophobicContact CB-CH2 4.26Å; E247-W274 HydrophobicContact CG-CH2 3.99Å; E247-W274 WeakPolarHBondContact OE1-CH2 3.36Å; R270-W274 WeakPolarHBondContact O-CB 3.36Å; R270-W274 PolarHBondContact O-N 3.49Å; R272-W274 PolarHBondContact O-N 3.34Å; W274-T277 PolarHBondContact O-OG1 2.91Å; W274-T277 VanDerWaalsContact O-OG1 3.07Å; W274-R278 WeakPolarHBondContact O-CB 3.4Å; W274-R278 PolarHBondContact O-N 3.46Å; W274-R278 VanDerWaalsContact O-N 3.11Å
275	K	72.8	Confident	59.4	Low	88 Å²	88	95.2 Å²	95.2	38%	0.383	50%	0.497	S	S	.	.	H	α-helix	trans	-69.6	-32.4	170.9	-78.5	177	-179.9	179.6	0	112.8	V271 R272 A273 R278 K279	V271-K275 HydrophobicContact CG1-CD 4.42Å; V271-K275 WeakPolarHBondContact O-CB 3.49Å; V271-K275 VanDerWaalsContact O-CG 3.28Å; V271-K275 WeakPolarHBondContact O-CG 3.33Å; V271-K275 PolarHBondContact O-N 3.13Å; R272-K275 CarbonylContact O-C 3.2Å; R272-K275 WeakPolarHBondContact O-CA 3.19Å; R272-K275 WeakPolarHBondContact O-CB 3.4Å; R272-K275 PolarHBondContact O-N 3.42Å; R272-K275 VanDerWaalsContact O-N 3.12Å; A273-K275 VanDerWaalsContact C-N 3.32Å; A273-K275 PolarHBondContact O-N 3.01Å; K275-R278 CarbonylContact O-C 3.56Å; K275-R278 PolarHBondContact O-N 3.02Å; K275-K279 WeakPolarHBondContact O-CB 3.42Å; K275-K279 VanDerWaalsContact O-CG 3.3Å; K275-K279 WeakPolarHBondContact O-CG 3.37Å; K275-K279 PolarHBondContact O-N 3.02Å
276	M	71.4	Confident	57.3	Low	136 Å²	136	98.8 Å²	98.8	67%	0.67	52%	0.519	S	S	*	.	H	α-helix	trans	-70.3	-43.6	175.1	-69.9	-55.8	-152.7	0	0	111.6	R272 A273 R278 K279	R272-M276 WeakPolarHBondContact O-CG 3.37Å; R272-M276 PolarHBondContact O-N 2.84Å; A273-M276 WeakPolarHBondContact O-CB 3.38Å; A273-M276 PolarHBondContact O-N 2.84Å; A273-M276 VanDerWaalsContact O-N 3.08Å; M276-R278 PolarHBondContact O-N 3.39Å; M276-K279 PolarHBondContact O-N 3.43Å
277	T	66.9	Low	55.4	Low	87 Å²	87	99.6 Å²	99.6	53%	0.534	53%	0.532	S	S	.	.	H	α-helix	trans	-64.7	-29	174.5	54.3	0	0	0	0	112.5	A273 W274 L309	A273-T277 PolarHBondContact O-N 3.24Å; A273-T277 PolarHBondContact O-OG1 2.88Å; W274-T277 PolarHBondContact O-OG1 2.91Å; W274-T277 VanDerWaalsContact O-OG1 3.07Å; T277-L309 HydrophobicContact CG2-CD1 4.5Å
278	R	56.9	Low	53.3	Low	111 Å²	111	107.8 Å²	107.8	42%	0.419	57%	0.568	S	S	.	*	H	α-helix	trans	-81.9	-13.3	168.1	-90.1	-175.1	155	-144.6	-4.3	115.7	F243 E247 W274 K275 M276 Q280	F243-R278 VanDerWaalsContact CE1-NH2 3.28Å; E247-R278 IonicContact OE1-NH1 3.95Å; E247-R278 PolarHBondContact OE1-NH1 2.77Å; E247-R278 IonicContact OE2-CZ 3.49Å; E247-R278 IonicContact OE2-NH1 2.76Å; E247-R278 PolarHBondContact OE2-NH1 2.97Å; W274-R278 WeakPolarHBondContact O-CB 3.4Å; W274-R278 PolarHBondContact O-N 3.46Å; W274-R278 VanDerWaalsContact O-N 3.11Å; K275-R278 CarbonylContact O-C 3.56Å; K275-R278 PolarHBondContact O-N 3.02Å; M276-R278 PolarHBondContact O-N 3.39Å; R278-Q280 VanDerWaalsContact C-N 3.31Å; R278-Q280 PolarHBondContact O-N 3.45Å
279	K	55.6	Low	51.3	Low	159 Å²	159	111 Å²	111	69%	0.691	59%	0.593	S	S	*	*			trans	-92.9	21.2	-179.7	-90.3	-167.4	166	-157.5	0	114.2	K275 M276 P281	K275-K279 WeakPolarHBondContact O-CB 3.42Å; K275-K279 VanDerWaalsContact O-CG 3.3Å; K275-K279 WeakPolarHBondContact O-CG 3.37Å; K275-K279 PolarHBondContact O-N 3.02Å; M276-K279 PolarHBondContact O-N 3.43Å; K279-P281 VanDerWaalsContact O-CD 3.32Å; K279-P281 WeakPolarHBondContact O-CD 3.45Å
280	Q	36.3	Very low	49.1	Very low	167 Å²	167	109.2 Å²	109.2	78%	0.78	60%	0.604	S	S	*	*			trans	-93.8	46	165.3	-68.9	-70.5	1.4	0	0	115.3	R278	R278-Q280 VanDerWaalsContact C-N 3.31Å; R278-Q280 PolarHBondContact O-N 3.45Å
281	P	33.1	Very low	47.2	Very low	118 Å²	118	112.8 Å²	112.8	77%	0.766	63%	0.626	S	S	*	*			trans	-102.3	78	152	34.8	-24	0	0	0	108.4	K279	K279-P281 VanDerWaalsContact O-CD 3.32Å; K279-P281 WeakPolarHBondContact O-CD 3.45Å
282	G	30.8	Very low	45.3	Very low	62 Å²	62	122.1 Å²	122.1	64%	0.639	67%	0.666	S	S	*	*			trans	-124.3	-6.3	-165.8	0	0	0	0	0	116.8
283	Q	32.5	Very low	43.3	Very low	190 Å²	190	122.2 Å²	122.2	89%	0.888	69%	0.686	S	S	*	*	S	Bend	trans	-150.5	107.9	167.8	-76.3	-155.4	49.1	0	0	110.3
284	L	30	Very low	41.5	Very low	181 Å²	181	125 Å²	125	95%	0.948	70%	0.703	S	S	*	*			trans	179	141	149.2	-100.7	164.3	0	0	0	108.6
285	S	26.9	Very low	39.8	Very low	100 Å²	100	134 Å²	134	70%	0.699	74%	0.743	S	S	*	*			trans	-79.6	145.6	-170.1	-168.9	0	0	0	0	113	A287	S285-A287 PolarHBondContact O-N 3.04Å
286	P	29.2	Very low	38	Very low	135 Å²	135	138.1 Å²	138.1	88%	0.877	77%	0.767	S	S	*	*	S	Bend	trans	-73.1	85.2	178.4	30.8	-36.6	0	0	0	112.4
287	A	33.6	Very low	36.2	Very low	80 Å²	80	136.6 Å²	136.6	66%	0.661	77%	0.77	S	S	*	*			trans	-133.4	-13.8	176.7	0	0	0	0	0	115	S285 V289	S285-A287 PolarHBondContact O-N 3.04Å; A287-V289 PolarHBondContact O-N 3.16Å
288	F	29.4	Very low	34.9	Very low	176 Å²	176	135.2 Å²	135.2	77%	0.772	76%	0.764	S	S	*	*			trans	-94	70.6	-170.5	-106.3	-103.6	0	0	0	113.9	M291	F288-M291 HydrophobicContact CD1-CB 4.18Å; F288-M291 HydrophobicContact CE1-CB 3.87Å; F288-M291 HydrophobicContact CE1-CG 4.4Å; F288-M291 HydrophobicContact CE1-SD 3.79Å; F288-M291 HydrophobicContact CZ-SD 4.22Å
289	V	31.9	Very low	34.1	Very low	149 Å²	149	133.3 Å²	133.3	90%	0.903	77%	0.765	S	S	*	*			trans	-92.9	121.6	158.9	177	0	0	0	0	108	A287	A287-V289 PolarHBondContact O-N 3.16Å
290	G	28.8	Very low	33.9	Very low	75 Å²	75	130.8 Å²	130.8	77%	0.773	77%	0.768	S	S	*	*	S	Bend	trans	88.3	63.1	169.4	0	0	0	0	0	116.7
291	M	33.7	Very low	34.8	Very low	157 Å²	157	125.1 Å²	125.1	77%	0.773	75%	0.749	S	S	*	*			trans	-139.4	140.4	157.1	-125.3	-178.3	-178.4	0	0	111.9	F288	F288-M291 HydrophobicContact CD1-CB 4.18Å; F288-M291 HydrophobicContact CE1-CB 3.87Å; F288-M291 HydrophobicContact CE1-CG 4.4Å; F288-M291 HydrophobicContact CE1-SD 3.79Å; F288-M291 HydrophobicContact CZ-SD 4.22Å
292	K	34.8	Very low	36.3	Very low	207 Å²	207	123.2 Å²	123.2	90%	0.9	73%	0.733	S	S	*	*			trans	-72.3	131.6	-169.3	-65.3	176.8	-179.6	176.8	0	111	S294	K292-S294 PolarHBondContact O-N 3.06Å
293	S	33.4	Very low	37.9	Very low	127 Å²	127	127.2 Å²	127.2	89%	0.888	73%	0.728	S	S	*	*			trans	-72.1	98.8	-169.9	58.1	0	0	0	0	113.4
294	S	35.1	Very low	39.7	Very low	106 Å²	106	124.5 Å²	124.5	74%	0.741	71%	0.714	S	S	*	*			trans	-110.9	139.3	164.6	60.6	0	0	0	0	110.6	K292 L296	K292-S294 PolarHBondContact O-N 3.06Å; S294-L296 PolarHBondContact O-N 3.29Å
295	K	32.8	Very low	41.6	Very low	204 Å²	204	121.7 Å²	121.7	89%	0.887	69%	0.694	S	S	*	*			trans	35.9	72.9	171.3	-67.9	-178.8	177	174.8	0	117.8	S297	K295-S297 PolarHBondContact O-N 2.82Å
296	L	34.7	Very low	43.4	Very low	173 Å²	173	120.9 Å²	120.9	91%	0.906	68%	0.679	S	S	*	*			trans	-85.1	89.8	154.4	-99.6	163	0	0	0	110.3	S294 S298	S294-L296 PolarHBondContact O-N 3.29Å; L296-S298 PolarHBondContact O-N 3.32Å; L296-S298 VanDerWaalsContact O-N 3.15Å
297	S	33.9	Very low	45.3	Very low	104 Å²	104	120.9 Å²	120.9	73%	0.727	67%	0.665	S	S	*	*			trans	-81.9	83.5	-179.4	54.9	0	0	0	0	112.4	K295 T299	K295-S297 PolarHBondContact O-N 2.82Å; S297-T299 PolarHBondContact O-N 3.35Å
298	S	39.3	Very low	47.3	Very low	59 Å²	59	120.1 Å²	120.1	41%	0.413	65%	0.648	S	S	.	*			trans	-54.4	128.2	161.2	59.7	0	0	0	0	109.7	L296 R303	L296-S298 PolarHBondContact O-N 3.32Å; L296-S298 VanDerWaalsContact O-N 3.15Å; S298-R303 VanDerWaalsContact OG-CZ 3.28Å; S298-R303 PolarHBondContact OG-NE 3.21Å; S298-R303 PolarHBondContact OG-NH2 3.23Å
299	T	41.3	Very low	49.1	Very low	70 Å²	70	113.6 Å²	113.6	43%	0.429	62%	0.621	S	S	.	*			trans	-64	156	-177.4	80.2	0	0	0	0	111.8	S297 A301 D302 R303	S297-T299 PolarHBondContact O-N 3.35Å; T299-A301 PolarHBondContact O-N 3.19Å; T299-A301 PolarHBondContact OG1-N 3.12Å; T299-D302 PolarHBondContact O-N 3.41Å; T299-D302 VanDerWaalsContact OG1-CG 3.22Å; T299-D302 PolarHBondContact OG1-N 3.01Å; T299-D302 VanDerWaalsContact OG1-N 3.14Å; T299-D302 PolarHBondContact OG1-OD2 2.75Å; T299-R303 PolarHBondContact O-N 3.13Å
300	S	49.8	Very low	50.8	Low	107 Å²	107	109.6 Å²	109.6	75%	0.748	59%	0.594	S	S	*	*	H	α-helix	trans	-60.8	-35.2	172.7	50.7	0	0	0	0	111.8	F304	S300-F304 WeakPolarHBondContact O-CB 3.31Å; S300-F304 PolarHBondContact O-N 3.27Å
301	A	56.7	Low	52.7	Low	47 Å²	47	113 Å²	113	39%	0.388	58%	0.584	S	S	.	*	H	α-helix	trans	-62.9	-42.3	178.3	0	0	0	0	0	112.5	T299 F304 K305	T299-A301 PolarHBondContact O-N 3.19Å; T299-A301 PolarHBondContact OG1-N 3.12Å; A301-F304 WeakPolarHBondContact O-CB 3.39Å; A301-F304 PolarHBondContact O-N 3.45Å; A301-K305 WeakPolarHBondContact O-CG 3.44Å; A301-K305 PolarHBondContact O-N 2.84Å
302	D	64.7	Low	54.5	Low	79 Å²	79	108.4 Å²	108.4	42%	0.422	56%	0.56	S	S	.	*	H	α-helix	trans	-70.6	-40.2	-179	-58.2	-47.3	0	0	0	111.7	T299 F304 K305 E306	T299-D302 PolarHBondContact O-N 3.41Å; T299-D302 VanDerWaalsContact OG1-CG 3.22Å; T299-D302 PolarHBondContact OG1-N 3.01Å; T299-D302 VanDerWaalsContact OG1-N 3.14Å; T299-D302 PolarHBondContact OG1-OD2 2.75Å; D302-F304 VanDerWaalsContact C-N 3.25Å; D302-F304 PolarHBondContact O-N 2.96Å; D302-K305 PolarHBondContact O-N 3.42Å; D302-K305 IonicContact OD1-NZ 3.24Å; D302-E306 WeakPolarHBondContact O-CB 3.29Å; D302-E306 PolarHBondContact O-N 3.38Å
303	R	63	Low	55.9	Low	145 Å²	145	98.9 Å²	98.9	55%	0.547	52%	0.519	S	S	.	.	H	α-helix	trans	-64.1	-29.6	171.2	-67.1	-169.1	-174.7	-171.2	4.5	112.7	S298 T299 K307	S298-R303 VanDerWaalsContact OG-CZ 3.28Å; S298-R303 PolarHBondContact OG-NE 3.21Å; S298-R303 PolarHBondContact OG-NH2 3.23Å; T299-R303 PolarHBondContact O-N 3.13Å; R303-K307 WeakPolarHBondContact O-CB 3.47Å; R303-K307 VanDerWaalsContact O-CG 3.3Å; R303-K307 WeakPolarHBondContact O-CG 3.41Å; R303-K307 PolarHBondContact O-N 3.19Å; R303-K307 VanDerWaalsContact O-N 3.09Å
304	F	70	Confident	57.4	Low	133 Å²	133	94.6 Å²	94.6	58%	0.583	50%	0.495	S	S	*	.	H	α-helix	trans	-71.2	-47.9	174.5	-168.7	-87.8	0	0	0	111.1	S300 A301 D302 E306 K307 Q308	S300-F304 WeakPolarHBondContact O-CB 3.31Å; S300-F304 PolarHBondContact O-N 3.27Å; A301-F304 WeakPolarHBondContact O-CB 3.39Å; A301-F304 PolarHBondContact O-N 3.45Å; D302-F304 VanDerWaalsContact C-N 3.25Å; D302-F304 PolarHBondContact O-N 2.96Å; F304-E306 VanDerWaalsContact C-N 3.34Å; F304-E306 PolarHBondContact O-N 3.15Å; F304-K307 PolarHBondContact O-N 3.48Å; F304-Q308 WeakPolarHBondContact O-CB 3.37Å; F304-Q308 PolarHBondContact O-N 2.72Å
305	K	70.6	Confident	59.1	Low	123 Å²	123	92 Å²	92	54%	0.535	48%	0.476	S	S	.	.	H	α-helix	trans	-57.1	-44.4	174.1	-68.8	168.2	-173	167.1	0	111.9	A301 D302 Q308 L309	A301-K305 WeakPolarHBondContact O-CG 3.44Å; A301-K305 PolarHBondContact O-N 2.84Å; D302-K305 PolarHBondContact O-N 3.42Å; D302-K305 IonicContact OD1-NZ 3.24Å; K305-Q308 PolarHBondContact O-N 3.04Å; K305-L309 WeakPolarHBondContact O-CG 3.25Å; K305-L309 PolarHBondContact O-N 2.82Å
306	E	65.9	Low	60.5	Low	82 Å²	82	82.6 Å²	82.6	38%	0.383	44%	0.436	S	S	.	.	H	α-helix	trans	-62.2	-49.4	177	-176	-179.1	-150.6	0	0	112	F243 D302 F304 Q308 L309 L310	F243-E306 WeakPolarHBondContact CE2-OE1 3.37Å; F243-E306 WeakPolarHBondContact CZ-OE1 3.33Å; D302-E306 WeakPolarHBondContact O-CB 3.29Å; D302-E306 PolarHBondContact O-N 3.38Å; F304-E306 VanDerWaalsContact C-N 3.34Å; F304-E306 PolarHBondContact O-N 3.15Å; E306-Q308 PolarHBondContact O-N 2.84Å; E306-L309 PolarHBondContact O-N 3.12Å; E306-L310 HydrophobicContact CG-CD1 4.17Å; E306-L310 WeakPolarHBondContact O-CG 3.49Å; E306-L310 PolarHBondContact O-N 3.04Å
307	K	67.7	Low	61.7	Low	136 Å²	136	77.1 Å²	77.1	59%	0.591	41%	0.405	S	S	*	.	H	α-helix	trans	-60.3	-34.7	175.2	-78	178.5	176.7	-176.3	0	112.6	R303 F304 R311	R303-K307 WeakPolarHBondContact O-CB 3.47Å; R303-K307 VanDerWaalsContact O-CG 3.3Å; R303-K307 WeakPolarHBondContact O-CG 3.41Å; R303-K307 PolarHBondContact O-N 3.19Å; R303-K307 VanDerWaalsContact O-N 3.09Å; F304-K307 PolarHBondContact O-N 3.48Å; K307-R311 WeakPolarHBondContact O-CG 3.07Å; K307-R311 PolarHBondContact O-N 3.06Å; K307-R311 VanDerWaalsContact O-N 3.13Å
308	Q	75	Confident	63.2	Low	64 Å²	64	75.6 Å²	75.6	30%	0.299	40%	0.395	S	S	.	.	H	α-helix	trans	-69.2	-49.2	178.3	-175.7	57.7	20	0	0	111.6	F304 K305 E306 L310 R311 E312	F304-Q308 WeakPolarHBondContact O-CB 3.37Å; F304-Q308 PolarHBondContact O-N 2.72Å; K305-Q308 PolarHBondContact O-N 3.04Å; E306-Q308 PolarHBondContact O-N 2.84Å; Q308-L310 VanDerWaalsContact C-N 3.26Å; Q308-L310 PolarHBondContact O-N 3.33Å; Q308-R311 WeakPolarHBondContact O-CB 3.46Å; Q308-R311 PolarHBondContact O-N 2.83Å; Q308-E312 VanDerWaalsContact CG-OE1 3.31Å; Q308-E312 WeakPolarHBondContact CG-OE1 3.27Å; Q308-E312 PolarHBondContact NE2-OE1 3.39Å; Q308-E312 PolarHBondContact O-N 3.13Å
309	L	67.5	Low	64.6	Low	38 Å²	38	77.5 Å²	77.5	20%	0.199	40%	0.397	C	S	.	.	H	α-helix	trans	-58.5	-36.1	173.9	-71.2	171	0	0	0	112.5	T277 K305 E306 E312 M313	T277-L309 HydrophobicContact CG2-CD1 4.5Å; K305-L309 WeakPolarHBondContact O-CG 3.25Å; K305-L309 PolarHBondContact O-N 2.82Å; E306-L309 PolarHBondContact O-N 3.12Å; L309-E312 PolarHBondContact O-N 3.43Å; L309-M313 WeakPolarHBondContact O-CG 3.36Å; L309-M313 PolarHBondContact O-N 3.07Å
310	L	68.6	Low	65.4	Low	66 Å²	66	75.6 Å²	75.6	35%	0.346	38%	0.384	S	S	.	.	H	α-helix	trans	-66.2	-37.9	174.7	-74.3	167.5	0	0	0	112.6	F246 E306 Q308 M313 G314	F246-L310 HydrophobicContact CE1-CD2 4.2Å; F246-L310 HydrophobicContact CZ-CD2 4.48Å; E306-L310 HydrophobicContact CG-CD1 4.17Å; E306-L310 WeakPolarHBondContact O-CG 3.49Å; E306-L310 PolarHBondContact O-N 3.04Å; Q308-L310 VanDerWaalsContact C-N 3.26Å; Q308-L310 PolarHBondContact O-N 3.33Å; L310-M313 HydrophobicContact CD2-CE 4.17Å; L310-G314 PolarHBondContact O-N 3.47Å; L310-G314 VanDerWaalsContact O-N 3.15Å
311	R	69.3	Low	66.1	Low	147 Å²	147	75.9 Å²	75.9	56%	0.555	38%	0.376	S	S	*	.	H	α-helix	trans	-66.2	-43.8	172.5	-73.1	-173.6	-69.9	-137.7	2.2	111.7	K307 Q308 M313 G314 S315	K307-R311 WeakPolarHBondContact O-CG 3.07Å; K307-R311 PolarHBondContact O-N 3.06Å; K307-R311 VanDerWaalsContact O-N 3.13Å; Q308-R311 WeakPolarHBondContact O-CB 3.46Å; Q308-R311 PolarHBondContact O-N 2.83Å; R311-M313 VanDerWaalsContact C-N 3.35Å; R311-M313 PolarHBondContact O-N 3.4Å; R311-G314 WeakPolarHBondContact O-CA 3.08Å; R311-G314 PolarHBondContact O-N 2.97Å; R311-S315 PolarHBondContact O-N 2.89Å; R311-S315 VanDerWaalsContact O-N 3.16Å
312	E	71.1	Confident	66.8	Low	59 Å²	59	77 Å²	77	28%	0.276	38%	0.379	S	S	.	.	H	α-helix	trans	-70	-25.2	-179.6	-73.6	172.8	-155.2	0	0	114.4	R270 Q308 L309	R270-E312 PolarHBondContact NH1-O 2.96Å; Q308-E312 VanDerWaalsContact CG-OE1 3.31Å; Q308-E312 WeakPolarHBondContact CG-OE1 3.27Å; Q308-E312 PolarHBondContact NE2-OE1 3.39Å; Q308-E312 PolarHBondContact O-N 3.13Å; L309-E312 PolarHBondContact O-N 3.43Å
313	M	64.1	Low	66.6	Low	8 Å²	8	74.9 Å²	74.9	4%	0.039	37%	0.372	C	S	.	.	H	α-helix	trans	-77.2	-32	166.2	-72.6	-167.8	-68.4	0	0	111.9	F246 L309 L310 R311 L316 F317	F246-M313 HydrophobicContact CE1-CE 3.86Å; F246-M313 HydrophobicContact CZ-CE 4.07Å; L309-M313 WeakPolarHBondContact O-CG 3.36Å; L309-M313 PolarHBondContact O-N 3.07Å; L310-M313 HydrophobicContact CD2-CE 4.17Å; R311-M313 VanDerWaalsContact C-N 3.35Å; R311-M313 PolarHBondContact O-N 3.4Å; M313-L316 PolarHBondContact O-N 2.95Å; M313-F317 WeakPolarHBondContact O-CD2 3.23Å; M313-F317 PolarHBondContact O-N 3.33Å; M313-F317 VanDerWaalsContact O-N 3.15Å
314	G	64.2	Low	66.7	Low	37 Å²	37	74.4 Å²	74.4	38%	0.381	38%	0.376	S	S	.	.	H	α-helix	trans	-62.1	-39	176.4	0	0	0	0	0	114	L310 R311 S318	L310-G314 PolarHBondContact O-N 3.47Å; L310-G314 VanDerWaalsContact O-N 3.15Å; R311-G314 WeakPolarHBondContact O-CA 3.08Å; R311-G314 PolarHBondContact O-N 2.97Å; G314-S318 PolarHBondContact O-N 2.99Å; G314-S318 PolarHBondContact O-OG 2.94Å
315	S	70.6	Confident	66.7	Low	50 Å²	50	74.3 Å²	74.3	35%	0.35	38%	0.377	S	S	.	.	H	α-helix	trans	-65.5	-48.6	174.6	87.3	0	0	0	0	111.1	R311 F317 S318 E319	R311-S315 PolarHBondContact O-N 2.89Å; R311-S315 VanDerWaalsContact O-N 3.16Å; S315-F317 VanDerWaalsContact C-N 3.29Å; S315-F317 PolarHBondContact O-N 3.15Å; S315-S318 WeakPolarHBondContact O-CA 3.43Å; S315-S318 VanDerWaalsContact O-CB 3.29Å; S315-S318 WeakPolarHBondContact O-CB 3.4Å; S315-S318 PolarHBondContact O-N 3.46Å; S315-E319 VanDerWaalsContact C-OE1 3.29Å; S315-E319 WeakPolarHBondContact CB-OE1 3.2Å; S315-E319 WeakPolarHBondContact O-CG 3.5Å; S315-E319 PolarHBondContact O-N 3.38Å; S315-E319 PolarHBondContact OG-OE1 3.15Å
316	L	62.7	Low	66.8	Low	7 Å²	7	75.2 Å²	75.2	4%	0.037	38%	0.381	C	S	.	.	H	α-helix	trans	-59.1	-36.1	-178.4	-72.7	179.6	0	0	0	113.1	M313 S318 E319 L320	M313-L316 PolarHBondContact O-N 2.95Å; L316-S318 VanDerWaalsContact C-N 3.32Å; L316-E319 PolarHBondContact O-N 3.28Å; L316-L320 VanDerWaalsContact O-CB 3.26Å; L316-L320 WeakPolarHBondContact O-CB 3.42Å; L316-L320 VanDerWaalsContact O-CG 3.28Å; L316-L320 WeakPolarHBondContact O-CG 3.48Å; L316-L320 PolarHBondContact O-N 3.16Å
317	F	59.3	Low	66.9	Low	58 Å²	58	76.6 Å²	76.6	25%	0.254	39%	0.39	S	S	.	.	H	α-helix	trans	-66.4	-33.8	173.3	-80.8	-64.4	0	0	0	112.8	V250 A253 F267 M313 S315 L321	V250-F317 HydrophobicContact CG2-CZ 4.42Å; A253-F317 HydrophobicContact CB-CE1 4.43Å; F267-F317 HydrophobicContact CE2-CE1 4.4Å; F267-F317 HydrophobicContact CE2-CZ 4.08Å; F267-F317 HydrophobicContact CZ-CZ 4.33Å; M313-F317 WeakPolarHBondContact O-CD2 3.23Å; M313-F317 PolarHBondContact O-N 3.33Å; M313-F317 VanDerWaalsContact O-N 3.15Å; S315-F317 VanDerWaalsContact C-N 3.29Å; S315-F317 PolarHBondContact O-N 3.15Å; F317-L321 VanDerWaalsContact O-CG 3.3Å; F317-L321 WeakPolarHBondContact O-CG 3.4Å; F317-L321 PolarHBondContact O-N 2.77Å; F317-L321 VanDerWaalsContact O-N 3.13Å
318	S	66.3	Low	66.9	Low	73 Å²	73	72.3 Å²	72.3	51%	0.51	38%	0.381	S	S	.	.	H	α-helix	trans	-70.7	-42.8	175.2	-53.8	0	0	0	0	111.3	G314 S315 L316 L321 V322	G314-S318 PolarHBondContact O-N 2.99Å; G314-S318 PolarHBondContact O-OG 2.94Å; S315-S318 WeakPolarHBondContact O-CA 3.43Å; S315-S318 VanDerWaalsContact O-CB 3.29Å; S315-S318 WeakPolarHBondContact O-CB 3.4Å; S315-S318 PolarHBondContact O-N 3.46Å; L316-S318 VanDerWaalsContact C-N 3.32Å; S318-L321 PolarHBondContact O-N 2.88Å; S318-V322 WeakPolarHBondContact O-CG2 3.37Å; S318-V322 PolarHBondContact O-N 3.41Å; S318-V322 VanDerWaalsContact O-N 3.13Å
319	E	67.3	Low	66.3	Low	98 Å²	98	73.3 Å²	73.3	46%	0.458	39%	0.388	S	S	.	.	H	α-helix	trans	-62.5	-43.4	175	-66.5	162	-126.5	0	0	111.8	S315 L316 V322 A323	S315-E319 VanDerWaalsContact C-OE1 3.29Å; S315-E319 WeakPolarHBondContact CB-OE1 3.2Å; S315-E319 WeakPolarHBondContact O-CG 3.5Å; S315-E319 PolarHBondContact O-N 3.38Å; S315-E319 PolarHBondContact OG-OE1 3.15Å; L316-E319 PolarHBondContact O-N 3.28Å; E319-V322 PolarHBondContact O-N 2.96Å; E319-A323 WeakPolarHBondContact O-CB 3.49Å; E319-A323 PolarHBondContact O-N 3.13Å
320	L	58.4	Low	65.9	Low	30 Å²	30	76.4 Å²	76.4	16%	0.157	41%	0.413	C	S	.	.	H	α-helix	trans	-61.8	-43.7	176.2	-82.8	167.6	0	0	0	112.5	L257 I263 F267 L316 V322 A323 E324	L257-L320 HydrophobicContact CD2-CD2 3.88Å; I263-L320 HydrophobicContact CG2-CD2 3.61Å; I263-L320 HydrophobicContact CG2-CG 4.09Å; F267-L320 HydrophobicContact CD2-CD1 4.3Å; L316-L320 VanDerWaalsContact O-CB 3.26Å; L316-L320 WeakPolarHBondContact O-CB 3.42Å; L316-L320 VanDerWaalsContact O-CG 3.28Å; L316-L320 WeakPolarHBondContact O-CG 3.48Å; L316-L320 PolarHBondContact O-N 3.16Å; L320-V322 PolarHBondContact O-N 2.62Å; L320-A323 PolarHBondContact O-N 3.39Å; L320-E324 WeakPolarHBondContact O-CB 3.49Å; L320-E324 PolarHBondContact O-N 3.43Å
321	L	65.7	Low	65.2	Low	113 Å²	113	79.4 Å²	79.4	59%	0.592	43%	0.429	S	S	*	.	H	α-helix	trans	-63.5	-40.6	176.7	-74.7	167.7	0	0	0	112	F317 S318 E324 E325	F317-L321 VanDerWaalsContact O-CG 3.3Å; F317-L321 WeakPolarHBondContact O-CG 3.4Å; F317-L321 PolarHBondContact O-N 2.77Å; F317-L321 VanDerWaalsContact O-N 3.13Å; S318-L321 PolarHBondContact O-N 2.88Å; L321-E324 PolarHBondContact O-N 3.33Å; L321-E325 PolarHBondContact O-N 3.36Å
322	V	70.3	Confident	64	Low	72 Å²	72	79 Å²	79	44%	0.436	43%	0.431	S	S	.	.	H	α-helix	trans	-67.4	-35.8	174.9	171.4	0	0	0	0	111.6	S318 E319 L320 K326	S318-V322 WeakPolarHBondContact O-CG2 3.37Å; S318-V322 PolarHBondContact O-N 3.41Å; S318-V322 VanDerWaalsContact O-N 3.13Å; E319-V322 PolarHBondContact O-N 2.96Å; L320-V322 PolarHBondContact O-N 2.62Å; V322-K326 HydrophobicContact CG1-CD 4.17Å; V322-K326 WeakPolarHBondContact O-CB 3.37Å; V322-K326 VanDerWaalsContact O-CG 3.24Å; V322-K326 WeakPolarHBondContact O-CG 3.27Å; V322-K326 PolarHBondContact O-N 3.14Å
323	A	61.7	Low	62.5	Low	34 Å²	34	83.8 Å²	83.8	28%	0.281	46%	0.458	S	S	.	.	H	α-helix	trans	-68.2	-41.6	174.4	0	0	0	0	0	112.2	I263 E319 L320 K326 L327	I263-A323 HydrophobicContact CD1-CB 4.16Å; E319-A323 WeakPolarHBondContact O-CB 3.49Å; E319-A323 PolarHBondContact O-N 3.13Å; L320-A323 PolarHBondContact O-N 3.39Å; A323-K326 PolarHBondContact O-N 3.41Å; A323-L327 WeakPolarHBondContact O-CB 3.28Å; A323-L327 PolarHBondContact O-N 2.9Å
324	E	65	Low	61.5	Low	135 Å²	135	88.9 Å²	88.9	63%	0.631	49%	0.491	S	S	*	.	H	α-helix	trans	-64.3	-44.4	175.6	-169.5	-178.9	175.6	0	0	111.3	L320 L321 K326 L327 A328	L320-E324 WeakPolarHBondContact O-CB 3.49Å; L320-E324 PolarHBondContact O-N 3.43Å; L321-E324 PolarHBondContact O-N 3.33Å; E324-K326 PolarHBondContact O-N 2.94Å; E324-L327 PolarHBondContact O-N 2.98Å; E324-A328 WeakPolarHBondContact O-CB 3.45Å; E324-A328 PolarHBondContact O-N 3.09Å
325	E	70.1	Confident	60.2	Low	130 Å²	130	96.3 Å²	96.3	61%	0.607	52%	0.516	S	S	*	.	H	α-helix	trans	-64.2	-40.3	176.1	-178.7	166.6	-152.8	0	0	112.2	L321 N329	L321-E325 PolarHBondContact O-N 3.36Å; E325-N329 WeakPolarHBondContact CG-ND2 3.4Å; E325-N329 WeakPolarHBondContact O-CB 3.48Å; E325-N329 VanDerWaalsContact O-CG 3.32Å; E325-N329 PolarHBondContact O-N 3.32Å; E325-N329 PolarHBondContact O-ND2 3.21Å
326	K	71.1	Confident	58.7	Low	142 Å²	142	102.2 Å²	102.2	62%	0.617	54%	0.538	S	S	*	.	H	α-helix	trans	-59.1	-50.9	173	-77.1	170.4	-179.3	176.8	0	110.9	V322 A323 E324 A328 N329 S330	V322-K326 HydrophobicContact CG1-CD 4.17Å; V322-K326 WeakPolarHBondContact O-CB 3.37Å; V322-K326 VanDerWaalsContact O-CG 3.24Å; V322-K326 WeakPolarHBondContact O-CG 3.27Å; V322-K326 PolarHBondContact O-N 3.14Å; A323-K326 PolarHBondContact O-N 3.41Å; E324-K326 PolarHBondContact O-N 2.94Å; K326-A328 PolarHBondContact O-N 3.37Å; K326-N329 PolarHBondContact O-N 3.33Å; K326-N329 VanDerWaalsContact O-N 3.12Å; K326-S330 PolarHBondContact O-N 2.88Å; K326-S330 PolarHBondContact O-OG 3.29Å
327	L	68.3	Low	57.8	Low	111 Å²	111	107.6 Å²	107.6	58%	0.581	57%	0.571	S	S	*	*	H	α-helix	trans	-64.1	-42.4	-179	-168.7	126.1	0	0	0	112.1	A323 E324 N329 S330 L331	A323-L327 WeakPolarHBondContact O-CB 3.28Å; A323-L327 PolarHBondContact O-N 2.9Å; E324-L327 PolarHBondContact O-N 2.98Å; L327-N329 PolarHBondContact O-N 3.21Å; L327-S330 PolarHBondContact O-N 3.44Å; L327-L331 HydrophobicContact CD2-CD1 3.66Å; L327-L331 HydrophobicContact CG-CD1 4.18Å; L327-L331 WeakPolarHBondContact O-CB 3.26Å; L327-L331 WeakPolarHBondContact O-CG 3.47Å; L327-L331 PolarHBondContact O-N 3.39Å
328	A	67.7	Low	56.8	Low	47 Å²	47	116.3 Å²	116.3	39%	0.388	60%	0.602	S	S	.	*	H	α-helix	trans	-66.1	-20.4	175.6	0	0	0	0	0	113.3	E324 K326 K332	E324-A328 WeakPolarHBondContact O-CB 3.45Å; E324-A328 PolarHBondContact O-N 3.09Å; K326-A328 PolarHBondContact O-N 3.37Å; A328-K332 PolarHBondContact O-NZ 2.88Å
329	N	63.8	Low	55.2	Low	85 Å²	85	116.5 Å²	116.5	46%	0.455	62%	0.616	S	S	.	*	H	α-helix	trans	-89.8	-39.4	172.6	-74.4	-37.7	0	0	0	112.5	E325 K326 L327 L331 K332	E325-N329 WeakPolarHBondContact CG-ND2 3.4Å; E325-N329 WeakPolarHBondContact O-CB 3.48Å; E325-N329 VanDerWaalsContact O-CG 3.32Å; E325-N329 PolarHBondContact O-N 3.32Å; E325-N329 PolarHBondContact O-ND2 3.21Å; K326-N329 PolarHBondContact O-N 3.33Å; K326-N329 VanDerWaalsContact O-N 3.12Å; L327-N329 PolarHBondContact O-N 3.21Å; N329-L331 VanDerWaalsContact C-N 3.31Å; N329-L331 PolarHBondContact O-N 3.4Å; N329-K332 PolarHBondContact O-N 3.06Å; N329-K332 PolarHBondContact OD1-NZ 2.83Å
330	S	57.6	Low	53.9	Low	103 Å²	103	119.8 Å²	119.8	72%	0.72	64%	0.635	S	S	*	*	H	α-helix	trans	-63.4	-31.9	174.3	-64.1	0	0	0	0	113.6	K326 L327 K332	K326-S330 PolarHBondContact O-N 2.88Å; K326-S330 PolarHBondContact O-OG 3.29Å; L327-S330 PolarHBondContact O-N 3.44Å; S330-K332 PolarHBondContact O-N 2.96Å
331	L	54.7	Low	52.8	Low	129 Å²	129	130.2 Å²	130.2	68%	0.675	67%	0.673	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76	-2.3	178.2	-72.9	170.1	0	0	0	114.6	L327 N329 L333	L327-L331 HydrophobicContact CD2-CD1 3.66Å; L327-L331 HydrophobicContact CG-CD1 4.18Å; L327-L331 WeakPolarHBondContact O-CB 3.26Å; L327-L331 WeakPolarHBondContact O-CG 3.47Å; L327-L331 PolarHBondContact O-N 3.39Å; N329-L331 VanDerWaalsContact C-N 3.31Å; N329-L331 PolarHBondContact O-N 3.4Å; L331-L333 PolarHBondContact O-N 3.36Å
332	K	45.1	Very low	51.6	Low	138 Å²	138	131.3 Å²	131.3	60%	0.6	68%	0.684	S	S	*	*			trans	-87.4	77.2	176.5	-63.9	-171	-170.4	74.4	0	111.5	A328 N329 S330	A328-K332 PolarHBondContact O-NZ 2.88Å; N329-K332 PolarHBondContact O-N 3.06Å; N329-K332 PolarHBondContact OD1-NZ 2.83Å; S330-K332 PolarHBondContact O-N 2.96Å
333	L	37.9	Very low	49.9	Very low	160 Å²	160	131 Å²	131	84%	0.838	70%	0.695	S	S	*	*			trans	-55.7	132.5	170.4	-79.4	163.4	0	0	0	111.4	L331 H335	L331-L333 PolarHBondContact O-N 3.36Å; L333-H335 PolarHBondContact O-N 3.23Å
334	P	43.2	Very low	48.9	Very low	114 Å²	114	133.1 Å²	133.1	74%	0.74	71%	0.713	S	S	*	*			trans	-77.5	113.1	-179.8	30.1	-33.3	0	0	0	111.2	E336	P334-E336 VanDerWaalsContact C-N 3.32Å; P334-E336 PolarHBondContact O-N 3.18Å
335	H	37.4	Very low	47.6	Very low	194 Å²	194	133.3 Å²	133.3	90%	0.898	72%	0.724	S	S	*	*			trans	-85	63.8	-174.6	-159.1	-62.4	0	0	0	112.8	L333	L333-H335 PolarHBondContact O-N 3.23Å
336	E	38.2	Very low	46.4	Very low	174 Å²	174	136.1 Å²	136.1	81%	0.813	73%	0.734	S	S	*	*			trans	-99.2	109.8	174.4	-72.9	-159.2	136.9	0	0	112.8	P334	P334-E336 VanDerWaalsContact C-N 3.32Å; P334-E336 PolarHBondContact O-N 3.18Å
337	T	43.6	Very low	45.2	Very low	119 Å²	119	138 Å²	138	73%	0.73	75%	0.745	S	S	*	*			trans	-164.1	137.2	142.5	0.7	0	0	0	0	112.5
338	R	38.7	Very low	44.1	Very low	241 Å²	241	142 Å²	142	91%	0.909	76%	0.758	S	S	*	*			trans	40.6	110	153	-67.5	169.6	-178.3	163.5	0.7	118.4
339	G	33.9	Very low	43.2	Very low	78 Å²	78	143.6 Å²	143.6	80%	0.804	77%	0.771	S	S	*	*			trans	-89.5	159.6	163.4	0	0	0	0	0	113.5
340	L	38.9	Very low	42.7	Very low	166 Å²	166	142 Å²	142	87%	0.869	78%	0.775	S	S	*	*			trans	-136.4	143.5	164.5	-144	74	0	0	0	108.3
341	R	34.9	Very low	42.9	Very low	249 Å²	249	142.9 Å²	142.9	94%	0.94	77%	0.771	S	S	*	*			trans	-98.7	111.4	178.6	-67.3	-172.6	-169.2	175.5	5.5	110.7
342	V	40.7	Very low	43.3	Very low	136 Å²	136	139.8 Å²	139.8	82%	0.824	76%	0.764	S	S	*	*			trans	-145.7	138.2	165.2	-172.1	0	0	0	0	110
343	G	35.5	Very low	44.4	Very low	66 Å²	66	138.4 Å²	138.4	68%	0.68	76%	0.763	S	S	*	*			trans	86	113.9	142.5	0	0	0	0	0	121.1
344	A	40.3	Very low	46	Very low	79 Å²	79	133 Å²	133	65%	0.653	74%	0.739	S	S	*	*				50.1	80.6	127.4	0	0	0	0	0	121.7	F346	A344-F346 PolarHBondContact O-N 3.23Å
345	T	37.3	Very low	47.3	Very low	139 Å²	139	129.4 Å²	129.4	85%	0.853	72%	0.719	S	S	*	*	S	Bend		41	44.6	114.1	62.3	0	0	0	0	121.5
346	F	44.9	Very low	49	Very low	189 Å²	189	122.7 Å²	122.7	83%	0.829	69%	0.689	S	S	*	*			trans	-130.6	-18.3	170.2	-96	-79.1	0	0	0	117.7	A344 K348	A344-F346 PolarHBondContact O-N 3.23Å; F346-K348 VanDerWaalsContact C-N 3.27Å; F346-K348 PolarHBondContact O-N 3.29Å
347	E	46.1	Very low	50.5	Low	180 Å²	180	116.7 Å²	116.7	84%	0.841	67%	0.67	S	S	*	*	G	3₁₀ helix	trans	-75.3	1.8	-166.1	-59.3	-169.3	116.5	0	0	117.2	A349 G350	E347-A349 PolarHBondContact O-N 3.28Å; E347-G350 PolarHBondContact O-N 3.17Å; E347-G350 VanDerWaalsContact O-N 3.1Å
348	K	45.1	Very low	51.8	Low	197 Å²	197	119.5 Å²	119.5	86%	0.857	67%	0.667	S	S	*	*	G	3₁₀ helix	trans	-61.2	-13.1	-167.1	-118.5	179.9	-176.3	177.4	0	116	F346	F346-K348 VanDerWaalsContact C-N 3.27Å; F346-K348 PolarHBondContact O-N 3.29Å
349	A	49.9	Very low	53.5	Low	80 Å²	80	114.7 Å²	114.7	66%	0.661	65%	0.652	S	S	*	*	G	3₁₀ helix	trans	-79.2	-44.8	174.6	0	0	0	0	0	112.9	E347 D351 A352	E347-A349 PolarHBondContact O-N 3.28Å; A349-D351 VanDerWaalsContact C-N 3.34Å; A349-D351 PolarHBondContact O-N 3.09Å; A349-A352 WeakPolarHBondContact O-CB 3.21Å; A349-A352 PolarHBondContact O-N 3.4Å; A349-A352 VanDerWaalsContact O-N 3.15Å
350	G	53	Low	55.2	Low	52 Å²	52	117.7 Å²	117.7	54%	0.536	64%	0.643	S	S	.	*	H	α-helix	trans	-65.8	-35	-173.2	0	0	0	0	0	113.5	E347 A352 D353 S354	E347-G350 PolarHBondContact O-N 3.17Å; E347-G350 VanDerWaalsContact O-N 3.1Å; G350-A352 VanDerWaalsContact C-N 3.26Å; G350-A352 PolarHBondContact O-N 3.43Å; G350-D353 PolarHBondContact O-N 2.84Å; G350-S354 WeakPolarHBondContact O-CB 3.34Å; G350-S354 PolarHBondContact O-N 3.4Å
351	D	60.7	Low	56.7	Low	121 Å²	121	118.4 Å²	118.4	65%	0.647	64%	0.639	S	S	*	*	H	α-helix	trans	-61.9	-32.7	175.8	-110.2	-14.8	0	0	0	112.8	A349 A355	A349-D351 VanDerWaalsContact C-N 3.34Å; A349-D351 PolarHBondContact O-N 3.09Å; D351-A355 WeakPolarHBondContact O-CB 3.3Å; D351-A355 PolarHBondContact O-N 3.14Å
352	A	65	Low	58	Low	63 Å²	63	112.4 Å²	112.4	52%	0.521	63%	0.63	S	S	.	*	H	α-helix	trans	-68.1	-46	-179.2	0	0	0	0	0	111.5	A349 G350 A355 L356	A349-A352 WeakPolarHBondContact O-CB 3.21Å; A349-A352 PolarHBondContact O-N 3.4Å; A349-A352 VanDerWaalsContact O-N 3.15Å; G350-A352 VanDerWaalsContact C-N 3.26Å; G350-A352 PolarHBondContact O-N 3.43Å; A352-A355 PolarHBondContact O-N 3.34Å; A352-L356 WeakPolarHBondContact O-CB 3.42Å; A352-L356 PolarHBondContact O-N 3.33Å
353	D	68.1	Low	58.7	Low	110 Å²	110	109.2 Å²	109.2	59%	0.588	62%	0.619	S	S	*	*	H	α-helix	trans	-74.8	-34.7	177.1	-90.1	-40.1	0	0	0	112.8	G350 A355 L356 A357	G350-D353 PolarHBondContact O-N 2.84Å; D353-A355 VanDerWaalsContact C-N 3.34Å; D353-A355 PolarHBondContact O-N 3.03Å; D353-L356 CarbonylContact O-C 3.53Å; D353-L356 PolarHBondContact O-N 2.67Å; D353-A357 VanDerWaalsContact O-CB 3.31Å; D353-A357 WeakPolarHBondContact O-CB 3.43Å; D353-A357 PolarHBondContact O-N 3.12Å
354	S	70.8	Confident	59.7	Low	46 Å²	46	109.5 Å²	109.5	32%	0.322	61%	0.614	S	S	.	*	H	α-helix	trans	-59.1	-45.1	169.4	-178.6	0	0	0	0	111.2	G350 A357 R358	G350-S354 WeakPolarHBondContact O-CB 3.34Å; G350-S354 PolarHBondContact O-N 3.4Å; S354-A357 PolarHBondContact O-N 3.12Å; S354-R358 WeakPolarHBondContact O-CB 3.47Å; S354-R358 VanDerWaalsContact O-CG 3.27Å; S354-R358 WeakPolarHBondContact O-CG 3.49Å; S354-R358 PolarHBondContact O-N 3.15Å
355	A	70.2	Confident	60.4	Low	38 Å²	38	112.4 Å²	112.4	31%	0.314	62%	0.618	S	S	.	*	H	α-helix	trans	-66.6	-36.2	174.3	0	0	0	0	0	112.6	D351 A352 D353 K359	D351-A355 WeakPolarHBondContact O-CB 3.3Å; D351-A355 PolarHBondContact O-N 3.14Å; A352-A355 PolarHBondContact O-N 3.34Å; D353-A355 VanDerWaalsContact C-N 3.34Å; D353-A355 PolarHBondContact O-N 3.03Å; A355-K359 WeakPolarHBondContact O-CB 3.3Å; A355-K359 WeakPolarHBondContact O-CG 3.39Å; A355-K359 PolarHBondContact O-N 3.02Å
356	L	72.6	Confident	61.4	Low	53 Å²	53	110.8 Å²	110.8	28%	0.277	61%	0.609	S	S	.	*	H	α-helix	trans	-69.6	-38.7	175.6	-176.2	59.3	0	0	0	112	A352 D353 K359 K360	A352-L356 WeakPolarHBondContact O-CB 3.42Å; A352-L356 PolarHBondContact O-N 3.33Å; D353-L356 CarbonylContact O-C 3.53Å; D353-L356 PolarHBondContact O-N 2.67Å; L356-K359 PolarHBondContact O-N 3.03Å; L356-K360 HydrophobicContact CG-CD 4.25Å; L356-K360 WeakPolarHBondContact O-CB 3.39Å; L356-K360 VanDerWaalsContact O-CG 3.29Å; L356-K360 WeakPolarHBondContact O-CG 3.45Å; L356-K360 PolarHBondContact O-N 3.23Å
357	A	70	Confident	61.9	Low	49 Å²	49	106.8 Å²	106.8	41%	0.405	60%	0.602	S	S	.	*	H	α-helix	trans	-65.4	-43.9	174.2	0	0	0	0	0	111.4	D353 S354 K360 K361	D353-A357 VanDerWaalsContact O-CB 3.31Å; D353-A357 WeakPolarHBondContact O-CB 3.43Å; D353-A357 PolarHBondContact O-N 3.12Å; S354-A357 PolarHBondContact O-N 3.12Å; A357-K360 PolarHBondContact O-N 2.78Å; A357-K361 PolarHBondContact O-N 3.02Å
358	R	72.4	Confident	62.3	Low	177 Å²	177	103.2 Å²	103.2	67%	0.668	60%	0.595	S	S	*	*	H	α-helix	trans	-60.9	-43.4	172	-69.5	174	-165.8	-145.9	2.4	111.4	S354 K361 T362	S354-R358 WeakPolarHBondContact O-CB 3.47Å; S354-R358 VanDerWaalsContact O-CG 3.27Å; S354-R358 WeakPolarHBondContact O-CG 3.49Å; S354-R358 PolarHBondContact O-N 3.15Å; R358-K361 PolarHBondContact O-N 3.02Å; R358-T362 WeakPolarHBondContact O-CB 3.28Å; R358-T362 PolarHBondContact O-N 2.89Å; R358-T362 PolarHBondContact O-OG1 2.95Å
359	K	73.2	Confident	62.6	Low	140 Å²	140	102.5 Å²	102.5	61%	0.609	60%	0.599	S	S	*	*	H	α-helix	trans	-61	-46.8	173.3	-75.8	166.7	-176	172.6	0	111.9	A355 L356 K361 T362 A363	A355-K359 WeakPolarHBondContact O-CB 3.3Å; A355-K359 WeakPolarHBondContact O-CG 3.39Å; A355-K359 PolarHBondContact O-N 3.02Å; L356-K359 PolarHBondContact O-N 3.03Å; K359-K361 PolarHBondContact O-N 2.86Å; K359-T362 CarbonylContact O-C 3.56Å; K359-T362 PolarHBondContact O-N 2.81Å; K359-T362 VanDerWaalsContact O-N 3.16Å; K359-A363 WeakPolarHBondContact O-CB 3.27Å; K359-A363 PolarHBondContact O-N 3.33Å
360	K	70.4	Confident	62.6	Low	142 Å²	142	102.2 Å²	102.2	62%	0.617	59%	0.592	S	S	*	*	H	α-helix	trans	-58	-44.3	176.7	-76.4	167.8	176.8	171.6	0	111.8	L356 A357	L356-K360 HydrophobicContact CG-CD 4.25Å; L356-K360 WeakPolarHBondContact O-CB 3.39Å; L356-K360 VanDerWaalsContact O-CG 3.29Å; L356-K360 WeakPolarHBondContact O-CG 3.45Å; L356-K360 PolarHBondContact O-N 3.23Å; A357-K360 PolarHBondContact O-N 2.78Å
361	K	68.8	Low	62.2	Low	180 Å²	180	105 Å²	105	78%	0.783	60%	0.595	S	S	*	*	H	α-helix	trans	-67.7	-34.7	174.8	-70.7	-173	177	-172.2	0	113.3	A357 R358 K359	A357-K361 PolarHBondContact O-N 3.02Å; R358-K361 PolarHBondContact O-N 3.02Å; K359-K361 PolarHBondContact O-N 2.86Å
362	T	62.2	Low	61.7	Low	123 Å²	123	103.5 Å²	103.5	76%	0.755	59%	0.59	S	S	*	*	H	α-helix	trans	-81.4	-22.2	179.4	-45.2	0	0	0	0	113	R358 K359	R358-T362 WeakPolarHBondContact O-CB 3.28Å; R358-T362 PolarHBondContact O-N 2.89Å; R358-T362 PolarHBondContact O-OG1 2.95Å; K359-T362 CarbonylContact O-C 3.56Å; K359-T362 PolarHBondContact O-N 2.81Å; K359-T362 VanDerWaalsContact O-N 3.16Å
363	A	55.7	Low	61	Low	70 Å²	70	106.2 Å²	106.2	58%	0.579	60%	0.6	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.1	14.6	178.7	0	0	0	0	0	113.1	K359 I365	K359-A363 WeakPolarHBondContact O-CB 3.27Å; K359-A363 PolarHBondContact O-N 3.33Å; A363-I365 PolarHBondContact O-N 3.41Å
364	A	56.6	Low	60.4	Low	71 Å²	71	106.3 Å²	106.3	59%	0.587	61%	0.605	S	S	*	*			trans	-64.6	97.7	163.2	0	0	0	0	0	108.2	P366	A364-P366 WeakPolarHBondContact O-CD 3.06Å
365	I	55.4	Low	59.6	Low	141 Å²	141	112.3 Å²	112.3	72%	0.723	62%	0.62	S	S	*	*	P	Polyproline II helix	trans	-62.6	120.2	176.8	-58.9	175.1	0	0	0	107.2	A363	A363-I365 PolarHBondContact O-N 3.41Å
366	P	58	Low	58.5	Low	104 Å²	104	116.3 Å²	116.3	68%	0.675	64%	0.643	S	S	*	*	P	Polyproline II helix	trans	-58.7	137.4	174.9	-23	34.2	0	0	0	109.8	A364	A364-P366 WeakPolarHBondContact O-CD 3.06Å
367	P	55.3	Low	57.6	Low	105 Å²	105	119.2 Å²	119.2	68%	0.682	66%	0.658	S	S	*	*	P	Polyproline II helix	trans	-52.4	133.9	171.5	-25.1	34.4	0	0	0	109.9	L369	P367-L369 PolarHBondContact O-N 3.47Å
368	P	55.8	Low	56.6	Low	106 Å²	106	127.4 Å²	127.4	69%	0.688	68%	0.678	S	S	*	*			trans	-64.5	108.9	179.6	25.4	-32.6	0	0	0	109.6	S370	P368-S370 PolarHBondContact O-N 3.02Å
369	L	51.1	Low	55.8	Low	182 Å²	182	127.7 Å²	127.7	95%	0.953	68%	0.68	S	S	*	*			trans	-74.5	75.8	170.8	-66.6	175.4	0	0	0	109.2	P367	P367-L369 PolarHBondContact O-N 3.47Å
370	S	48.4	Very low	55.2	Low	73 Å²	73	130.8 Å²	130.8	51%	0.51	69%	0.69	S	S	.	*			trans	-124.4	113.9	169.4	53.1	0	0	0	0	108.2	P368	P368-S370 PolarHBondContact O-N 3.02Å
371	D	46.3	Very low	54.7	Low	111 Å²	111	135.3 Å²	135.3	59%	0.594	70%	0.703	S	S	*	*			trans	-70.5	159.6	163.5	-146.5	-25.7	0	0	0	109.2	R242	R242-D371 IonicContact CZ-OD2 3.77Å; R242-D371 IonicContact NH1-OD2 3.72Å; R242-D371 PolarHBondContact NH1-OD2 3.09Å; R242-D371 IonicContact NH2-OD1 2.82Å; R242-D371 PolarHBondContact NH2-OD1 2.88Å; R242-D371 IonicContact NH2-OD2 2.7Å; R242-D371 PolarHBondContact NH2-OD2 3.38Å
372	V	49.8	Very low	54.8	Low	90 Å²	90	129.5 Å²	129.5	55%	0.545	68%	0.682	S	S	.	*	S	Bend	trans	76.1	127	177.2	-160.2	0	0	0	0	117.1	V374	V372-V374 PolarHBondContact O-N 2.83Å
373	T	50.1	Low	55.1	Low	120 Å²	120	132.9 Å²	132.9	74%	0.736	69%	0.687	S	S	*	*	S	Bend	trans	50.8	-12.5	160.5	54.1	0	0	0	0	124.4	R375	T373-R375 PolarHBondContact O-N 3.43Å
374	V	54.4	Low	55.7	Low	111 Å²	111	133.3 Å²	133.3	67%	0.673	68%	0.679	S	S	*	*			trans	-73.7	119.5	-179.6	-172.6	0	0	0	0	112.4	V372	V372-V374 PolarHBondContact O-N 2.83Å
375	R	54.6	Low	56.1	Low	173 Å²	173	133.7 Å²	133.7	65%	0.653	68%	0.676	S	S	*	*			trans	-60.5	143.5	176.1	-66.4	-169.8	-172.8	-157.6	5.9	111.4	T373 I377 S691	T373-R375 PolarHBondContact O-N 3.43Å; R375-I377 PolarHBondContact O-N 2.99Å; R375-I377 VanDerWaalsContact O-N 3.13Å; R375-S691 PolarHBondContact NH1-OG 2.78Å
376	P	46.7	Very low	56.5	Low	122 Å²	122	131.9 Å²	131.9	79%	0.792	67%	0.665	S	S	*	*			trans	-67.6	111.8	-176.6	26.8	-34.8	0	0	0	112.3	R378	P376-R378 PolarHBondContact O-N 3.39Å; P376-R378 VanDerWaalsContact O-N 3.09Å
377	I	53.9	Low	56.7	Low	114 Å²	114	133.6 Å²	133.6	59%	0.585	66%	0.662	S	S	*	*			trans	-67.4	106.8	175.1	-59.5	176.2	0	0	0	109.1	R375 Y379	R375-I377 PolarHBondContact O-N 2.99Å; R375-I377 VanDerWaalsContact O-N 3.13Å; I377-Y379 HydrophobicContact CB-CE2 4.13Å; I377-Y379 HydrophobicContact CG2-CD1 4.34Å; I377-Y379 HydrophobicContact CG2-CD2 4.36Å; I377-Y379 HydrophobicContact CG2-CE1 4.02Å; I377-Y379 HydrophobicContact CG2-CE2 4.05Å; I377-Y379 VanDerWaalsContact O-CD2 3.27Å; I377-Y379 WeakPolarHBondContact O-CD2 3.45Å; I377-Y379 PolarHBondContact O-N 3.28Å
378	R	48.8	Very low	56.9	Low	221 Å²	221	135.6 Å²	135.6	83%	0.834	66%	0.66	S	S	*	*			trans	-71.6	88	175.7	-71.9	-174.5	177.3	177.1	0.8	110.9	P376 Y380	P376-R378 PolarHBondContact O-N 3.39Å; P376-R378 VanDerWaalsContact O-N 3.09Å; R378-Y380 PolarHBondContact O-N 3.05Å
379	Y	56.8	Low	56.9	Low	182 Å²	182	138.3 Å²	138.3	71%	0.714	66%	0.657	S	S	*	*			trans	-65.9	102.2	172.4	-65.1	-78.5	0	0	0	111.4	I377 R381	I377-Y379 HydrophobicContact CB-CE2 4.13Å; I377-Y379 HydrophobicContact CG2-CD1 4.34Å; I377-Y379 HydrophobicContact CG2-CD2 4.36Å; I377-Y379 HydrophobicContact CG2-CE1 4.02Å; I377-Y379 HydrophobicContact CG2-CE2 4.05Å; I377-Y379 VanDerWaalsContact O-CD2 3.27Å; I377-Y379 WeakPolarHBondContact O-CD2 3.45Å; I377-Y379 PolarHBondContact O-N 3.28Å; Y379-R381 PolarHBondContact O-N 2.98Å
380	Y	61.1	Low	57	Low	205 Å²	205	137 Å²	137	80%	0.804	64%	0.643	S	S	*	*			trans	-67.6	122.9	173.2	35.7	-96.7	0	0	0	111.2	R378 V382	R378-Y380 PolarHBondContact O-N 3.05Å; Y380-V382 HydrophobicContact CD2-CG2 4.11Å; Y380-V382 PolarHBondContact O-N 3.08Å
381	R	59.9	Low	57.2	Low	238 Å²	238	139.2 Å²	139.2	90%	0.898	65%	0.653	S	S	*	*			trans	-72.7	85	-176.2	-170	-177.4	-174.2	-170.9	3.9	111.6	Y379 K383	Y379-R381 PolarHBondContact O-N 2.98Å; R381-K383 PolarHBondContact O-N 3.5Å
382	V	70.9	Confident	57.3	Low	57 Å²	57	138.7 Å²	138.7	35%	0.345	65%	0.648	S	S	.	*			trans	-61.7	108.5	171	-175.6	0	0	0	0	109	Y380 D384 P385 K388	Y380-V382 HydrophobicContact CD2-CG2 4.11Å; Y380-V382 PolarHBondContact O-N 3.08Å; V382-D384 PolarHBondContact O-N 2.9Å; V382-P385 HydrophobicContact CG1-CB 4.38Å; V382-K388 HydrophobicContact CG1-CD 4.01Å; V382-K388 HydrophobicContact CG1-CG 4.31Å
383	K	67.9	Low	57.4	Low	195 Å²	195	137.3 Å²	137.3	85%	0.848	64%	0.637	S	S	*	*	S	Bend	trans	-58	-49.8	-175.7	-67.2	-175.6	178.4	-178.9	0	112.2	R381	R381-K383 PolarHBondContact O-N 3.5Å
384	D	67.3	Low	57.2	Low	79 Å²	79	141 Å²	141	42%	0.422	64%	0.638	S	S	.	*			trans	-122.2	87	177.7	-77.9	-38.5	0	0	0	111.2	V382 M386 K387 K388	V382-D384 PolarHBondContact O-N 2.9Å; D384-M386 VanDerWaalsContact C-N 3.25Å; D384-M386 PolarHBondContact O-N 3.43Å; D384-K387 HydrophobicContact CB-CB 3.9Å; D384-K387 HydrophobicContact CB-CD 3.82Å; D384-K387 HydrophobicContact CB-CG 3.87Å; D384-K387 PolarHBondContact O-N 3.34Å; D384-K387 VanDerWaalsContact O-N 3.17Å; D384-K387 WeakPolarHBondContact OD2-CD 3.49Å; D384-K387 VanDerWaalsContact OD2-CE 3.25Å; D384-K387 WeakPolarHBondContact OD2-CE 3.39Å; D384-K387 IonicContact OD2-NZ 2.67Å; D384-K387 PolarHBondContact OD2-NZ 3.39Å; D384-K388 PolarHBondContact O-N 3.05Å
385	P	65.6	Low	57	Low	79 Å²	79	138.5 Å²	138.5	51%	0.513	62%	0.623	S	S	.	*	H	α-helix	trans	-62.3	-34.1	178	24.7	-33.2	0	0	0	112	V382 K387 K388 W389	V382-P385 HydrophobicContact CG1-CB 4.38Å; P385-K387 VanDerWaalsContact C-N 3.31Å; P385-K387 PolarHBondContact O-N 3.11Å; P385-K388 PolarHBondContact O-N 3.45Å; P385-W389 WeakPolarHBondContact O-CB 3.2Å; P385-W389 PolarHBondContact O-N 3.48Å
386	M	63.2	Low	56.8	Low	103 Å²	103	134.7 Å²	134.7	51%	0.507	62%	0.623	S	S	.	*	H	α-helix	trans	-62.2	-33.6	175.4	-110.9	82.2	79.5	0	0	113.4	D384 K390	D384-M386 VanDerWaalsContact C-N 3.25Å; D384-M386 PolarHBondContact O-N 3.43Å; M386-K390 WeakPolarHBondContact O-CB 3.37Å; M386-K390 VanDerWaalsContact O-CG 3.29Å; M386-K390 WeakPolarHBondContact O-CG 3.38Å; M386-K390 PolarHBondContact O-N 2.99Å
387	K	63.6	Low	57.2	Low	139 Å²	139	139.6 Å²	139.6	60%	0.604	63%	0.625	S	S	*	*	H	α-helix	trans	-74	-40.4	179.5	-71.7	-178.6	-172.8	155.2	0	111.5	D384 P385	D384-K387 HydrophobicContact CB-CB 3.9Å; D384-K387 HydrophobicContact CB-CD 3.82Å; D384-K387 HydrophobicContact CB-CG 3.87Å; D384-K387 PolarHBondContact O-N 3.34Å; D384-K387 VanDerWaalsContact O-N 3.17Å; D384-K387 WeakPolarHBondContact OD2-CD 3.49Å; D384-K387 VanDerWaalsContact OD2-CE 3.25Å; D384-K387 WeakPolarHBondContact OD2-CE 3.39Å; D384-K387 IonicContact OD2-NZ 2.67Å; D384-K387 PolarHBondContact OD2-NZ 3.39Å; P385-K387 VanDerWaalsContact C-N 3.31Å; P385-K387 PolarHBondContact O-N 3.11Å
388	K	59.7	Low	57.7	Low	147 Å²	147	141.8 Å²	141.8	64%	0.639	63%	0.626	S	S	*	*	H	α-helix	trans	-65.2	-45.8	172.9	-70.9	-157	172.3	-162.5	0	111.6	V382 D384 P385 K390 V391	V382-K388 HydrophobicContact CG1-CD 4.01Å; V382-K388 HydrophobicContact CG1-CG 4.31Å; D384-K388 PolarHBondContact O-N 3.05Å; P385-K388 PolarHBondContact O-N 3.45Å; K388-K390 PolarHBondContact O-N 3.02Å; K388-V391 PolarHBondContact O-N 3.36Å; K388-V391 VanDerWaalsContact O-N 3.15Å
389	W	55.3	Low	58.9	Low	163 Å²	163	131.8 Å²	131.8	62%	0.617	59%	0.589	S	S	*	*	H	α-helix	trans	-62.2	-40.2	-179.8	-171.4	8.6	0	0	0	112.5	P385 V391 E392 D393	P385-W389 WeakPolarHBondContact O-CB 3.2Å; P385-W389 PolarHBondContact O-N 3.48Å; W389-V391 PolarHBondContact O-N 2.91Å; W389-V391 VanDerWaalsContact O-N 3.14Å; W389-E392 WeakPolarHBondContact O-CA 3.23Å; W389-E392 WeakPolarHBondContact O-CB 3.26Å; W389-E392 PolarHBondContact O-N 2.85Å; W389-D393 PolarHBondContact O-N 3.44Å
390	K	53.7	Low	60	Low	154 Å²	154	127 Å²	127	67%	0.67	58%	0.581	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62	-18	175.6	-81.5	-175	172.5	-162.6	0	115.5	M386 K388 D393	M386-K390 WeakPolarHBondContact O-CB 3.37Å; M386-K390 VanDerWaalsContact O-CG 3.29Å; M386-K390 WeakPolarHBondContact O-CG 3.38Å; M386-K390 PolarHBondContact O-N 2.99Å; K388-K390 PolarHBondContact O-N 3.02Å; K390-D393 WeakPolarHBondContact CA-OD2 3.42Å
391	V	51	Low	60.9	Low	120 Å²	120	123 Å²	123	73%	0.727	57%	0.57	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.1	-18.8	172.8	177.8	0	0	0	0	111.2	K388 W389	K388-V391 PolarHBondContact O-N 3.36Å; K388-V391 VanDerWaalsContact O-N 3.15Å; W389-V391 PolarHBondContact O-N 2.91Å; W389-V391 VanDerWaalsContact O-N 3.14Å
392	E	49.1	Very low	62	Low	101 Å²	101	119.2 Å²	119.2	47%	0.472	56%	0.562	S	S	.	*	S	Bend	trans	-93.6	-1.2	177.2	-140.2	100.9	-159.6	0	0	112.9	W389 R394 K790	W389-E392 WeakPolarHBondContact O-CA 3.23Å; W389-E392 WeakPolarHBondContact O-CB 3.26Å; W389-E392 PolarHBondContact O-N 2.85Å; E392-R394 PolarHBondContact O-N 3.15Å; E392-K790 IonicContact OE1-NZ 2.67Å; E392-K790 PolarHBondContact OE1-NZ 2.6Å
393	D	51.4	Low	62.9	Low	61 Å²	61	117.8 Å²	117.8	33%	0.326	55%	0.552	S	S	.	*			trans	-70.3	42.9	177.8	-84.6	-37	0	0	0	113.4	W389 K390 T395 S396	W389-D393 PolarHBondContact O-N 3.44Å; K390-D393 WeakPolarHBondContact CA-OD2 3.42Å; D393-T395 PolarHBondContact O-N 2.87Å; D393-S396 PolarHBondContact O-N 2.85Å; D393-S396 PolarHBondContact O-OG 3.01Å
394	R	45.8	Very low	63.7	Low	197 Å²	197	110.8 Å²	110.8	74%	0.743	52%	0.521	S	S	*	.	G	3₁₀ helix	trans	-65.7	-3.8	174.6	-71.6	-173.9	172.2	-163.5	-2	113.9	E392 S396 R397	E392-R394 PolarHBondContact O-N 3.15Å; R394-S396 PolarHBondContact O-N 3.27Å; R394-R397 WeakPolarHBondContact O-CB 3.36Å; R394-R397 PolarHBondContact O-N 2.91Å
395	T	50.8	Low	64.6	Low	59 Å²	59	110.9 Å²	110.9	36%	0.362	53%	0.525	S	S	.	.	G	3₁₀ helix	trans	-53.9	-29	166.7	35.8	0	0	0	0	112.7	D393 R397 W398 F439	D393-T395 PolarHBondContact O-N 2.87Å; T395-R397 PolarHBondContact O-N 2.98Å; T395-W398 PolarHBondContact O-N 2.81Å; T395-F439 HydrophobicContact CG2-CD1 4.43Å; T395-F439 HydrophobicContact CG2-CD2 3.63Å; T395-F439 HydrophobicContact CG2-CE1 4.29Å; T395-F439 HydrophobicContact CG2-CE2 3.48Å; T395-F439 VanDerWaalsContact CG2-CE2 3.48Å; T395-F439 HydrophobicContact CG2-CG 4.15Å; T395-F439 HydrophobicContact CG2-CZ 3.83Å
396	S	50.1	Low	65.6	Low	93 Å²	93	108.8 Å²	108.8	65%	0.65	51%	0.508	S	S	*	.	G	3₁₀ helix	trans	-61.5	-21.9	171.4	-55	0	0	0	0	114.4	D393 R394	D393-S396 PolarHBondContact O-N 2.85Å; D393-S396 PolarHBondContact O-OG 3.01Å; R394-S396 PolarHBondContact O-N 3.27Å
397	R	55.2	Low	66.9	Low	225 Å²	225	103.9 Å²	103.9	85%	0.849	48%	0.484	S	S	*	.	G	3₁₀ helix	trans	-96.6	-6.3	-175.7	-163.6	167.5	-175.7	151.6	2.5	113.8	R394 T395	R394-R397 WeakPolarHBondContact O-CB 3.36Å; R394-R397 PolarHBondContact O-N 2.91Å; T395-R397 PolarHBondContact O-N 2.98Å
398	W	64.7	Low	68	Low	159 Å²	159	98.4 Å²	98.4	60%	0.602	46%	0.462	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.7	-19.5	-178.8	-87.1	55.1	0	0	0	113.8	T395 K428	T395-W398 PolarHBondContact O-N 2.81Å; W398-K428 WeakPolarHBondContact O-CE 3.4Å; W398-K428 PolarHBondContact O-NZ 3.06Å
399	F	74	Confident	69.4	Low	12 Å²	12	96.4 Å²	96.4	5%	0.053	45%	0.453	C	S	.	.	S	Bend	trans	-120.7	116.4	176.2	-88.2	-110.2	0	0	0	110.2	E403 K404 F407 I425 K428 D432 Y436	F399-E403 WeakPolarHBondContact CA-OE2 3.23Å; F399-E403 HydrophobicContact CD1-CB 3.82Å; F399-E403 HydrophobicContact CE1-CB 4.46Å; F399-K404 HydrophobicContact CB-CG 3.93Å; F399-K404 WeakPolarHBondContact O-CE 3.49Å; F399-F407 HydrophobicContact CE1-CD2 4.39Å; F399-I425 HydrophobicContact CE1-CD1 4.31Å; F399-K428 HydrophobicContact CD2-CD 4.4Å; F399-K428 HydrophobicContact CE1-CG 4.42Å; F399-K428 HydrophobicContact CE2-CD 3.89Å; F399-K428 HydrophobicContact CZ-CD 3.97Å; F399-K428 HydrophobicContact CZ-CG 4.14Å; F399-D432 HydrophobicContact CE2-CB 4.25Å; F399-Y436 HydrophobicContact CB-CD2 4.01Å; F399-Y436 HydrophobicContact CB-CE2 3.96Å; F399-Y436 AromaticContact CD1-CD2 3.72Å; F399-Y436 HydrophobicContact CD1-CD2 3.72Å; F399-Y436 HydrophobicContact CD1-CE2 4.03Å; F399-Y436 HydrophobicContact CD1-CG 4.28Å; F399-Y436 AromaticContact CD2-CD2 3.63Å; F399-Y436 HydrophobicContact CD2-CD2 3.63Å; F399-Y436 HydrophobicContact CD2-CE2 4.44Å; F399-Y436 HydrophobicContact CD2-CG 4.34Å; F399-Y436 HydrophobicContact CE1-CD2 4.05Å; F399-Y436 HydrophobicContact CE1-CG 4.15Å; F399-Y436 AromaticContact CE2-CD2 3.97Å; F399-Y436 HydrophobicContact CE2-CD2 3.97Å; F399-Y436 HydrophobicContact CE2-CG 4.22Å; F399-Y436 AromaticContact CG-CD2 3.5Å; F399-Y436 HydrophobicContact CG-CD2 3.5Å; F399-Y436 AromaticContact CG-CE2 3.9Å; F399-Y436 HydrophobicContact CG-CE2 3.9Å; F399-Y436 HydrophobicContact CG-CG 4.37Å; F399-Y436 HydrophobicContact CZ-CD2 4.17Å; F399-Y436 HydrophobicContact CZ-CG 4.13Å
400	C	79.1	Confident	70.9	Confident	81 Å²	81	90.9 Å²	90.9	55%	0.547	43%	0.432	S	S	.	.			trans	-65.3	155.3	167.1	-69.1	0	0	0	0	110.2	E402 E403 K404	C400-E402 VanDerWaalsContact C-N 3.27Å; C400-E402 PolarHBondContact O-N 3.3Å; C400-E403 HydrophobicContact CB-CG 4.1Å; C400-E403 PolarHBondContact N-OE2 2.89Å; C400-E403 WeakPolarHBondContact O-CB 3.32Å; C400-E403 PolarHBondContact O-N 3.21Å; C400-K404 WeakPolarHBondContact O-CG 3.28Å; C400-K404 PolarHBondContact O-N 3.33Å; C400-K404 VanDerWaalsContact O-N 3.08Å
401	E	80.7	Confident	72.6	Confident	121 Å²	121	83.7 Å²	83.7	57%	0.565	40%	0.4	S	S	*	.	H	α-helix	trans	-60.4	-38.5	-174.5	-161.2	59.8	-138.8	0	0	112.1	E403 K404 T405	E401-E403 PolarHBondContact O-N 3.16Å; E401-K404 WeakPolarHBondContact O-CB 3.48Å; E401-K404 PolarHBondContact O-N 3.23Å; E401-K404 VanDerWaalsContact O-N 3.08Å; E401-K404 WeakPolarHBondContact OE2-CD 3.38Å; E401-K404 WeakPolarHBondContact OE2-CE 3.44Å; E401-K404 IonicContact OE2-NZ 2.75Å; E401-K404 PolarHBondContact OE2-NZ 2.86Å; E401-T405 WeakPolarHBondContact O-CG2 3.3Å; E401-T405 PolarHBondContact O-N 3.13Å
402	E	84	Confident	74.3	Confident	159 Å²	159	84 Å²	84	74%	0.743	39%	0.392	S	S	*	.	H	α-helix	trans	-52.9	-50.1	171.6	-66.1	167.3	-169.1	0	0	111.8	C400 K404 T405 E406	C400-E402 VanDerWaalsContact C-N 3.27Å; C400-E402 PolarHBondContact O-N 3.3Å; E402-K404 VanDerWaalsContact C-N 3.28Å; E402-K404 PolarHBondContact O-N 2.95Å; E402-T405 PolarHBondContact O-N 3.18Å; E402-T405 VanDerWaalsContact O-N 3.08Å; E402-T405 PolarHBondContact O-OG1 3.43Å; E402-E406 PolarHBondContact O-N 2.92Å
403	E	88	Confident	75.9	Confident	27 Å²	27	84.7 Å²	84.7	13%	0.126	40%	0.395	C	S	.	.	H	α-helix	trans	-62	-34.1	177.6	-55.4	-177.3	120.3	0	0	112.2	F399 C400 E401 F407 I425 K428	F399-E403 WeakPolarHBondContact CA-OE2 3.23Å; F399-E403 HydrophobicContact CD1-CB 3.82Å; F399-E403 HydrophobicContact CE1-CB 4.46Å; C400-E403 HydrophobicContact CB-CG 4.1Å; C400-E403 PolarHBondContact N-OE2 2.89Å; C400-E403 WeakPolarHBondContact O-CB 3.32Å; C400-E403 PolarHBondContact O-N 3.21Å; E401-E403 PolarHBondContact O-N 3.16Å; E403-F407 WeakPolarHBondContact O-CB 3.18Å; E403-F407 PolarHBondContact O-N 3.12Å; E403-I425 HydrophobicContact CB-CG2 3.84Å; E403-I425 HydrophobicContact CG-CG2 3.93Å; E403-K428 WeakPolarHBondContact OE1-CE 3.5Å; E403-K428 IonicContact OE1-NZ 2.57Å; E403-K428 PolarHBondContact OE1-NZ 3.17Å; E403-K428 WeakPolarHBondContact OE2-CE 3.27Å; E403-K428 IonicContact OE2-NZ 2.59Å; E403-K428 PolarHBondContact OE2-NZ 3.06Å
404	K	85.3	Confident	77.4	Confident	47 Å²	47	86.4 Å²	86.4	20%	0.204	40%	0.398	C	S	.	.	H	α-helix	trans	-69.3	-40.2	173.1	-55.7	178	-153.5	158.5	0	111.7	F399 C400 E401 E402 N408 Y436	F399-K404 HydrophobicContact CB-CG 3.93Å; F399-K404 WeakPolarHBondContact O-CE 3.49Å; C400-K404 WeakPolarHBondContact O-CG 3.28Å; C400-K404 PolarHBondContact O-N 3.33Å; C400-K404 VanDerWaalsContact O-N 3.08Å; E401-K404 WeakPolarHBondContact O-CB 3.48Å; E401-K404 PolarHBondContact O-N 3.23Å; E401-K404 VanDerWaalsContact O-N 3.08Å; E401-K404 WeakPolarHBondContact OE2-CD 3.38Å; E401-K404 WeakPolarHBondContact OE2-CE 3.44Å; E401-K404 IonicContact OE2-NZ 2.75Å; E401-K404 PolarHBondContact OE2-NZ 2.86Å; E402-K404 VanDerWaalsContact C-N 3.28Å; E402-K404 PolarHBondContact O-N 2.95Å; K404-N408 WeakPolarHBondContact O-CB 3.19Å; K404-N408 PolarHBondContact O-N 2.81Å; K404-N408 PolarHBondContact O-ND2 2.98Å; K404-Y436 HydrophobicContact CD-CE2 4.21Å; K404-Y436 HydrophobicContact CG-CE2 3.75Å; K404-Y436 WeakPolarHBondContact CG-OH 3.45Å
405	T	85.7	Confident	79.2	Confident	82 Å²	82	79.5 Å²	79.5	50%	0.503	38%	0.38	S	S	.	.	H	α-helix	trans	-66.5	-40.7	176.8	67	0	0	0	0	111.3	E401 E402 N408 K409	E401-T405 WeakPolarHBondContact O-CG2 3.3Å; E401-T405 PolarHBondContact O-N 3.13Å; E402-T405 PolarHBondContact O-N 3.18Å; E402-T405 VanDerWaalsContact O-N 3.08Å; E402-T405 PolarHBondContact O-OG1 3.43Å; T405-N408 PolarHBondContact O-N 3.18Å; T405-K409 VanDerWaalsContact O-CB 3.31Å; T405-K409 WeakPolarHBondContact O-CB 3.46Å; T405-K409 PolarHBondContact O-N 2.97Å
406	E	86.9	Confident	80.6	Confident	35 Å²	35	81.8 Å²	81.8	16%	0.164	39%	0.385	C	S	.	.	H	α-helix	trans	-71.3	-41.5	177.2	-165.8	63.2	-172.2	0	0	111.3	E402 N408 K409 R410	E402-E406 PolarHBondContact O-N 2.92Å; E406-N408 VanDerWaalsContact C-N 3.28Å; E406-N408 PolarHBondContact O-N 3.15Å; E406-K409 WeakPolarHBondContact O-CB 3.33Å; E406-K409 PolarHBondContact O-N 3.47Å; E406-K409 VanDerWaalsContact O-N 3.08Å; E406-K409 IonicContact OE1-NZ 2.9Å; E406-K409 PolarHBondContact OE1-NZ 2.91Å; E406-K409 VanDerWaalsContact OE2-CD 3.25Å; E406-K409 WeakPolarHBondContact OE2-CD 3.44Å; E406-K409 WeakPolarHBondContact OE2-CE 3.5Å; E406-K409 IonicContact OE2-NZ 3.96Å; E406-K409 PolarHBondContact OE2-NZ 2.87Å; E406-R410 HydrophobicContact CG-CG 4.3Å; E406-R410 WeakPolarHBondContact O-CG 3.38Å; E406-R410 PolarHBondContact O-N 3.49Å; E406-R410 IonicContact OE1-CZ 3.48Å; E406-R410 IonicContact OE1-NE 2.66Å; E406-R410 PolarHBondContact OE1-NE 3.12Å; E406-R410 IonicContact OE1-NH2 2.69Å; E406-R410 PolarHBondContact OE1-NH2 2.92Å
407	F	90.7	Very high	82.4	Confident	0 Å²	0	80 Å²	80	0%	0	37%	0.372	C	S	.	.	H	α-helix	trans	-52.9	-47.3	169	-175.8	-86.4	0	0	0	111.3	F399 E403 K409 R410 F411 F418 I421 I425 C433 Y436 F446	F399-F407 HydrophobicContact CE1-CD2 4.39Å; E403-F407 WeakPolarHBondContact O-CB 3.18Å; E403-F407 PolarHBondContact O-N 3.12Å; F407-K409 PolarHBondContact O-N 3.46Å; F407-R410 PolarHBondContact O-N 3.43Å; F407-F411 HydrophobicContact CE1-CB 4.38Å; F407-F411 HydrophobicContact CE1-CD2 4.18Å; F407-F411 HydrophobicContact CZ-CD2 4.24Å; F407-F411 WeakPolarHBondContact O-CB 3.33Å; F407-F411 PolarHBondContact O-N 3.25Å; F407-F418 HydrophobicContact CZ-CE1 4.49Å; F407-I421 HydrophobicContact CD2-CG2 3.54Å; F407-I421 HydrophobicContact CE2-CG2 3.84Å; F407-I421 HydrophobicContact CG-CG2 4.32Å; F407-I425 HydrophobicContact CB-CD1 3.76Å; F407-I425 HydrophobicContact CD2-CD1 3.96Å; F407-I425 HydrophobicContact CG-CD1 4.38Å; F407-C433 HydrophobicContact CD2-CB 4.49Å; F407-C433 HydrophobicContact CE2-CB 3.87Å; F407-Y436 AromaticContact CD1-CD1 3.66Å; F407-Y436 HydrophobicContact CD1-CD1 3.66Å; F407-Y436 AromaticContact CD1-CE1 3.7Å; F407-Y436 HydrophobicContact CD1-CE1 3.7Å; F407-Y436 HydrophobicContact CD2-CD1 4.31Å; F407-Y436 AromaticContact CE1-CD1 3.65Å; F407-Y436 HydrophobicContact CE1-CD1 3.65Å; F407-Y436 HydrophobicContact CE1-CE1 4Å; F407-Y436 HydrophobicContact CE2-CD1 4.29Å; F407-Y436 HydrophobicContact CG-CD1 4.03Å; F407-Y436 HydrophobicContact CG-CE1 4.25Å; F407-Y436 AromaticContact CZ-CD1 3.99Å; F407-Y436 HydrophobicContact CZ-CD1 3.99Å; F407-F446 HydrophobicContact CD1-CE1 4.12Å; F407-F446 HydrophobicContact CD1-CZ 4.23Å; F407-F446 AromaticContact CE1-CE1 3.66Å; F407-F446 HydrophobicContact CE1-CE1 3.66Å; F407-F446 AromaticContact CE1-CZ 3.8Å; F407-F446 HydrophobicContact CE1-CZ 3.8Å
408	N	87.4	Confident	84	Confident	24 Å²	24	70.8 Å²	70.8	13%	0.128	34%	0.338	C	S	.	.	H	α-helix	trans	-69.3	-29.2	177.9	-90.3	-64.9	0	0	0	114.2	K404 T405 E406 K412 E444 F446 L449	K404-N408 WeakPolarHBondContact O-CB 3.19Å; K404-N408 PolarHBondContact O-N 2.81Å; K404-N408 PolarHBondContact O-ND2 2.98Å; T405-N408 PolarHBondContact O-N 3.18Å; E406-N408 VanDerWaalsContact C-N 3.28Å; E406-N408 PolarHBondContact O-N 3.15Å; N408-K412 WeakPolarHBondContact O-CD 3.26Å; N408-K412 WeakPolarHBondContact O-CE 3.1Å; N408-K412 WeakPolarHBondContact O-CG 3.49Å; N408-E444 PolarHBondContact ND2-OE2 2.97Å; N408-E444 PolarHBondContact OD1-OE2 3.15Å; N408-F446 WeakPolarHBondContact OD1-CE1 3.44Å; N408-L449 HydrophobicContact CB-CD2 4.45Å; N408-L449 WeakPolarHBondContact OD1-CD2 3.4Å
409	K	87.9	Confident	85.2	Confident	104 Å²	104	68.8 Å²	68.8	45%	0.452	34%	0.339	S	S	.	.	H	α-helix	trans	-72	-45.8	174.4	-179.2	169.4	134.5	-147.3	0	110.5	T405 E406 F407 K412	T405-K409 VanDerWaalsContact O-CB 3.31Å; T405-K409 WeakPolarHBondContact O-CB 3.46Å; T405-K409 PolarHBondContact O-N 2.97Å; E406-K409 WeakPolarHBondContact O-CB 3.33Å; E406-K409 PolarHBondContact O-N 3.47Å; E406-K409 VanDerWaalsContact O-N 3.08Å; E406-K409 IonicContact OE1-NZ 2.9Å; E406-K409 PolarHBondContact OE1-NZ 2.91Å; E406-K409 VanDerWaalsContact OE2-CD 3.25Å; E406-K409 WeakPolarHBondContact OE2-CD 3.44Å; E406-K409 WeakPolarHBondContact OE2-CE 3.5Å; E406-K409 IonicContact OE2-NZ 3.96Å; E406-K409 PolarHBondContact OE2-NZ 2.87Å; F407-K409 PolarHBondContact O-N 3.46Å; K409-K412 PolarHBondContact O-N 2.91Å
410	R	88	Confident	85.9	Confident	47 Å²	47	69.6 Å²	69.6	18%	0.177	35%	0.349	C	S	.	.	H	α-helix	trans	-73.1	-35.7	177.8	-59	-58.3	174	145.5	6	113	E406 F407 K412 Q413 Y414 I421 F424	E406-R410 HydrophobicContact CG-CG 4.3Å; E406-R410 WeakPolarHBondContact O-CG 3.38Å; E406-R410 PolarHBondContact O-N 3.49Å; E406-R410 IonicContact OE1-CZ 3.48Å; E406-R410 IonicContact OE1-NE 2.66Å; E406-R410 PolarHBondContact OE1-NE 3.12Å; E406-R410 IonicContact OE1-NH2 2.69Å; E406-R410 PolarHBondContact OE1-NH2 2.92Å; F407-R410 PolarHBondContact O-N 3.43Å; R410-K412 PolarHBondContact O-N 2.73Å; R410-Q413 VanDerWaalsContact CD-OE1 3.25Å; R410-Q413 CarbonylContact O-C 3.55Å; R410-Q413 WeakPolarHBondContact O-CA 3.48Å; R410-Q413 WeakPolarHBondContact O-CB 3.35Å; R410-Q413 PolarHBondContact O-N 2.96Å; R410-Y414 PolarHBondContact O-N 3.07Å; R410-I421 HydrophobicContact CB-CB 4.47Å; R410-I421 HydrophobicContact CB-CG1 4.04Å; R410-I421 HydrophobicContact CB-CG2 4.2Å; R410-F424 HydrophobicContact CG-CB 3.9Å; R410-F424 HydrophobicContact CG-CD2 3.85Å; R410-F424 HydrophobicContact CG-CG 4.18Å; R410-F424 VanDerWaalsContact CZ-CD1 3.41Å; R410-F424 VanDerWaalsContact NH1-CZ 3.29Å
411	F	89.9	Confident	86.4	Confident	3 Å²	3	65.8 Å²	65.8	1%	0.013	32%	0.322	C	S	.	.	H	α-helix	trans	-63.3	-26.1	175	-168.9	-85.3	0	0	0	113.2	F407 Q413 K416 F418 I421 Y437 F446	F407-F411 HydrophobicContact CE1-CB 4.38Å; F407-F411 HydrophobicContact CE1-CD2 4.18Å; F407-F411 HydrophobicContact CZ-CD2 4.24Å; F407-F411 WeakPolarHBondContact O-CB 3.33Å; F407-F411 PolarHBondContact O-N 3.25Å; F411-Q413 VanDerWaalsContact C-N 3.33Å; F411-K416 HydrophobicContact CE2-CG 4.42Å; F411-K416 HydrophobicContact CZ-CG 4.43Å; F411-F418 HydrophobicContact CE2-CE1 4.46Å; F411-I421 HydrophobicContact CB-CD1 4.23Å; F411-I421 HydrophobicContact CD2-CD1 3.97Å; F411-Y437 AromaticContact CE2-CD2 3.73Å; F411-Y437 HydrophobicContact CE2-CD2 3.73Å; F411-Y437 AromaticContact CE2-CE2 3.67Å; F411-Y437 HydrophobicContact CE2-CE2 3.67Å; F411-Y437 HydrophobicContact CZ-CD2 4.11Å; F411-Y437 AromaticContact CZ-CE2 3.59Å; F411-Y437 HydrophobicContact CZ-CE2 3.59Å; F411-F446 AromaticContact CD1-CD1 3.6Å; F411-F446 HydrophobicContact CD1-CD1 3.6Å; F411-F446 HydrophobicContact CD1-CE1 4.25Å; F411-F446 HydrophobicContact CD2-CD1 4.38Å; F411-F446 HydrophobicContact CE1-CB 3.98Å; F411-F446 AromaticContact CE1-CD1 3.64Å; F411-F446 HydrophobicContact CE1-CD1 3.64Å; F411-F446 HydrophobicContact CE1-CG 4.24Å; F411-F446 HydrophobicContact CE2-CD1 4.41Å; F411-F446 AromaticContact CG-CD1 3.99Å; F411-F446 HydrophobicContact CG-CD1 3.99Å; F411-F446 HydrophobicContact CG-CE1 4.23Å; F411-F446 HydrophobicContact CZ-CB 4.27Å; F411-F446 HydrophobicContact CZ-CD1 4.07Å; F411-F446 HydrophobicContact CZ-CG 4.48Å
412	K	85	Confident	86.8	Confident	127 Å²	127	60.9 Å²	60.9	55%	0.552	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.9	-25	171	-66.9	158.7	-167.8	160.7	0	112.9	N408 K409 R410 L449	N408-K412 WeakPolarHBondContact O-CD 3.26Å; N408-K412 WeakPolarHBondContact O-CE 3.1Å; N408-K412 WeakPolarHBondContact O-CG 3.49Å; K409-K412 PolarHBondContact O-N 2.91Å; R410-K412 PolarHBondContact O-N 2.73Å; K412-L449 HydrophobicContact CD-CD2 4.49Å; K412-L449 HydrophobicContact CG-CD2 4.1Å; K412-L449 HydrophobicContact CG-CG 4.15Å
413	Q	83.5	Confident	87.1	Confident	115 Å²	115	57 Å²	57	54%	0.537	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.4	-57.9	176.6	-64.1	173.4	-22.3	0	0	110.6	R410 F411	R410-Q413 VanDerWaalsContact CD-OE1 3.25Å; R410-Q413 CarbonylContact O-C 3.55Å; R410-Q413 WeakPolarHBondContact O-CA 3.48Å; R410-Q413 WeakPolarHBondContact O-CB 3.35Å; R410-Q413 PolarHBondContact O-N 2.96Å; F411-Q413 VanDerWaalsContact C-N 3.33Å
414	Y	82.6	Confident	87	Confident	98 Å²	98	59.2 Å²	59.2	38%	0.384	30%	0.303	S	S	.	.	S	Bend	trans	-106.7	74.4	-173	-59.2	-79.4	0	0	0	111	R410 K416 S417 A420 F424	R410-Y414 PolarHBondContact O-N 3.07Å; Y414-K416 PolarHBondContact O-N 2.69Å; Y414-S417 PolarHBondContact O-N 2.82Å; Y414-A420 HydrophobicContact CD1-CB 4.11Å; Y414-A420 HydrophobicContact CG-CB 4.19Å; Y414-F424 HydrophobicContact CD2-CE2 4.31Å; Y414-F424 AromaticContact CE2-CE2 3.74Å; Y414-F424 HydrophobicContact CE2-CE2 3.74Å; Y414-F424 HydrophobicContact CE2-CZ 4.43Å
415	S	83	Confident	87.2	Confident	51 Å²	51	57.2 Å²	57.2	36%	0.357	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.5	105.9	-173	93.4	0	0	0	0	111.8
416	K	81.4	Confident	87.1	Confident	108 Å²	108	57.8 Å²	57.8	47%	0.47	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	72.4	10.7	-177.3	-52.4	-175.1	166.9	-161.3	0	117.8	F411 Y414 F418	F411-K416 HydrophobicContact CE2-CG 4.42Å; F411-K416 HydrophobicContact CZ-CG 4.43Å; Y414-K416 PolarHBondContact O-N 2.69Å; K416-F418 HydrophobicContact CB-CE2 4.21Å; K416-F418 HydrophobicContact CB-CZ 4.33Å; K416-F418 WeakPolarHBondContact O-CD2 3.43Å; K416-F418 PolarHBondContact O-N 2.7Å
417	S	87.4	Confident	86.8	Confident	56 Å²	56	63.8 Å²	63.8	39%	0.392	33%	0.332	S	S	.	.			trans	-87.8	83.8	168.3	-51.4	0	0	0	0	108.3	Y414 D419 A420 I421	Y414-S417 PolarHBondContact O-N 2.82Å; S417-D419 PolarHBondContact O-N 3.47Å; S417-A420 CarbonylContact O-C 3.49Å; S417-A420 PolarHBondContact O-N 3.36Å; S417-I421 WeakPolarHBondContact O-CG1 3.47Å; S417-I421 PolarHBondContact O-N 3.1Å
418	F	89.9	Confident	86.5	Confident	31 Å²	31	65.2 Å²	65.2	14%	0.136	34%	0.339	C	S	.	.	S	Bend	trans	-66.3	-28.1	-170.5	-62.1	-72.8	0	0	0	113.1	F407 F411 K416 I421 A422 C433 V434 Y437	F407-F418 HydrophobicContact CZ-CE1 4.49Å; F411-F418 HydrophobicContact CE2-CE1 4.46Å; K416-F418 HydrophobicContact CB-CE2 4.21Å; K416-F418 HydrophobicContact CB-CZ 4.33Å; K416-F418 WeakPolarHBondContact O-CD2 3.43Å; K416-F418 PolarHBondContact O-N 2.7Å; F418-I421 HydrophobicContact CD1-CD1 4.43Å; F418-I421 PolarHBondContact O-N 2.9Å; F418-I421 VanDerWaalsContact O-N 3.14Å; F418-A422 WeakPolarHBondContact O-CB 3.12Å; F418-A422 PolarHBondContact O-N 3.47Å; F418-C433 HydrophobicContact CB-CB 4.12Å; F418-C433 HydrophobicContact CD1-CB 4.14Å; F418-V434 HydrophobicContact CB-CG2 3.87Å; F418-V434 HydrophobicContact CD1-CG2 4.12Å; F418-V434 HydrophobicContact CD2-CG2 3.49Å; F418-V434 VanDerWaalsContact CD2-CG2 3.49Å; F418-V434 HydrophobicContact CE2-CG2 4.03Å; F418-V434 HydrophobicContact CG-CG2 3.54Å; F418-Y437 HydrophobicContact CE1-CD1 4.04Å; F418-Y437 HydrophobicContact CE1-CD2 4.35Å; F418-Y437 AromaticContact CE1-CG 3.74Å; F418-Y437 HydrophobicContact CE1-CG 3.74Å; F418-Y437 AromaticContact CZ-CD1 3.58Å; F418-Y437 HydrophobicContact CZ-CD1 3.58Å; F418-Y437 HydrophobicContact CZ-CD2 4.47Å; F418-Y437 HydrophobicContact CZ-CE1 4.11Å; F418-Y437 AromaticContact CZ-CG 3.78Å; F418-Y437 HydrophobicContact CZ-CG 3.78Å
419	D	89.6	Confident	86.5	Confident	116 Å²	116	66.5 Å²	66.5	62%	0.62	35%	0.35	S	S	*	.	H	α-helix	trans	-67	-44	176.7	-33.5	-82.1	0	0	0	110.2	S417 I421 A422 S423 A430	S417-D419 PolarHBondContact O-N 3.47Å; D419-I421 PolarHBondContact O-N 3.29Å; D419-A422 PolarHBondContact O-N 3.48Å; D419-S423 PolarHBondContact O-N 2.96Å; D419-S423 VanDerWaalsContact O-N 3.09Å; D419-A430 WeakPolarHBondContact OD1-CB 3.19Å
420	A	87.7	Confident	86.6	Confident	30 Å²	30	62.8 Å²	62.8	25%	0.248	34%	0.338	C	S	.	.	H	α-helix	trans	-78.3	8	172	0	0	0	0	0	114.2	Y414 S417 F424	Y414-A420 HydrophobicContact CD1-CB 4.11Å; Y414-A420 HydrophobicContact CG-CB 4.19Å; S417-A420 CarbonylContact O-C 3.49Å; S417-A420 PolarHBondContact O-N 3.36Å; A420-F424 VanDerWaalsContact O-CD2 3.25Å; A420-F424 WeakPolarHBondContact O-CD2 3.44Å; A420-F424 VanDerWaalsContact O-CE2 3.27Å; A420-F424 WeakPolarHBondContact O-CE2 3.35Å
421	I	89.6	Confident	86.6	Confident	0 Å²	0	63.3 Å²	63.3	0%	0	35%	0.349	C	S	.	.	H	α-helix	trans	-105.9	-42.9	165.7	-66.3	167.4	0	0	0	109	F407 R410 F411 S417 F418 D419 S423 F424 I425	F407-I421 HydrophobicContact CD2-CG2 3.54Å; F407-I421 HydrophobicContact CE2-CG2 3.84Å; F407-I421 HydrophobicContact CG-CG2 4.32Å; R410-I421 HydrophobicContact CB-CB 4.47Å; R410-I421 HydrophobicContact CB-CG1 4.04Å; R410-I421 HydrophobicContact CB-CG2 4.2Å; F411-I421 HydrophobicContact CB-CD1 4.23Å; F411-I421 HydrophobicContact CD2-CD1 3.97Å; S417-I421 WeakPolarHBondContact O-CG1 3.47Å; S417-I421 PolarHBondContact O-N 3.1Å; F418-I421 HydrophobicContact CD1-CD1 4.43Å; F418-I421 PolarHBondContact O-N 2.9Å; F418-I421 VanDerWaalsContact O-N 3.14Å; D419-I421 PolarHBondContact O-N 3.29Å; I421-S423 VanDerWaalsContact C-N 3.26Å; I421-S423 PolarHBondContact O-N 3.28Å; I421-F424 PolarHBondContact O-N 2.94Å; I421-I425 HydrophobicContact CG2-CD1 3.88Å
422	A	90.1	Very high	86.5	Confident	18 Å²	18	63.8 Å²	63.8	15%	0.149	35%	0.352	C	S	.	.	H	α-helix	trans	-56.9	-37.7	174.1	0	0	0	0	0	112.4	F418 D419 F424 I425 A430	F418-A422 WeakPolarHBondContact O-CB 3.12Å; F418-A422 PolarHBondContact O-N 3.47Å; D419-A422 PolarHBondContact O-N 3.48Å; A422-F424 PolarHBondContact O-N 3.33Å; A422-I425 PolarHBondContact O-N 2.69Å; A422-I425 VanDerWaalsContact O-N 3.07Å; A422-A430 HydrophobicContact CB-CB 4.4Å
423	S	89.5	Confident	86.6	Confident	79 Å²	79	57.8 Å²	57.8	55%	0.552	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.4	-4.1	174.5	67	0	0	0	0	115.6	D419 I421	D419-S423 PolarHBondContact O-N 2.96Å; D419-S423 VanDerWaalsContact O-N 3.09Å; I421-S423 VanDerWaalsContact C-N 3.26Å; I421-S423 PolarHBondContact O-N 3.28Å
424	F	86.2	Confident	86.9	Confident	73 Å²	73	54.9 Å²	54.9	32%	0.32	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	-125.9	7.1	178	-58	-61.7	0	0	0	113.5	R410 Y414 A420 I421 A422	R410-F424 HydrophobicContact CG-CB 3.9Å; R410-F424 HydrophobicContact CG-CD2 3.85Å; R410-F424 HydrophobicContact CG-CG 4.18Å; R410-F424 VanDerWaalsContact CZ-CD1 3.41Å; R410-F424 VanDerWaalsContact NH1-CZ 3.29Å; Y414-F424 HydrophobicContact CD2-CE2 4.31Å; Y414-F424 AromaticContact CE2-CE2 3.74Å; Y414-F424 HydrophobicContact CE2-CE2 3.74Å; Y414-F424 HydrophobicContact CE2-CZ 4.43Å; A420-F424 VanDerWaalsContact O-CD2 3.25Å; A420-F424 WeakPolarHBondContact O-CD2 3.44Å; A420-F424 VanDerWaalsContact O-CE2 3.27Å; A420-F424 WeakPolarHBondContact O-CE2 3.35Å; I421-F424 PolarHBondContact O-N 2.94Å; A422-F424 PolarHBondContact O-N 3.33Å
425	I	89.3	Confident	87	Confident	5 Å²	5	54.7 Å²	54.7	3%	0.026	32%	0.317	C	S	.	.	S	Bend	trans	-128.4	105.4	176.9	-49.9	173.7	0	0	0	107.3	F399 E403 F407 I421 A422 K428	F399-I425 HydrophobicContact CE1-CD1 4.31Å; E403-I425 HydrophobicContact CB-CG2 3.84Å; E403-I425 HydrophobicContact CG-CG2 3.93Å; F407-I425 HydrophobicContact CB-CD1 3.76Å; F407-I425 HydrophobicContact CD2-CD1 3.96Å; F407-I425 HydrophobicContact CG-CD1 4.38Å; I421-I425 HydrophobicContact CG2-CD1 3.88Å; A422-I425 PolarHBondContact O-N 2.69Å; A422-I425 VanDerWaalsContact O-N 3.07Å; I425-K428 HydrophobicContact CB-CB 4.22Å; I425-K428 HydrophobicContact CB-CG 4.27Å; I425-K428 HydrophobicContact CG2-CB 4.05Å; I425-K428 HydrophobicContact CG2-CG 3.54Å; I425-K428 PolarHBondContact O-N 3.48Å
426	P	83.7	Confident	87.2	Confident	94 Å²	94	53.1 Å²	53.1	61%	0.61	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.3	151.5	-179.1	26.1	-34.1	0	0	0	110.7	K428	P426-K428 PolarHBondContact O-N 3.21Å; P426-K428 VanDerWaalsContact O-N 3.11Å
427	N	80.2	Confident	87.6	Confident	160 Å²	160	49.9 Å²	49.9	86%	0.856	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.3	21.1	177.3	-50.6	-25.6	0	0	0	115
428	K	85.2	Confident	87.5	Confident	31 Å²	31	50.6 Å²	50.6	14%	0.135	29%	0.288	C	S	.	.			trans	-126.5	122.1	176.6	-62.7	-59.8	-179.6	-67.6	0	112.3	W398 F399 E403 I425 P426 D432	W398-K428 WeakPolarHBondContact O-CE 3.4Å; W398-K428 PolarHBondContact O-NZ 3.06Å; F399-K428 HydrophobicContact CD2-CD 4.4Å; F399-K428 HydrophobicContact CE1-CG 4.42Å; F399-K428 HydrophobicContact CE2-CD 3.89Å; F399-K428 HydrophobicContact CZ-CD 3.97Å; F399-K428 HydrophobicContact CZ-CG 4.14Å; E403-K428 WeakPolarHBondContact OE1-CE 3.5Å; E403-K428 IonicContact OE1-NZ 2.57Å; E403-K428 PolarHBondContact OE1-NZ 3.17Å; E403-K428 WeakPolarHBondContact OE2-CE 3.27Å; E403-K428 IonicContact OE2-NZ 2.59Å; E403-K428 PolarHBondContact OE2-NZ 3.06Å; I425-K428 HydrophobicContact CB-CB 4.22Å; I425-K428 HydrophobicContact CB-CG 4.27Å; I425-K428 HydrophobicContact CG2-CB 4.05Å; I425-K428 HydrophobicContact CG2-CG 3.54Å; I425-K428 PolarHBondContact O-N 3.48Å; P426-K428 PolarHBondContact O-N 3.21Å; P426-K428 VanDerWaalsContact O-N 3.11Å; K428-D432 HydrophobicContact CB-CB 4.5Å; K428-D432 HydrophobicContact CD-CB 4.2Å
429	S	88.1	Confident	87.1	Confident	51 Å²	51	54.1 Å²	54.1	36%	0.357	30%	0.303	S	S	.	.			trans	-75.5	163.5	172.5	74.4	0	0	0	0	111.7	S431 D432 C433	S429-S431 PolarHBondContact O-N 3.1Å; S429-S431 WeakPolarHBondContact OG-CB 3.48Å; S429-S431 PolarHBondContact OG-N 2.87Å; S429-S431 VanDerWaalsContact OG-N 3.17Å; S429-S431 PolarHBondContact OG-OG 3.45Å; S429-D432 VanDerWaalsContact CB-OD2 3.32Å; S429-D432 WeakPolarHBondContact CB-OD2 3.25Å; S429-D432 PolarHBondContact N-OD2 2.66Å; S429-D432 PolarHBondContact O-N 3.01Å; S429-D432 PolarHBondContact OG-N 3.32Å; S429-D432 PolarHBondContact OG-OD2 2.78Å; S429-C433 PolarHBondContact O-N 3.28Å; S429-C433 VanDerWaalsContact O-N 3.1Å
430	A	89.6	Confident	86.7	Confident	26 Å²	26	50.7 Å²	50.7	22%	0.215	29%	0.285	C	S	.	.	H	α-helix	trans	-55.3	-30.3	166.5	0	0	0	0	0	111.8	D419 A422 D432 C433 V434	D419-A430 WeakPolarHBondContact OD1-CB 3.19Å; A422-A430 HydrophobicContact CB-CB 4.4Å; A430-D432 VanDerWaalsContact C-N 3.33Å; A430-D432 PolarHBondContact O-N 2.82Å; A430-C433 PolarHBondContact O-N 3Å; A430-V434 WeakPolarHBondContact O-CB 3.43Å; A430-V434 VanDerWaalsContact O-CG2 3.28Å; A430-V434 WeakPolarHBondContact O-CG2 3.43Å; A430-V434 PolarHBondContact O-N 3.43Å
431	S	86.6	Confident	86.2	Confident	57 Å²	57	52.6 Å²	52.6	40%	0.399	29%	0.288	S	S	.	.	H	α-helix	trans	-65.4	-35.1	174.5	91	0	0	0	0	112.4	S429 V434 K435	S429-S431 PolarHBondContact O-N 3.1Å; S429-S431 WeakPolarHBondContact OG-CB 3.48Å; S429-S431 PolarHBondContact OG-N 2.87Å; S429-S431 VanDerWaalsContact OG-N 3.17Å; S429-S431 PolarHBondContact OG-OG 3.45Å; S431-V434 PolarHBondContact O-N 3.04Å; S431-K435 WeakPolarHBondContact O-CE 3.44Å; S431-K435 VanDerWaalsContact O-CG 3.23Å; S431-K435 WeakPolarHBondContact O-CG 3.5Å; S431-K435 PolarHBondContact O-N 2.93Å; S431-K435 WeakPolarHBondContact OG-CE 3.39Å; S431-K435 PolarHBondContact OG-NZ 2.76Å
432	D	87.6	Confident	85.4	Confident	14 Å²	14	60.2 Å²	60.2	8%	0.075	32%	0.323	C	S	.	.	H	α-helix	trans	-76.1	-37.7	179.1	-56.5	-57.9	0	0	0	111.3	F399 K428 S429 A430 V434 K435 Y436	F399-D432 HydrophobicContact CE2-CB 4.25Å; K428-D432 HydrophobicContact CB-CB 4.5Å; K428-D432 HydrophobicContact CD-CB 4.2Å; S429-D432 VanDerWaalsContact CB-OD2 3.32Å; S429-D432 WeakPolarHBondContact CB-OD2 3.25Å; S429-D432 PolarHBondContact N-OD2 2.66Å; S429-D432 PolarHBondContact O-N 3.01Å; S429-D432 PolarHBondContact OG-N 3.32Å; S429-D432 PolarHBondContact OG-OD2 2.78Å; A430-D432 VanDerWaalsContact C-N 3.33Å; A430-D432 PolarHBondContact O-N 2.82Å; D432-V434 VanDerWaalsContact C-N 3.29Å; D432-V434 PolarHBondContact O-N 3.4Å; D432-K435 PolarHBondContact O-N 3.1Å; D432-K435 IonicContact OD1-NZ 3.59Å; D432-K435 PolarHBondContact OD1-NZ 3.2Å; D432-Y436 WeakPolarHBondContact O-CB 3.48Å; D432-Y436 PolarHBondContact O-N 3.48Å
433	C	88.3	Confident	84.3	Confident	0 Å²	0	63.3 Å²	63.3	0%	0	35%	0.349	C	S	.	.	H	α-helix	trans	-58.4	-40.6	167.6	-70.2	0	0	0	0	112	F407 F418 S429 A430 Y437	F407-C433 HydrophobicContact CD2-CB 4.49Å; F407-C433 HydrophobicContact CE2-CB 3.87Å; F418-C433 HydrophobicContact CB-CB 4.12Å; F418-C433 HydrophobicContact CD1-CB 4.14Å; S429-C433 PolarHBondContact O-N 3.28Å; S429-C433 VanDerWaalsContact O-N 3.1Å; A430-C433 PolarHBondContact O-N 3Å; C433-Y437 WeakPolarHBondContact O-CB 3.43Å; C433-Y437 PolarHBondContact O-N 2.88Å
434	V	88.6	Confident	83.1	Confident	55 Å²	55	62 Å²	62	33%	0.333	33%	0.334	S	S	.	.	H	α-helix	trans	-69.9	-38	174.3	168.8	0	0	0	0	112.1	F418 A430 S431 D432 N438	F418-V434 HydrophobicContact CB-CG2 3.87Å; F418-V434 HydrophobicContact CD1-CG2 4.12Å; F418-V434 HydrophobicContact CD2-CG2 3.49Å; F418-V434 VanDerWaalsContact CD2-CG2 3.49Å; F418-V434 HydrophobicContact CE2-CG2 4.03Å; F418-V434 HydrophobicContact CG-CG2 3.54Å; A430-V434 WeakPolarHBondContact O-CB 3.43Å; A430-V434 VanDerWaalsContact O-CG2 3.28Å; A430-V434 WeakPolarHBondContact O-CG2 3.43Å; A430-V434 PolarHBondContact O-N 3.43Å; S431-V434 PolarHBondContact O-N 3.04Å; D432-V434 VanDerWaalsContact C-N 3.29Å; D432-V434 PolarHBondContact O-N 3.4Å; V434-N438 WeakPolarHBondContact CG1-ND2 3.16Å; V434-N438 VanDerWaalsContact O-CB 3.31Å; V434-N438 WeakPolarHBondContact O-CB 3.37Å; V434-N438 PolarHBondContact O-N 3.35Å; V434-N438 PolarHBondContact O-ND2 3.31Å
435	K	86.6	Confident	82.2	Confident	94 Å²	94	63.8 Å²	63.8	41%	0.409	35%	0.347	S	S	.	.	H	α-helix	trans	-61.1	-57.4	172.8	-71	161.9	-144.1	164.4	0	109.7	S431 D432 Y437 N438 F439	S431-K435 WeakPolarHBondContact O-CE 3.44Å; S431-K435 VanDerWaalsContact O-CG 3.23Å; S431-K435 WeakPolarHBondContact O-CG 3.5Å; S431-K435 PolarHBondContact O-N 2.93Å; S431-K435 WeakPolarHBondContact OG-CE 3.39Å; S431-K435 PolarHBondContact OG-NZ 2.76Å; D432-K435 PolarHBondContact O-N 3.1Å; D432-K435 IonicContact OD1-NZ 3.59Å; D432-K435 PolarHBondContact OD1-NZ 3.2Å; K435-Y437 VanDerWaalsContact C-N 3.34Å; K435-Y437 PolarHBondContact O-N 2.9Å; K435-N438 WeakPolarHBondContact O-CA 3.27Å; K435-N438 PolarHBondContact O-N 2.9Å; K435-F439 HydrophobicContact CB-CE2 4.32Å; K435-F439 WeakPolarHBondContact O-CD2 3.32Å; K435-F439 PolarHBondContact O-N 2.94Å
436	Y	86.7	Confident	81.2	Confident	18 Å²	18	63.9 Å²	63.9	7%	0.071	35%	0.347	C	S	.	.	H	α-helix	trans	-51.4	-50.7	179.5	-173.3	-86.7	0	0	0	111.7	F399 K404 F407 D432 N438 F439 N440 E444 F446	F399-Y436 HydrophobicContact CB-CD2 4.01Å; F399-Y436 HydrophobicContact CB-CE2 3.96Å; F399-Y436 AromaticContact CD1-CD2 3.72Å; F399-Y436 HydrophobicContact CD1-CD2 3.72Å; F399-Y436 HydrophobicContact CD1-CE2 4.03Å; F399-Y436 HydrophobicContact CD1-CG 4.28Å; F399-Y436 AromaticContact CD2-CD2 3.63Å; F399-Y436 HydrophobicContact CD2-CD2 3.63Å; F399-Y436 HydrophobicContact CD2-CE2 4.44Å; F399-Y436 HydrophobicContact CD2-CG 4.34Å; F399-Y436 HydrophobicContact CE1-CD2 4.05Å; F399-Y436 HydrophobicContact CE1-CG 4.15Å; F399-Y436 AromaticContact CE2-CD2 3.97Å; F399-Y436 HydrophobicContact CE2-CD2 3.97Å; F399-Y436 HydrophobicContact CE2-CG 4.22Å; F399-Y436 AromaticContact CG-CD2 3.5Å; F399-Y436 HydrophobicContact CG-CD2 3.5Å; F399-Y436 AromaticContact CG-CE2 3.9Å; F399-Y436 HydrophobicContact CG-CE2 3.9Å; F399-Y436 HydrophobicContact CG-CG 4.37Å; F399-Y436 HydrophobicContact CZ-CD2 4.17Å; F399-Y436 HydrophobicContact CZ-CG 4.13Å; K404-Y436 HydrophobicContact CD-CE2 4.21Å; K404-Y436 HydrophobicContact CG-CE2 3.75Å; K404-Y436 WeakPolarHBondContact CG-OH 3.45Å; F407-Y436 AromaticContact CD1-CD1 3.66Å; F407-Y436 HydrophobicContact CD1-CD1 3.66Å; F407-Y436 AromaticContact CD1-CE1 3.7Å; F407-Y436 HydrophobicContact CD1-CE1 3.7Å; F407-Y436 HydrophobicContact CD2-CD1 4.31Å; F407-Y436 AromaticContact CE1-CD1 3.65Å; F407-Y436 HydrophobicContact CE1-CD1 3.65Å; F407-Y436 HydrophobicContact CE1-CE1 4Å; F407-Y436 HydrophobicContact CE2-CD1 4.29Å; F407-Y436 HydrophobicContact CG-CD1 4.03Å; F407-Y436 HydrophobicContact CG-CE1 4.25Å; F407-Y436 AromaticContact CZ-CD1 3.99Å; F407-Y436 HydrophobicContact CZ-CD1 3.99Å; D432-Y436 WeakPolarHBondContact O-CB 3.48Å; D432-Y436 PolarHBondContact O-N 3.48Å; Y436-N438 VanDerWaalsContact C-N 3.33Å; Y436-N438 PolarHBondContact O-N 2.96Å; Y436-F439 PolarHBondContact O-N 3.44Å; Y436-N440 HydrophobicContact CE1-CB 4.22Å; Y436-N440 WeakPolarHBondContact CE1-ND2 3.18Å; Y436-N440 WeakPolarHBondContact CE2-ND2 3.28Å; Y436-N440 WeakPolarHBondContact O-CB 3.39Å; Y436-N440 PolarHBondContact O-N 2.82Å; Y436-N440 PolarHBondContact OH-ND2 2.79Å; Y436-E444 WeakPolarHBondContact CE1-OE1 3.25Å; Y436-E444 PolarHBondContact OH-OE1 3.04Å; Y436-F446 HydrophobicContact CE1-CZ 4.13Å
437	Y	88.7	Confident	80.4	Confident	39 Å²	39	66.9 Å²	66.9	15%	0.153	35%	0.35	C	S	.	.	H	α-helix	trans	-58.1	-42.6	174.6	179.8	-108.7	0	0	0	112.7	F411 F418 C433 K435 F439 N440 K441 F446	F411-Y437 AromaticContact CE2-CD2 3.73Å; F411-Y437 HydrophobicContact CE2-CD2 3.73Å; F411-Y437 AromaticContact CE2-CE2 3.67Å; F411-Y437 HydrophobicContact CE2-CE2 3.67Å; F411-Y437 HydrophobicContact CZ-CD2 4.11Å; F411-Y437 AromaticContact CZ-CE2 3.59Å; F411-Y437 HydrophobicContact CZ-CE2 3.59Å; F418-Y437 HydrophobicContact CE1-CD1 4.04Å; F418-Y437 HydrophobicContact CE1-CD2 4.35Å; F418-Y437 AromaticContact CE1-CG 3.74Å; F418-Y437 HydrophobicContact CE1-CG 3.74Å; F418-Y437 AromaticContact CZ-CD1 3.58Å; F418-Y437 HydrophobicContact CZ-CD1 3.58Å; F418-Y437 HydrophobicContact CZ-CD2 4.47Å; F418-Y437 HydrophobicContact CZ-CE1 4.11Å; F418-Y437 AromaticContact CZ-CG 3.78Å; F418-Y437 HydrophobicContact CZ-CG 3.78Å; C433-Y437 WeakPolarHBondContact O-CB 3.43Å; C433-Y437 PolarHBondContact O-N 2.88Å; K435-Y437 VanDerWaalsContact C-N 3.34Å; K435-Y437 PolarHBondContact O-N 2.9Å; Y437-F439 PolarHBondContact O-N 3.44Å; Y437-N440 PolarHBondContact O-N 3.34Å; Y437-K441 HydrophobicContact CD2-CB 4.44Å; Y437-K441 HydrophobicContact CE2-CB 4.13Å; Y437-K441 WeakPolarHBondContact O-CB 3.34Å; Y437-K441 WeakPolarHBondContact O-CG 3.24Å; Y437-K441 PolarHBondContact O-N 3.44Å; Y437-F446 HydrophobicContact CD2-CD2 4.5Å; Y437-F446 HydrophobicContact CD2-CG 4.43Å; Y437-F446 HydrophobicContact CE2-CB 4.23Å; Y437-F446 HydrophobicContact CE2-CG 4.24Å
438	N	86.3	Confident	79.6	Confident	72 Å²	72	62 Å²	62	39%	0.385	33%	0.332	S	S	.	.	H	α-helix	trans	-69.9	-29.7	-177.6	-86.4	-63.3	0	0	0	114.4	V434 K435 Y436 K441	V434-N438 WeakPolarHBondContact CG1-ND2 3.16Å; V434-N438 VanDerWaalsContact O-CB 3.31Å; V434-N438 WeakPolarHBondContact O-CB 3.37Å; V434-N438 PolarHBondContact O-N 3.35Å; V434-N438 PolarHBondContact O-ND2 3.31Å; K435-N438 WeakPolarHBondContact O-CA 3.27Å; K435-N438 PolarHBondContact O-N 2.9Å; Y436-N438 VanDerWaalsContact C-N 3.33Å; Y436-N438 PolarHBondContact O-N 2.96Å; N438-K441 WeakPolarHBondContact O-CE 3.42Å; N438-K441 PolarHBondContact O-NZ 2.96Å; N438-K441 PolarHBondContact OD1-NZ 3.43Å
439	F	81.4	Confident	78.5	Confident	105 Å²	105	63.3 Å²	63.3	46%	0.461	34%	0.341	S	S	.	.	H	α-helix	trans	-76.4	-49.9	170.3	-68	-72.6	0	0	0	110.9	T395 K435 Y436 Y437	T395-F439 HydrophobicContact CG2-CD1 4.43Å; T395-F439 HydrophobicContact CG2-CD2 3.63Å; T395-F439 HydrophobicContact CG2-CE1 4.29Å; T395-F439 HydrophobicContact CG2-CE2 3.48Å; T395-F439 VanDerWaalsContact CG2-CE2 3.48Å; T395-F439 HydrophobicContact CG2-CG 4.15Å; T395-F439 HydrophobicContact CG2-CZ 3.83Å; K435-F439 HydrophobicContact CB-CE2 4.32Å; K435-F439 WeakPolarHBondContact O-CD2 3.32Å; K435-F439 PolarHBondContact O-N 2.94Å; Y436-F439 PolarHBondContact O-N 3.44Å; Y437-F439 PolarHBondContact O-N 3.44Å
440	N	80.4	Confident	77.1	Confident	44 Å²	44	68 Å²	68	24%	0.235	35%	0.35	C	S	.	.	H	α-helix	trans	-89.6	-8.4	-167.4	-64	-32.3	0	0	0	115.9	Y436 Y437 H442 A443 E444 F446	Y436-N440 HydrophobicContact CE1-CB 4.22Å; Y436-N440 WeakPolarHBondContact CE1-ND2 3.18Å; Y436-N440 WeakPolarHBondContact CE2-ND2 3.28Å; Y436-N440 WeakPolarHBondContact O-CB 3.39Å; Y436-N440 PolarHBondContact O-N 2.82Å; Y436-N440 PolarHBondContact OH-ND2 2.79Å; Y437-N440 PolarHBondContact O-N 3.34Å; N440-H442 PolarHBondContact O-N 3.16Å; N440-A443 PolarHBondContact O-N 2.92Å; N440-E444 HydrophobicContact CB-CG 4.4Å; N440-E444 WeakPolarHBondContact CB-OE1 3.39Å; N440-E444 PolarHBondContact O-N 2.92Å; N440-F446 HydrophobicContact CB-CE2 3.9Å
441	K	78.5	Confident	75.5	Confident	70 Å²	70	70.7 Å²	70.7	30%	0.304	36%	0.362	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54	-6.5	174.1	65.5	-173.7	177.8	-155.1	0	116.8	Y437 N438	Y437-K441 HydrophobicContact CD2-CB 4.44Å; Y437-K441 HydrophobicContact CE2-CB 4.13Å; Y437-K441 WeakPolarHBondContact O-CB 3.34Å; Y437-K441 WeakPolarHBondContact O-CG 3.24Å; Y437-K441 PolarHBondContact O-N 3.44Å; N438-K441 WeakPolarHBondContact O-CE 3.42Å; N438-K441 PolarHBondContact O-NZ 2.96Å; N438-K441 PolarHBondContact OD1-NZ 3.43Å
442	H	71.6	Confident	73.8	Confident	159 Å²	159	79.2 Å²	79.2	74%	0.736	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-122.8	-10.7	178.4	-64.7	-56.1	0	0	0	113.9	N440	N440-H442 PolarHBondContact O-N 3.16Å
443	A	66.9	Low	72.1	Confident	84 Å²	84	88.8 Å²	88.8	69%	0.694	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.9	-47.3	178	0	0	0	0	0	110.6	N440	N440-A443 PolarHBondContact O-N 2.92Å
444	E	65	Low	70.2	Confident	50 Å²	50	96.9 Å²	96.9	23%	0.234	46%	0.461	C	S	.	.	S	Bend	trans	-93.1	136.9	169.8	-58.7	171.8	-119.8	0	0	109.3	N408 Y436 N440 F446	N408-E444 PolarHBondContact ND2-OE2 2.97Å; N408-E444 PolarHBondContact OD1-OE2 3.15Å; Y436-E444 WeakPolarHBondContact CE1-OE1 3.25Å; Y436-E444 PolarHBondContact OH-OE1 3.04Å; N440-E444 HydrophobicContact CB-CG 4.4Å; N440-E444 WeakPolarHBondContact CB-OE1 3.39Å; N440-E444 PolarHBondContact O-N 2.92Å; E444-F446 HydrophobicContact CB-CD2 3.81Å; E444-F446 HydrophobicContact CB-CE2 3.52Å; E444-F446 HydrophobicContact CB-CZ 4.09Å; E444-F446 HydrophobicContact CG-CE2 4.19Å; E444-F446 WeakPolarHBondContact O-CD2 3.46Å; E444-F446 PolarHBondContact O-N 3.4Å; E444-F446 WeakPolarHBondContact OE2-CZ 3.25Å
445	D	67.9	Low	68	Low	112 Å²	112	99.5 Å²	99.5	60%	0.599	48%	0.477	S	S	*	.			trans	-82.6	63.4	-174.9	-135.9	-27.8	0	0	0	111.8	K447 A448 L449	D445-K447 PolarHBondContact O-N 2.92Å; D445-A448 HydrophobicContact CB-CB 4.08Å; D445-A448 WeakPolarHBondContact O-CA 3.4Å; D445-A448 WeakPolarHBondContact O-CB 3.36Å; D445-A448 PolarHBondContact O-N 2.87Å; D445-L449 PolarHBondContact O-N 3.16Å; D445-L449 VanDerWaalsContact O-N 3.07Å
446	F	68.2	Low	65.7	Low	7 Å²	7	99.7 Å²	99.7	3%	0.031	50%	0.497	C	S	.	.	H	α-helix	trans	-54.9	-18.2	177.4	-73.9	-76.1	0	0	0	113.4	F407 N408 F411 Y436 Y437 N440 E444 L449 R450	F407-F446 HydrophobicContact CD1-CE1 4.12Å; F407-F446 HydrophobicContact CD1-CZ 4.23Å; F407-F446 AromaticContact CE1-CE1 3.66Å; F407-F446 HydrophobicContact CE1-CE1 3.66Å; F407-F446 AromaticContact CE1-CZ 3.8Å; F407-F446 HydrophobicContact CE1-CZ 3.8Å; N408-F446 WeakPolarHBondContact OD1-CE1 3.44Å; F411-F446 AromaticContact CD1-CD1 3.6Å; F411-F446 HydrophobicContact CD1-CD1 3.6Å; F411-F446 HydrophobicContact CD1-CE1 4.25Å; F411-F446 HydrophobicContact CD2-CD1 4.38Å; F411-F446 HydrophobicContact CE1-CB 3.98Å; F411-F446 AromaticContact CE1-CD1 3.64Å; F411-F446 HydrophobicContact CE1-CD1 3.64Å; F411-F446 HydrophobicContact CE1-CG 4.24Å; F411-F446 HydrophobicContact CE2-CD1 4.41Å; F411-F446 AromaticContact CG-CD1 3.99Å; F411-F446 HydrophobicContact CG-CD1 3.99Å; F411-F446 HydrophobicContact CG-CE1 4.23Å; F411-F446 HydrophobicContact CZ-CB 4.27Å; F411-F446 HydrophobicContact CZ-CD1 4.07Å; F411-F446 HydrophobicContact CZ-CG 4.48Å; Y436-F446 HydrophobicContact CE1-CZ 4.13Å; Y437-F446 HydrophobicContact CD2-CD2 4.5Å; Y437-F446 HydrophobicContact CD2-CG 4.43Å; Y437-F446 HydrophobicContact CE2-CB 4.23Å; Y437-F446 HydrophobicContact CE2-CG 4.24Å; N440-F446 HydrophobicContact CB-CE2 3.9Å; E444-F446 HydrophobicContact CB-CD2 3.81Å; E444-F446 HydrophobicContact CB-CE2 3.52Å; E444-F446 HydrophobicContact CB-CZ 4.09Å; E444-F446 HydrophobicContact CG-CE2 4.19Å; E444-F446 WeakPolarHBondContact O-CD2 3.46Å; E444-F446 PolarHBondContact O-N 3.4Å; E444-F446 WeakPolarHBondContact OE2-CZ 3.25Å; F446-L449 HydrophobicContact CD1-CD2 4.42Å; F446-R450 WeakPolarHBondContact O-CB 3.24Å; F446-R450 PolarHBondContact O-N 3.42Å
447	K	65.8	Low	63.5	Low	156 Å²	156	110 Å²	110	68%	0.678	54%	0.537	S	S	*	.	H	α-helix	trans	-76.1	-33.5	171.1	-68.9	178	-176.1	168.7	0	113	D445 N451	D445-K447 PolarHBondContact O-N 2.92Å; K447-N451 PolarHBondContact O-ND2 3.47Å
448	A	64.1	Low	61.2	Low	58 Å²	58	112.9 Å²	112.9	48%	0.479	56%	0.563	S	S	.	*	H	α-helix	trans	-75.1	-45	173.4	0	0	0	0	0	110.9	D445 R450 N451	D445-A448 HydrophobicContact CB-CB 4.08Å; D445-A448 WeakPolarHBondContact O-CA 3.4Å; D445-A448 WeakPolarHBondContact O-CB 3.36Å; D445-A448 PolarHBondContact O-N 2.87Å; A448-R450 PolarHBondContact O-N 3.24Å; A448-R450 VanDerWaalsContact O-N 3.14Å; A448-N451 PolarHBondContact O-N 3.02Å
449	L	62.3	Low	59	Low	59 Å²	59	118.5 Å²	118.5	31%	0.309	58%	0.584	S	S	.	*	H	α-helix	trans	-51.1	-38.4	174.2	-105.5	68.7	0	0	0	112.5	N408 K412 D445 F446 N451	N408-L449 HydrophobicContact CB-CD2 4.45Å; N408-L449 WeakPolarHBondContact OD1-CD2 3.4Å; K412-L449 HydrophobicContact CD-CD2 4.49Å; K412-L449 HydrophobicContact CG-CD2 4.1Å; K412-L449 HydrophobicContact CG-CG 4.15Å; D445-L449 PolarHBondContact O-N 3.16Å; D445-L449 VanDerWaalsContact O-N 3.07Å; F446-L449 HydrophobicContact CD1-CD2 4.42Å; L449-N451 PolarHBondContact O-N 3.03Å
450	R	58.4	Low	56.9	Low	148 Å²	148	121.7 Å²	121.7	56%	0.558	60%	0.6	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.4	-13.4	-178.9	-164	172.4	-171.6	-138.6	-1.7	115.2	F446 A448	F446-R450 WeakPolarHBondContact O-CB 3.24Å; F446-R450 PolarHBondContact O-N 3.42Å; A448-R450 PolarHBondContact O-N 3.24Å; A448-R450 VanDerWaalsContact O-N 3.14Å
451	N	54.6	Low	54.5	Low	84 Å²	84	124.9 Å²	124.9	45%	0.449	63%	0.625	S	S	.	*	T	Hydrogen-bonded Turn	trans	-127.2	0.8	-160.1	-76.3	-58.9	0	0	0	117.6	K447 A448 L449 K453 K454	K447-N451 PolarHBondContact O-ND2 3.47Å; A448-N451 PolarHBondContact O-N 3.02Å; L449-N451 PolarHBondContact O-N 3.03Å; N451-K453 PolarHBondContact O-N 2.98Å; N451-K454 PolarHBondContact O-N 2.92Å; N451-K454 VanDerWaalsContact O-N 3.15Å
452	R	51.6	Low	52.4	Low	236 Å²	236	133.4 Å²	133.4	89%	0.891	66%	0.656	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.7	-5.8	-176.1	-129.5	178.9	-168.9	179.4	3.8	115.6
453	K	52	Low	50.7	Low	214 Å²	214	130 Å²	130	93%	0.93	65%	0.647	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.5	10	172.6	-70.4	-168	175.6	-174.3	0	115.1	N451	N451-K453 PolarHBondContact O-N 2.98Å
454	K	49.2	Very low	48.9	Very low	170 Å²	170	130.9 Å²	130.9	74%	0.739	66%	0.655	S	S	*	*	S	Bend	trans	-127.5	9	-176.2	-74.4	-164.4	172.3	-171.2	0	117.1	N451	N451-K454 PolarHBondContact O-N 2.92Å; N451-K454 VanDerWaalsContact O-N 3.15Å
455	T	41.4	Very low	47.5	Very low	110 Å²	110	136.8 Å²	136.8	68%	0.675	68%	0.68	S	S	*	*	S	Bend	trans	-109.4	-6.3	-172.6	46	0	0	0	0	116.3
456	A	38.2	Very low	46.2	Very low	99 Å²	99	135.5 Å²	135.5	82%	0.818	68%	0.678	S	S	*	*	S	Bend	trans	-82.4	-19.3	-177.8	0	0	0	0	0	115
457	Y	41.8	Very low	44.8	Very low	235 Å²	235	140.2 Å²	140.2	92%	0.922	71%	0.712	S	S	*	*	S	Bend	trans	-123.5	17	-166.8	-107.8	-85.1	0	0	0	114.6
458	S	39.2	Very low	44.1	Very low	98 Å²	98	138.7 Å²	138.7	69%	0.685	71%	0.711	S	S	*	*	S	Bend	trans	-132.6	17.7	-164.8	-170	0	0	0	0	115.6
459	K	40.9	Very low	43.2	Very low	191 Å²	191	141.5 Å²	141.5	83%	0.83	72%	0.717	S	S	*	*	S	Bend	trans	-133.5	-9.3	-178.9	-82.6	-166.3	171.9	-172.3	0	116.8
460	H	35.8	Very low	42.3	Very low	172 Å²	172	145 Å²	145	80%	0.796	74%	0.735	S	S	*	*	S	Bend	trans	-127.7	152.4	175.3	-62.8	-28.5	0	0	0	110
461	S	30.5	Very low	41.7	Very low	111 Å²	111	143 Å²	143	78%	0.776	74%	0.743	S	S	*	*			trans	57.6	70.8	170.3	-55.8	0	0	0	0	117.7
462	R	34.7	Very low	41.2	Very low	248 Å²	248	148.2 Å²	148.2	94%	0.936	76%	0.762	S	S	*	*			trans	-124.9	97.8	131.6	-79	-162.3	174.8	-131.5	-4.4	109.3
463	P	36	Very low	40.9	Very low	87 Å²	87	144.6 Å²	144.6	57%	0.565	76%	0.757	S	S	*	*			trans	-58.6	152.8	171.1	-22.3	33.7	0	0	0	111.4	F465	P463-F465 HydrophobicContact CB-CD2 4.28Å; P463-F465 HydrophobicContact CB-CE2 4.11Å; P463-F465 HydrophobicContact CG-CE2 4.15Å; P463-F465 PolarHBondContact O-N 3.4Å
464	A	30	Very low	40.3	Very low	104 Å²	104	142.6 Å²	142.6	86%	0.86	75%	0.749	S	S	*	*			trans	-73.3	90.7	166.9	0	0	0	0	0	109.1	P466	A464-P466 WeakPolarHBondContact O-CD 3.18Å
465	F	33.9	Very low	40	Very low	173 Å²	173	143 Å²	143	76%	0.759	75%	0.753	S	S	*	*			trans	-70.3	119.1	171.6	-82.9	-86.2	0	0	0	109.7	P463	P463-F465 HydrophobicContact CB-CD2 4.28Å; P463-F465 HydrophobicContact CB-CE2 4.11Å; P463-F465 HydrophobicContact CG-CE2 4.15Å; P463-F465 PolarHBondContact O-N 3.4Å
466	P	40.6	Very low	40	Very low	86 Å²	86	144 Å²	144	56%	0.558	76%	0.76	S	S	*	*			trans	-69.4	146.5	178.7	28.8	-34.1	0	0	0	110.9	A464 N468	A464-P466 WeakPolarHBondContact O-CD 3.18Å; P466-N468 PolarHBondContact O-N 3.42Å
467	S	40.4	Very low	40.2	Very low	106 Å²	106	144.2 Å²	144.2	74%	0.741	76%	0.755	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.3	8.7	-172	42.6	0	0	0	0	116.6
468	N	51.3	Low	40.1	Very low	123 Å²	123	139.9 Å²	139.9	66%	0.658	75%	0.753	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110.1	1.7	-151	-59.3	6.2	0	0	0	114.5	P466	P466-N468 PolarHBondContact O-N 3.42Å
469	I	44.8	Very low	40.1	Very low	117 Å²	117	141.9 Å²	141.9	60%	0.6	76%	0.761	S	S	*	*	S	Bend	trans	-101.3	-30.8	-173.4	-63.9	176.6	0	0	0	112.7	S471 K472	I469-S471 VanDerWaalsContact C-N 3.27Å; I469-S471 PolarHBondContact O-N 3.13Å; I469-K472 PolarHBondContact O-N 3.48Å
470	I	42.3	Very low	39.9	Very low	133 Å²	133	137.4 Å²	137.4	68%	0.682	76%	0.76	S	S	*	*	G	3₁₀ helix	trans	-66.4	-27.8	-172.4	-63.4	176.1	0	0	0	112.5	K472 M473	I470-K472 PolarHBondContact O-N 2.9Å; I470-K472 VanDerWaalsContact O-N 3.11Å; I470-M473 PolarHBondContact O-N 2.75Å
471	S	47	Very low	39.8	Very low	106 Å²	106	134.7 Å²	134.7	74%	0.741	76%	0.76	S	S	*	*	G	3₁₀ helix	trans	-66.9	-7.1	178.4	-56.6	0	0	0	0	115.4	I469	I469-S471 VanDerWaalsContact C-N 3.27Å; I469-S471 PolarHBondContact O-N 3.13Å
472	K	44.7	Very low	40.3	Very low	193 Å²	193	135.2 Å²	135.2	84%	0.839	76%	0.761	S	S	*	*	G	3₁₀ helix	trans	-105.2	-1.2	178.8	-77.1	-165.8	172.9	-170.3	0	115.4	I469 I470	I469-K472 PolarHBondContact O-N 3.48Å; I470-K472 PolarHBondContact O-N 2.9Å; I470-K472 VanDerWaalsContact O-N 3.11Å
473	M	44.4	Very low	40.6	Very low	160 Å²	160	129.4 Å²	129.4	79%	0.788	75%	0.753	S	S	*	*	S	Bend	trans	-119.9	5.6	-173.5	-83.5	-178.5	160.6	0	0	115.7	I470	I470-M473 PolarHBondContact O-N 2.75Å
474	F	40.2	Very low	40.9	Very low	172 Å²	172	129.7 Å²	129.7	75%	0.754	76%	0.757	S	S	*	*	S	Bend	trans	-109.6	9.7	176.5	-98.4	-87	0	0	0	114.7
475	Q	42.1	Very low	40.9	Very low	178 Å²	178	126.7 Å²	126.7	83%	0.832	74%	0.736	S	S	*	*	S	Bend	trans	-100.6	46.4	173.1	-75.1	-172.4	-28.4	0	0	113
476	T	42.2	Very low	41.2	Very low	132 Å²	132	124 Å²	124	81%	0.81	73%	0.734	S	S	*	*			trans	-165.3	90.5	157.3	42.9	0	0	0	0	109.7
477	S	42.2	Very low	40.8	Very low	103 Å²	103	128.6 Å²	128.6	72%	0.72	74%	0.74	S	S	*	*			trans	-89.4	126.8	170.1	-66.7	0	0	0	0	110.9
478	T	39.2	Very low	40.9	Very low	145 Å²	145	130.8 Å²	130.8	89%	0.89	74%	0.743	S	S	*	*			trans	-155.9	148.5	151.3	-1.5	0	0	0	0	109.3
479	V	38.8	Very low	40	Very low	140 Å²	140	134.1 Å²	134.1	85%	0.848	75%	0.752	S	S	*	*			trans	-107.1	131	-159.2	-179.4	0	0	0	0	112.2
480	A	37.3	Very low	39.7	Very low	97 Å²	97	132.8 Å²	132.8	80%	0.802	75%	0.753	S	S	*	*			trans	-153.4	123.5	155.6	0	0	0	0	0	109.9
481	S	33.7	Very low	39.4	Very low	115 Å²	115	132.6 Å²	132.6	80%	0.804	76%	0.763	S	S	*	*			trans	-105.6	146.2	166.4	-63.3	0	0	0	0	109.2
482	P	40.5	Very low	38.9	Very low	121 Å²	121	132.1 Å²	132.1	79%	0.786	76%	0.759	S	S	*	*			trans	-114.3	135.9	150.7	34.1	-27.4	0	0	0	112.1
483	T	40.1	Very low	38.5	Very low	126 Å²	126	130 Å²	130	77%	0.773	76%	0.757	S	S	*	*			trans	-59.7	127.8	176.8	-43.2	0	0	0	0	112.9	F908	T483-F908 HydrophobicContact CG2-CD1 4.31Å; T483-F908 HydrophobicContact CG2-CG 4.5Å
484	S	43	Very low	38.2	Very low	94 Å²	94	129.3 Å²	129.3	66%	0.657	76%	0.755	S	S	*	*			trans	168.7	-170.9	151.9	53.7	0	0	0	0	109.7	F908	S484-F908 VanDerWaalsContact CA-CE2 3.43Å; S484-F908 WeakPolarHBondContact O-CZ 3.31Å
485	G	30.4	Very low	38.1	Very low	41 Å²	41	128.4 Å²	128.4	42%	0.423	75%	0.754	S	S	.	*			trans	113.6	-140.7	-177	0	0	0	0	0	116.2	F908	G485-F908 WeakPolarHBondContact O-CE2 3.33Å
486	V	39.6	Very low	38	Very low	117 Å²	117	126.9 Å²	126.9	71%	0.709	75%	0.751	S	S	*	*			trans	-144.6	130.6	-157.2	-178	0	0	0	0	113	L488	V486-L488 PolarHBondContact O-N 2.9Å; V486-L488 VanDerWaalsContact O-N 3.1Å
487	W	33.6	Very low	37.9	Very low	182 Å²	182	126 Å²	126	69%	0.689	75%	0.748	S	S	*	*			trans	-77.8	83.9	172.7	-84.3	91.2	0	0	0	112.6	K489	W487-K489 PolarHBondContact O-N 2.9Å
488	L	40.6	Very low	37.6	Very low	151 Å²	151	132.1 Å²	132.1	79%	0.791	76%	0.755	S	S	*	*			trans	-75.4	90.2	167.9	-84.6	167.4	0	0	0	111.1	V486 S490	V486-L488 PolarHBondContact O-N 2.9Å; V486-L488 VanDerWaalsContact O-N 3.1Å; L488-S490 PolarHBondContact O-N 3.45Å
489	K	32.8	Very low	37.6	Very low	194 Å²	194	131.1 Å²	131.1	84%	0.843	75%	0.751	S	S	*	*			trans	-58.7	100.5	171.2	-74.2	-179.8	177.7	175.1	0	110.2	W487	W487-K489 PolarHBondContact O-N 2.9Å
490	S	39.8	Very low	37.8	Very low	89 Å²	89	134.6 Å²	134.6	62%	0.622	75%	0.751	S	S	*	*			trans	-155.5	101	176.2	-82.3	0	0	0	0	110.6	L488 S492	L488-S490 PolarHBondContact O-N 3.45Å; S490-S492 PolarHBondContact O-N 3.39Å
491	S	34.3	Very low	37.8	Very low	128 Å²	128	137.2 Å²	137.2	90%	0.895	75%	0.746	S	S	*	*			trans	-73.4	39.2	-179.5	-48	0	0	0	0	113.9	L493	S491-L493 PolarHBondContact O-N 2.89Å
492	S	36.6	Very low	38.3	Very low	96 Å²	96	138.5 Å²	138.5	67%	0.671	74%	0.744	S	S	*	*			trans	-90.8	81.1	167	-62.7	0	0	0	0	107.9	S490 I494	S490-S492 PolarHBondContact O-N 3.39Å; S492-I494 VanDerWaalsContact C-N 3.31Å; S492-I494 PolarHBondContact O-N 2.93Å
493	L	37	Very low	38.9	Very low	149 Å²	149	138.2 Å²	138.2	78%	0.78	73%	0.728	S	S	*	*			trans	-66.7	90.6	179.1	-77.4	176.1	0	0	0	110.8	S491 M495	S491-L493 PolarHBondContact O-N 2.89Å; L493-M495 PolarHBondContact O-N 3.04Å
494	I	38.3	Very low	40.2	Very low	146 Å²	146	134.7 Å²	134.7	75%	0.749	70%	0.704	S	S	*	*			trans	-65.2	98.6	162.4	-61.3	171.3	0	0	0	106.1	S492 L496	S492-I494 VanDerWaalsContact C-N 3.31Å; S492-I494 PolarHBondContact O-N 2.93Å; I494-L496 PolarHBondContact O-N 3.36Å
495	M	38.4	Very low	41.5	Very low	152 Å²	152	132.8 Å²	132.8	75%	0.749	69%	0.689	S	S	*	*			trans	-69	101.3	171.3	-67.3	-85	79.8	0	0	108.2	L493	L493-M495 PolarHBondContact O-N 3.04Å
496	L	40.1	Very low	43.9	Very low	146 Å²	146	130.9 Å²	130.9	76%	0.764	67%	0.669	S	S	*	*	P	Polyproline II helix	trans	-56.3	139.9	166.2	-71.9	165.7	0	0	0	108.8	I494 R498	I494-L496 PolarHBondContact O-N 3.36Å; L496-R498 PolarHBondContact O-N 3.09Å
497	P	40.2	Very low	45.7	Very low	113 Å²	113	128.6 Å²	128.6	73%	0.734	66%	0.657	S	S	*	*	P	Polyproline II helix	trans	-60.7	127	-180	-21	32.4	0	0	0	110.6	P499	P497-P499 WeakPolarHBondContact O-CD 3.17Å
498	R	35.6	Very low	47.6	Very low	232 Å²	232	124.4 Å²	124.4	88%	0.875	64%	0.644	S	S	*	*	P	Polyproline II helix	trans	-66.4	126.1	164.4	-76	-168.4	175.7	-152.4	-0.5	108	L496 Y500	L496-R498 PolarHBondContact O-N 3.09Å; R498-Y500 PolarHBondContact O-N 2.97Å
499	P	38.4	Very low	49.7	Very low	125 Å²	125	119.7 Å²	119.7	81%	0.812	62%	0.623	S	S	*	*	S	Bend	trans	-85.4	58.1	-178.3	35.9	-36.3	0	0	0	111.3	P497	P497-P499 WeakPolarHBondContact O-CD 3.17Å
500	Y	42.4	Very low	51.7	Low	213 Å²	213	117 Å²	117	84%	0.835	61%	0.613	S	S	*	*	S	Bend	trans	-149.4	159.7	164.3	-118.3	-83.8	0	0	0	110.4	R498	R498-Y500 PolarHBondContact O-N 2.97Å
501	E	38.8	Very low	53.6	Low	151 Å²	151	116.6 Å²	116.6	71%	0.706	61%	0.607	S	S	*	*			trans	-81.9	125.1	-153.7	-57.4	-177.1	103.5	0	0	115.2	Y503	E501-Y503 HydrophobicContact CB-CD1 4.48Å
502	D	43.2	Very low	55.3	Low	142 Å²	142	118.2 Å²	118.2	76%	0.759	59%	0.593	S	S	*	*			trans	-147.8	69.7	163.9	-120.8	-28.7	0	0	0	109.5	I504	D502-I504 PolarHBondContact O-N 3.29Å; D502-I504 VanDerWaalsContact O-N 3.09Å
503	Y	54.6	Low	57	Low	115 Å²	115	114.2 Å²	114.2	45%	0.451	56%	0.564	S	S	.	*			trans	-76.2	95.3	179.2	50.2	-90.9	0	0	0	110.5	E501 T505 R512	E501-Y503 HydrophobicContact CB-CD1 4.48Å; Y503-T505 HydrophobicContact CD2-CG2 4.1Å; Y503-T505 HydrophobicContact CE2-CG2 4.41Å; Y503-T505 PolarHBondContact O-N 3.28Å; Y503-R512 HydrophobicContact CD2-CG 3.87Å; Y503-R512 HydrophobicContact CG-CG 4.35Å
504	I	65.6	Low	58.1	Low	52 Å²	52	109.7 Å²	109.7	27%	0.267	55%	0.549	S	S	.	.			trans	-67.1	111.1	-173.6	-47.6	-175.7	0	0	0	110.1	D502 I513 L518 Q546	D502-I504 PolarHBondContact O-N 3.29Å; D502-I504 VanDerWaalsContact O-N 3.09Å; I504-I513 VanDerWaalsContact O-CB 3.27Å; I504-I513 WeakPolarHBondContact O-CB 3.17Å; I504-I513 WeakPolarHBondContact O-CG1 3.39Å; I504-I513 PolarHBondContact O-N 2.98Å; I504-L518 HydrophobicContact CD1-CD1 4.26Å; I504-Q546 VanDerWaalsContact CD1-NE2 3.26Å; I504-Q546 HydrophobicContact CG2-CB 3.96Å; I504-Q546 HydrophobicContact CG2-CG 3.82Å
505	T	71.9	Confident	59	Low	55 Å²	55	106.6 Å²	106.6	34%	0.337	54%	0.54	S	S	.	.	B	Isolated β-bridge	trans	-80.3	143.8	-179.6	60.6	0	0	0	0	111.3	Y503 C507	Y503-T505 HydrophobicContact CD2-CG2 4.1Å; Y503-T505 HydrophobicContact CE2-CG2 4.41Å; Y503-T505 PolarHBondContact O-N 3.28Å; T505-C507 PolarHBondContact O-N 2.88Å
506	C	80.5	Confident	59.8	Low	0 Å²	0	106.6 Å²	106.6	0%	0	54%	0.543	C	S	.	.	B	Isolated β-bridge	trans	-70.7	118.3	175.5	176.7	0	0	0	0	111.2	K508 C509 H510 T511 I513 Q546 C548	C506-K508 PolarHBondContact O-N 3.48Å; C506-C509 PolarHBondContact O-N 3.2Å; C506-C509 PolarHBondContact SG-SG 2.82Å; C506-H510 VanDerWaalsContact O-CA 3.24Å; C506-H510 WeakPolarHBondContact O-CA 3.39Å; C506-H510 PolarHBondContact O-N 3.29Å; C506-T511 WeakPolarHBondContact CB-O 3.37Å; C506-T511 PolarHBondContact N-O 2.89Å; C506-I513 HydrophobicContact CB-CD1 4.18Å; C506-I513 HydrophobicContact CB-CG1 4.33Å; C506-Q546 CarbonylContact C-O 3.59Å; C506-Q546 WeakPolarHBondContact CA-O 3.21Å; C506-C548 HydrophobicContact CB-CB 3.92Å; C506-C548 PolarHBondContact SG-N 3.21Å; C506-C548 VanDerWaalsContact SG-SG 3.68Å
507	C	77.2	Confident	60.4	Low	69 Å²	69	105.5 Å²	105.5	47%	0.466	54%	0.538	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.9	22	-177.7	-55.1	0	0	0	0	115.6	T505 G545 Q546	T505-C507 PolarHBondContact O-N 2.88Å; C507-G545 WeakPolarHBondContact SG-CA 3.49Å; C507-Q546 PolarHBondContact N-O 3.14Å
508	K	74.3	Confident	61	Low	95 Å²	95	103 Å²	103	41%	0.413	52%	0.518	S	S	.	.	T	Hydrogen-bonded Turn	trans	-135.6	-26.6	172.4	-175.8	-179.9	179.5	-153.6	0	113.7	C506 F547 C551	C506-K508 PolarHBondContact O-N 3.48Å; K508-F547 HydrophobicContact CB-CD1 4.04Å; K508-F547 HydrophobicContact CB-CE1 4.05Å; K508-C551 HydrophobicContact CB-CB 4.13Å; K508-C551 HydrophobicContact CD-CB 4.07Å; K508-C551 HydrophobicContact CG-CB 4.49Å
509	C	83	Confident	61.5	Low	52 Å²	52	94.7 Å²	94.7	35%	0.351	50%	0.504	S	S	.	.	T	Hydrogen-bonded Turn	trans	-136.3	6.8	-178.4	69.3	0	0	0	0	113.8	C506 T511 C551	C506-C509 PolarHBondContact O-N 3.2Å; C506-C509 PolarHBondContact SG-SG 2.82Å; C509-T511 PolarHBondContact O-N 3Å; C509-T511 PolarHBondContact O-OG1 2.89Å; C509-T511 PolarHBondContact SG-OG1 2.96Å; C509-C551 PolarHBondContact SG-SG 3.09Å
510	H	76.1	Confident	61.9	Low	137 Å²	137	96.2 Å²	96.2	63%	0.634	50%	0.504	S	S	*	.			trans	54.8	-1.6	178.3	-56.9	-85.8	0	0	0	116.8	C506 R512	C506-H510 VanDerWaalsContact O-CA 3.24Å; C506-H510 WeakPolarHBondContact O-CA 3.39Å; C506-H510 PolarHBondContact O-N 3.29Å; H510-R512 PolarHBondContact O-N 2.59Å
511	T	78.5	Confident	62.2	Low	81 Å²	81	88.2 Å²	88.2	50%	0.497	48%	0.475	S	S	.	.	P	Polyproline II helix	trans	-50.7	126.2	171.3	-47.4	0	0	0	0	110.5	C506 C509 I513	C506-T511 WeakPolarHBondContact CB-O 3.37Å; C506-T511 PolarHBondContact N-O 2.89Å; C509-T511 PolarHBondContact O-N 3Å; C509-T511 PolarHBondContact O-OG1 2.89Å; C509-T511 PolarHBondContact SG-OG1 2.96Å; T511-I513 PolarHBondContact O-N 2.66Å
512	R	71.6	Confident	62.7	Low	162 Å²	162	84.9 Å²	84.9	61%	0.611	47%	0.466	S	S	*	.	B	Isolated β-bridge	trans	-58.7	123.1	172.2	-67.1	-178.7	168.7	175.6	-6.3	109.2	Y503 H510	Y503-R512 HydrophobicContact CD2-CG 3.87Å; Y503-R512 HydrophobicContact CG-CG 4.35Å; H510-R512 PolarHBondContact O-N 2.59Å
513	I	71.6	Confident	62.8	Low	11 Å²	11	88.5 Å²	88.5	6%	0.056	47%	0.469	C	S	.	.	P	Polyproline II helix	trans	-90.8	123.5	172.4	-55.3	170.4	0	0	0	106	I504 C506 T511 D517 Q546 C548	I504-I513 VanDerWaalsContact O-CB 3.27Å; I504-I513 WeakPolarHBondContact O-CB 3.17Å; I504-I513 WeakPolarHBondContact O-CG1 3.39Å; I504-I513 PolarHBondContact O-N 2.98Å; C506-I513 HydrophobicContact CB-CD1 4.18Å; C506-I513 HydrophobicContact CB-CG1 4.33Å; T511-I513 PolarHBondContact O-N 2.66Å; I513-D517 HydrophobicContact CG2-CB 3.88Å; I513-Q546 HydrophobicContact CD1-CB 3.74Å; I513-C548 HydrophobicContact CD1-CB 4.27Å; I513-C548 HydrophobicContact CG1-CB 3.99Å
514	A	59.8	Low	62.3	Low	55 Å²	55	85.8 Å²	85.8	46%	0.455	47%	0.466	S	S	.	.	P	Polyproline II helix	trans	-68.2	141.3	174	0	0	0	0	0	109.2	N516 D517	A514-N516 PolarHBondContact O-N 2.85Å; A514-D517 WeakPolarHBondContact O-CB 3.33Å; A514-D517 PolarHBondContact O-N 2.84Å
515	S	57.4	Low	61.7	Low	81 Å²	81	83.7 Å²	83.7	57%	0.566	46%	0.456	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.8	-14.9	-178.1	-46.7	0	0	0	0	114
516	N	54.8	Low	60.6	Low	152 Å²	152	89.1 Å²	89.1	81%	0.813	47%	0.47	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.5	-17	176.2	-60.8	-18.5	0	0	0	114	A514 L518	A514-N516 PolarHBondContact O-N 2.85Å; N516-L518 PolarHBondContact O-N 2.99Å
517	D	52.1	Low	59	Low	123 Å²	123	95.1 Å²	95.1	66%	0.658	50%	0.503	S	S	*	.	S	Bend	trans	-74.3	-8.4	173.7	-77.8	-39.8	0	0	0	112.6	I513 A514 G519	I513-D517 HydrophobicContact CG2-CB 3.88Å; A514-D517 WeakPolarHBondContact O-CB 3.33Å; A514-D517 PolarHBondContact O-N 2.84Å; D517-G519 PolarHBondContact O-N 3.36Å
518	L	53	Low	57.6	Low	61 Å²	61	96.5 Å²	96.5	32%	0.319	50%	0.501	S	S	.	.			trans	-71.8	53.1	172	-85.6	136.4	0	0	0	112.4	I504 N516 I520 L521	I504-L518 HydrophobicContact CD1-CD1 4.26Å; N516-L518 PolarHBondContact O-N 2.99Å; L518-I520 PolarHBondContact O-N 3.15Å; L518-L521 HydrophobicContact CD2-CD1 3.98Å
519	G	47.1	Very low	56.2	Low	56 Å²	56	95.5 Å²	95.5	58%	0.577	50%	0.499	S	S	*	.			trans	-51	112.8	174.2	0	0	0	0	0	111.1	D517 L521	D517-G519 PolarHBondContact O-N 3.36Å; G519-L521 PolarHBondContact O-N 2.88Å; G519-L521 VanDerWaalsContact O-N 3.15Å
520	I	46.6	Very low	54.3	Low	158 Å²	158	100.3 Å²	100.3	81%	0.81	52%	0.516	S	S	*	.			trans	-21.5	104	-168.6	-56.6	173.3	0	0	0	112.7	L518 T522	L518-I520 PolarHBondContact O-N 3.15Å; I520-T522 VanDerWaalsContact C-N 3.34Å; I520-T522 PolarHBondContact O-N 2.8Å
521	L	48.6	Very low	52.8	Low	44 Å²	44	95.8 Å²	95.8	23%	0.23	50%	0.498	C	S	.	.			trans	-67.2	91.8	-178.4	-85.9	91.8	0	0	0	111.6	L518 G519 S525 R526 M529	L518-L521 HydrophobicContact CD2-CD1 3.98Å; G519-L521 PolarHBondContact O-N 2.88Å; G519-L521 VanDerWaalsContact O-N 3.15Å; L521-S525 VanDerWaalsContact C-OG 3.23Å; L521-S525 WeakPolarHBondContact CA-OG 3.39Å; L521-S525 WeakPolarHBondContact CB-OG 3.44Å; L521-R526 HydrophobicContact CB-CG 4Å; L521-R526 HydrophobicContact CD2-CG 4.3Å; L521-R526 PolarHBondContact O-NE 3.46Å; L521-M529 HydrophobicContact CD2-SD 4Å
522	T	50.3	Low	50.9	Low	82 Å²	82	100 Å²	100	50%	0.503	51%	0.51	S	S	.	.			trans	-40.1	146.1	162.2	56.5	0	0	0	0	111.8	I520 S524 S525 R526	I520-T522 VanDerWaalsContact C-N 3.34Å; I520-T522 PolarHBondContact O-N 2.8Å; T522-S524 PolarHBondContact O-N 2.8Å; T522-S524 VanDerWaalsContact O-N 3.12Å; T522-S524 PolarHBondContact OG1-OG 3.14Å; T522-S525 PolarHBondContact N-OG 3.25Å; T522-S525 VanDerWaalsContact N-OG 3.12Å; T522-S525 WeakPolarHBondContact O-CA 3.46Å; T522-S525 PolarHBondContact O-N 2.98Å; T522-S525 PolarHBondContact O-OG 3.05Å; T522-S525 WeakPolarHBondContact OG1-CB 3.49Å; T522-S525 PolarHBondContact OG1-N 3.5Å; T522-S525 PolarHBondContact OG1-OG 3.21Å; T522-R526 PolarHBondContact O-N 3.05Å
523	R	43.6	Very low	49.1	Very low	218 Å²	218	94.5 Å²	94.5	82%	0.823	50%	0.504	S	S	*	.	H	α-helix	trans	-51.6	-39.1	-178.2	-170.8	177.7	179.7	-169	0.8	112.9	R526 N527	R523-R526 PolarHBondContact O-N 2.83Å; R523-N527 PolarHBondContact O-N 2.94Å; R523-N527 PolarHBondContact O-OD1 3.44Å
524	S	45.3	Very low	47.5	Very low	57 Å²	57	101.4 Å²	101.4	40%	0.399	54%	0.541	S	S	.	.	H	α-helix	trans	-63.3	-43.9	173	48.2	0	0	0	0	112.9	T522 R526 N527 F528	T522-S524 PolarHBondContact O-N 2.8Å; T522-S524 VanDerWaalsContact O-N 3.12Å; T522-S524 PolarHBondContact OG1-OG 3.14Å; S524-R526 VanDerWaalsContact C-N 3.3Å; S524-R526 PolarHBondContact O-N 3.18Å; S524-N527 WeakPolarHBondContact O-CB 3.4Å; S524-N527 PolarHBondContact O-N 3.37Å; S524-N527 VanDerWaalsContact O-N 3.14Å; S524-F528 WeakPolarHBondContact O-CD2 3.33Å; S524-F528 PolarHBondContact O-N 2.99Å
525	S	52.3	Low	46.2	Very low	9 Å²	9	104 Å²	104	6%	0.063	56%	0.556	C	S	.	*	H	α-helix	trans	-62.9	-29.9	178	65.9	0	0	0	0	114.7	L521 T522 F528	L521-S525 VanDerWaalsContact C-OG 3.23Å; L521-S525 WeakPolarHBondContact CA-OG 3.39Å; L521-S525 WeakPolarHBondContact CB-OG 3.44Å; T522-S525 PolarHBondContact N-OG 3.25Å; T522-S525 VanDerWaalsContact N-OG 3.12Å; T522-S525 WeakPolarHBondContact O-CA 3.46Å; T522-S525 PolarHBondContact O-N 2.98Å; T522-S525 PolarHBondContact O-OG 3.05Å; T522-S525 WeakPolarHBondContact OG1-CB 3.49Å; T522-S525 PolarHBondContact OG1-N 3.5Å; T522-S525 PolarHBondContact OG1-OG 3.21Å; S525-F528 PolarHBondContact O-N 3.05Å
526	R	48.8	Very low	45.1	Very low	168 Å²	168	105.7 Å²	105.7	63%	0.634	57%	0.565	S	S	*	*	H	α-helix	trans	-68.3	-40.7	172.8	-58.6	-175.9	-168	-170.7	-3.4	111.4	L521 T522 R523 S524 F528 M529	L521-R526 HydrophobicContact CB-CG 4Å; L521-R526 HydrophobicContact CD2-CG 4.3Å; L521-R526 PolarHBondContact O-NE 3.46Å; T522-R526 PolarHBondContact O-N 3.05Å; R523-R526 PolarHBondContact O-N 2.83Å; S524-R526 VanDerWaalsContact C-N 3.3Å; S524-R526 PolarHBondContact O-N 3.18Å; R526-F528 PolarHBondContact O-N 3.38Å; R526-M529 PolarHBondContact O-N 2.99Å; R526-M529 VanDerWaalsContact O-N 3.13Å
527	N	47.9	Very low	44.2	Very low	127 Å²	127	109.9 Å²	109.9	68%	0.679	57%	0.569	S	S	*	*	H	α-helix	trans	-65.2	-17.8	177.2	-64.5	3.3	0	0	0	113.6	R523 S524 M529	R523-N527 PolarHBondContact O-N 2.94Å; R523-N527 PolarHBondContact O-OD1 3.44Å; S524-N527 WeakPolarHBondContact O-CB 3.4Å; S524-N527 PolarHBondContact O-N 3.37Å; S524-N527 VanDerWaalsContact O-N 3.14Å; N527-M529 VanDerWaalsContact C-N 3.33Å
528	F	48	Very low	43.5	Very low	97 Å²	97	112.4 Å²	112.4	43%	0.425	58%	0.575	S	S	.	*	T	Hydrogen-bonded Turn	trans	-84.7	2.5	175	-72	-66.3	0	0	0	114.3	S524 S525 R526	S524-F528 WeakPolarHBondContact O-CD2 3.33Å; S524-F528 PolarHBondContact O-N 2.99Å; S525-F528 PolarHBondContact O-N 3.05Å; R526-F528 PolarHBondContact O-N 3.38Å
529	M	44.1	Very low	42.6	Very low	74 Å²	74	116 Å²	116	37%	0.365	59%	0.594	S	S	.	*	T	Hydrogen-bonded Turn	trans	-98.8	-1.5	-175.7	-70.7	-162.6	66.3	0	0	116.3	L521 R526 N527 P531 G545 F547	L521-M529 HydrophobicContact CD2-SD 4Å; R526-M529 PolarHBondContact O-N 2.99Å; R526-M529 VanDerWaalsContact O-N 3.13Å; N527-M529 VanDerWaalsContact C-N 3.33Å; M529-P531 VanDerWaalsContact O-CD 3.24Å; M529-P531 WeakPolarHBondContact O-CD 3.39Å; M529-G545 VanDerWaalsContact CE-O 3.29Å; M529-G545 WeakPolarHBondContact CE-O 3.44Å; M529-F547 HydrophobicContact CE-CD2 4.49Å
530	H	42.7	Very low	42	Very low	153 Å²	153	120.4 Å²	120.4	71%	0.708	60%	0.598	S	S	*	*			trans	-80.8	112.5	165.2	-100	-91.1	0	0	0	109.7
531	P	45.4	Very low	41.6	Very low	42 Å²	42	123.7 Å²	123.7	27%	0.273	60%	0.6	S	S	.	*			trans	-83	-25.6	-175.2	-9.2	28.4	0	0	0	112.9	M529	M529-P531 VanDerWaalsContact O-CD 3.24Å; M529-P531 WeakPolarHBondContact O-CD 3.39Å
532	F	38.2	Very low	41.3	Very low	169 Å²	169	129.4 Å²	129.4	74%	0.741	63%	0.626	S	S	*	*			trans	-129.1	146.2	-178.2	-60.7	-80.5	0	0	0	110.4
533	G	34.5	Very low	40.5	Very low	47 Å²	47	132 Å²	132	49%	0.485	64%	0.636	S	S	.	*	S	Bend	trans	-71.9	-170.7	151.7	0	0	0	0	0	110	S535	G533-S535 PolarHBondContact O-N 2.93Å
534	D	36	Very low	40.4	Very low	156 Å²	156	124.6 Å²	124.6	83%	0.834	63%	0.628	S	S	*	*	S	Bend	trans	65.6	44.5	156.9	-35.7	-38	0	0	0	114.6
535	S	33.6	Very low	40.6	Very low	110 Å²	110	123 Å²	123	77%	0.769	62%	0.621	S	S	*	*	S	Bend	trans	-156	140	154.1	-87.4	0	0	0	0	113.3	G533 R537	G533-S535 PolarHBondContact O-N 2.93Å; S535-R537 PolarHBondContact O-N 2.94Å
536	P	34.6	Very low	41.1	Very low	117 Å²	117	124.6 Å²	124.6	76%	0.76	63%	0.627	S	S	*	*			trans	-82	100.3	-170.4	31.3	-35.4	0	0	0	113.7	K538	P536-K538 VanDerWaalsContact C-N 3.28Å; P536-K538 PolarHBondContact O-N 3.42Å
537	R	34.8	Very low	42.3	Very low	239 Å²	239	119.7 Å²	119.7	90%	0.902	61%	0.611	S	S	*	*	S	Bend	trans	41	-20.9	150.8	-77.2	-170.1	175.3	-169.8	2.3	123.7	S535	S535-R537 PolarHBondContact O-N 2.94Å
538	K	37.6	Very low	43.9	Very low	177 Å²	177	114.6 Å²	114.6	77%	0.77	59%	0.585	S	S	*	*	S	Bend	trans	-88.9	-50.4	-166.6	-70	-173.5	174.6	-177.6	0	114	P536	P536-K538 VanDerWaalsContact C-N 3.28Å; P536-K538 PolarHBondContact O-N 3.42Å
539	N	34.8	Very low	45.1	Very low	136 Å²	136	113 Å²	113	73%	0.727	59%	0.59	S	S	*	*	G	3₁₀ helix	trans	-86.8	-22.6	-162.9	-60.9	10.3	0	0	0	114.8	R541	N539-R541 PolarHBondContact O-N 3.47Å; N539-R541 VanDerWaalsContact O-N 3.11Å
540	F	33.8	Very low	46.7	Very low	149 Å²	149	114.5 Å²	114.5	65%	0.654	60%	0.599	S	S	*	*	G	3₁₀ helix	trans	-76	4.7	-177.2	-133.7	-86	0	0	0	114.6
541	R	38.7	Very low	48.4	Very low	226 Å²	226	107.4 Å²	107.4	85%	0.853	57%	0.567	S	S	*	*	G	3₁₀ helix	trans	-82.2	-20.9	176.1	-80.3	-167.2	173.4	-146.3	1.6	114.3	N539	N539-R541 PolarHBondContact O-N 3.47Å; N539-R541 VanDerWaalsContact O-N 3.11Å
542	Q	42.1	Very low	49.7	Very low	165 Å²	165	111.6 Å²	111.6	77%	0.771	58%	0.577	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.8	-41.7	-172.7	-69.9	169.9	-19.5	0	0	112	G544	Q542-G544 PolarHBondContact O-N 3.23Å
543	N	34.3	Very low	51.2	Low	135 Å²	135	110.4 Å²	110.4	72%	0.722	57%	0.572	S	S	*	*	S	Bend	trans	-96.9	85.1	177.2	-67.7	-21	0	0	0	110.3	G545	N543-G545 PolarHBondContact O-N 2.83Å
544	G	40.1	Very low	52.7	Low	64 Å²	64	113 Å²	113	66%	0.66	57%	0.571	S	S	*	*			trans	-69.5	50.7	-177.1	0	0	0	0	0	115.2	Q542 Q546	Q542-G544 PolarHBondContact O-N 3.23Å; G544-Q546 PolarHBondContact O-N 2.9Å
545	G	50.5	Low	54	Low	24 Å²	24	108.8 Å²	108.8	25%	0.247	55%	0.546	C	S	.	.			trans	-64.1	121.7	-163.8	0	0	0	0	0	115.1	C507 M529 N543	C507-G545 WeakPolarHBondContact SG-CA 3.49Å; M529-G545 VanDerWaalsContact CE-O 3.29Å; M529-G545 WeakPolarHBondContact CE-O 3.44Å; N543-G545 PolarHBondContact O-N 2.83Å
546	Q	63.3	Low	55.2	Low	41 Å²	41	107.3 Å²	107.3	19%	0.192	53%	0.532	C	S	.	.	B	Isolated β-bridge	trans	-100.5	155.8	-179.4	-60.6	-171.3	15.2	0	0	112.1	I504 C506 C507 I513 G544	I504-Q546 VanDerWaalsContact CD1-NE2 3.26Å; I504-Q546 HydrophobicContact CG2-CB 3.96Å; I504-Q546 HydrophobicContact CG2-CG 3.82Å; C506-Q546 CarbonylContact C-O 3.59Å; C506-Q546 WeakPolarHBondContact CA-O 3.21Å; C507-Q546 PolarHBondContact N-O 3.14Å; I513-Q546 HydrophobicContact CD1-CB 3.74Å; G544-Q546 PolarHBondContact O-N 2.9Å
547	F	73.5	Confident	56.2	Low	65 Å²	65	103.5 Å²	103.5	29%	0.285	51%	0.514	S	S	.	.			trans	-115.6	126.3	173.5	-62.8	-76.3	0	0	0	110.1	K508 M529 C551 R552	K508-F547 HydrophobicContact CB-CD1 4.04Å; K508-F547 HydrophobicContact CB-CE1 4.05Å; M529-F547 HydrophobicContact CE-CD2 4.49Å; F547-C551 HydrophobicContact CB-CB 4.39Å; F547-C551 HydrophobicContact CD1-CB 4.37Å; F547-R552 HydrophobicContact CB-CB 4.38Å
548	C	80.8	Confident	57	Low	20 Å²	20	100 Å²	100	14%	0.135	51%	0.506	C	S	.	.			trans	-59.3	160.2	172.8	75.4	0	0	0	0	110.9	C506 I513 N550 C551 R552	C506-C548 HydrophobicContact CB-CB 3.92Å; C506-C548 PolarHBondContact SG-N 3.21Å; C506-C548 VanDerWaalsContact SG-SG 3.68Å; I513-C548 HydrophobicContact CD1-CB 4.27Å; I513-C548 HydrophobicContact CG1-CB 3.99Å; C548-N550 PolarHBondContact O-N 3.2Å; C548-C551 PolarHBondContact O-N 3.47Å; C548-C551 VanDerWaalsContact O-N 3.13Å; C548-C551 PolarHBondContact SG-N 3.28Å; C548-C551 VanDerWaalsContact SG-N 3.4Å; C548-R552 WeakPolarHBondContact O-CB 3.35Å; C548-R552 PolarHBondContact O-N 3.25Å
549	A	73.1	Confident	57.6	Low	65 Å²	65	94 Å²	94	54%	0.537	48%	0.481	S	S	.	.	H	α-helix	trans	-53.7	-33.5	-176.7	0	0	0	0	0	113.5	K553	A549-K553 WeakPolarHBondContact O-CB 3.35Å; A549-K553 WeakPolarHBondContact O-CD 3.46Å; A549-K553 WeakPolarHBondContact O-CG 3.22Å; A549-K553 PolarHBondContact O-N 3.29Å
550	N	77.5	Confident	58.2	Low	104 Å²	104	91.1 Å²	91.1	56%	0.556	47%	0.471	S	S	*	.	H	α-helix	trans	-75.5	-45.7	178.6	-71.2	-14.7	0	0	0	112.7	C548 R552 K553 Q554	C548-N550 PolarHBondContact O-N 3.2Å; N550-R552 VanDerWaalsContact C-N 3.31Å; N550-R552 PolarHBondContact O-N 3.48Å; N550-K553 PolarHBondContact O-N 3.07Å; N550-Q554 WeakPolarHBondContact O-CG 3.43Å; N550-Q554 PolarHBondContact O-N 2.85Å
551	C	79	Confident	59	Low	5 Å²	5	92.1 Å²	92.1	3%	0.034	48%	0.478	C	S	.	.	H	α-helix	trans	-64.8	-37	174.1	-72.1	0	0	0	0	111.9	K508 C509 F547 C548 Q554 H555	K508-C551 HydrophobicContact CB-CB 4.13Å; K508-C551 HydrophobicContact CD-CB 4.07Å; K508-C551 HydrophobicContact CG-CB 4.49Å; C509-C551 PolarHBondContact SG-SG 3.09Å; F547-C551 HydrophobicContact CB-CB 4.39Å; F547-C551 HydrophobicContact CD1-CB 4.37Å; C548-C551 PolarHBondContact O-N 3.47Å; C548-C551 VanDerWaalsContact O-N 3.13Å; C548-C551 PolarHBondContact SG-N 3.28Å; C548-C551 VanDerWaalsContact SG-N 3.4Å; C551-Q554 PolarHBondContact O-N 3.39Å; C551-H555 WeakPolarHBondContact O-CB 3.46Å; C551-H555 PolarHBondContact O-N 3.18Å
552	R	72	Confident	59.7	Low	130 Å²	130	90.9 Å²	90.9	49%	0.491	48%	0.478	S	S	.	.	H	α-helix	trans	-60.2	-45.9	172.1	-172.5	178.7	179.5	-168.8	0.9	111.9	F547 C548 N550 H555 V556	F547-R552 HydrophobicContact CB-CB 4.38Å; C548-R552 WeakPolarHBondContact O-CB 3.35Å; C548-R552 PolarHBondContact O-N 3.25Å; N550-R552 VanDerWaalsContact C-N 3.31Å; N550-R552 PolarHBondContact O-N 3.48Å; R552-H555 PolarHBondContact O-N 3.05Å; R552-V556 WeakPolarHBondContact O-CB 3.07Å; R552-V556 WeakPolarHBondContact O-CG2 3.28Å; R552-V556 PolarHBondContact O-N 3.15Å
553	K	71.1	Confident	60.5	Low	143 Å²	143	87.3 Å²	87.3	62%	0.622	46%	0.458	S	S	*	.	H	α-helix	trans	-60	-46.9	173.1	-75.5	165.5	-173.3	172.3	0	111.7	A549 N550 H555 G557	A549-K553 WeakPolarHBondContact O-CB 3.35Å; A549-K553 WeakPolarHBondContact O-CD 3.46Å; A549-K553 WeakPolarHBondContact O-CG 3.22Å; A549-K553 PolarHBondContact O-N 3.29Å; N550-K553 PolarHBondContact O-N 3.07Å; K553-H555 PolarHBondContact O-N 3.06Å; K553-G557 PolarHBondContact O-N 2.95Å
554	Q	66	Low	62	Low	102 Å²	102	85.2 Å²	85.2	48%	0.477	45%	0.454	S	S	.	.	H	α-helix	trans	-62.2	-40.6	177.5	-72.5	178.7	-0.7	0	0	112.8	N550 C551 G557 K558	N550-Q554 WeakPolarHBondContact O-CG 3.43Å; N550-Q554 PolarHBondContact O-N 2.85Å; C551-Q554 PolarHBondContact O-N 3.39Å; Q554-G557 PolarHBondContact O-N 2.9Å; Q554-K558 PolarHBondContact O-N 2.84Å
555	H	62.4	Low	63.7	Low	67 Å²	67	82.6 Å²	82.6	31%	0.31	43%	0.425	S	S	.	.	H	α-helix	trans	-70.3	-42	-178.6	-153.1	-80.6	0	0	0	111.4	C551 R552 K553 G557 Q559	C551-H555 WeakPolarHBondContact O-CB 3.46Å; C551-H555 PolarHBondContact O-N 3.18Å; R552-H555 PolarHBondContact O-N 3.05Å; K553-H555 PolarHBondContact O-N 3.06Å; H555-G557 VanDerWaalsContact C-N 3.32Å; H555-Q559 PolarHBondContact CE1-NE2 2.96Å; H555-Q559 VanDerWaalsContact CE1-NE2 3.33Å; H555-Q559 WeakPolarHBondContact O-CB 3.28Å; H555-Q559 WeakPolarHBondContact O-CG 3.32Å; H555-Q559 PolarHBondContact O-N 2.95Å; H555-Q559 VanDerWaalsContact O-N 3.08Å
556	V	60	Low	65	Low	79 Å²	79	83.9 Å²	83.9	48%	0.479	43%	0.43	S	S	.	.	H	α-helix	trans	-64.3	-38	171.1	171.8	0	0	0	0	111.2	R552 S560	R552-V556 WeakPolarHBondContact O-CB 3.07Å; R552-V556 WeakPolarHBondContact O-CG2 3.28Å; R552-V556 PolarHBondContact O-N 3.15Å; V556-S560 PolarHBondContact O-N 2.82Å; V556-S560 PolarHBondContact O-OG 3.49Å; V556-S560 VanDerWaalsContact O-OG 3.09Å
557	G	54.6	Low	65.7	Low	37 Å²	37	82.3 Å²	82.3	38%	0.381	42%	0.423	S	S	.	.	H	α-helix	trans	-60.2	-63	175.2	0	0	0	0	0	112.4	K553 Q554 H555 Q559 S560	K553-G557 PolarHBondContact O-N 2.95Å; Q554-G557 PolarHBondContact O-N 2.9Å; H555-G557 VanDerWaalsContact C-N 3.32Å; G557-Q559 PolarHBondContact O-N 2.95Å; G557-S560 WeakPolarHBondContact O-CB 3.41Å; G557-S560 PolarHBondContact O-N 3.38Å; G557-S560 PolarHBondContact O-OG 3.47Å
558	K	51	Low	65.5	Low	165 Å²	165	85 Å²	85	72%	0.717	43%	0.434	S	S	*	.	H	α-helix	trans	-64.3	-24.3	-178.4	-70.9	-159.6	172.6	-160.2	0	114	Q554 S560	Q554-K558 PolarHBondContact O-N 2.84Å; K558-S560 VanDerWaalsContact C-N 3.29Å
559	Q	50.3	Low	65	Low	53 Å²	53	91 Å²	91	25%	0.248	46%	0.46	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.9	-5.1	170.9	-71.9	-169.6	-20	0	0	113.7	H555 G557 E561 R563	H555-Q559 PolarHBondContact CE1-NE2 2.96Å; H555-Q559 VanDerWaalsContact CE1-NE2 3.33Å; H555-Q559 WeakPolarHBondContact O-CB 3.28Å; H555-Q559 WeakPolarHBondContact O-CG 3.32Å; H555-Q559 PolarHBondContact O-N 2.95Å; H555-Q559 VanDerWaalsContact O-N 3.08Å; G557-Q559 PolarHBondContact O-N 2.95Å; Q559-E561 PolarHBondContact O-N 3.2Å; Q559-R563 HydrophobicContact CB-CG 4.46Å; Q559-R563 WeakPolarHBondContact O-CB 3.08Å; Q559-R563 VanDerWaalsContact O-CD 3.29Å; Q559-R563 WeakPolarHBondContact O-CD 3.38Å; Q559-R563 WeakPolarHBondContact O-CG 3.42Å; Q559-R563 PolarHBondContact O-N 3.07Å; Q559-R563 VanDerWaalsContact O-N 3.17Å
560	S	49.1	Very low	65.3	Low	75 Å²	75	89.5 Å²	89.5	52%	0.524	45%	0.445	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-42.2	177.8	-56.5	0	0	0	0	111.9	V556 G557 K558 R563	V556-S560 PolarHBondContact O-N 2.82Å; V556-S560 PolarHBondContact O-OG 3.49Å; V556-S560 VanDerWaalsContact O-OG 3.09Å; G557-S560 WeakPolarHBondContact O-CB 3.41Å; G557-S560 PolarHBondContact O-N 3.38Å; G557-S560 PolarHBondContact O-OG 3.47Å; K558-S560 VanDerWaalsContact C-N 3.29Å; S560-R563 PolarHBondContact O-N 2.91Å
561	E	50.3	Low	65.3	Low	169 Å²	169	89.9 Å²	89.9	79%	0.79	45%	0.452	S	S	*	.	G	3₁₀ helix	trans	-70.3	-42.7	-178.3	-70.5	160.5	135	0	0	111.5	Q559 R563	Q559-E561 PolarHBondContact O-N 3.2Å; E561-R563 PolarHBondContact O-N 3.09Å
562	K	53.1	Low	64.9	Low	200 Å²	200	90.3 Å²	90.3	87%	0.87	46%	0.455	S	S	*	.	G	3₁₀ helix	trans	-78.8	8.4	173.7	-69.5	-163.1	174.7	-168.8	0	114.8
563	R	57.9	Low	64.6	Low	90 Å²	90	94 Å²	94	34%	0.34	47%	0.47	S	S	.	.	G	3₁₀ helix	trans	-117.4	32.6	177.3	-73	173.7	-179.7	-103.8	5.7	113	Q559 S560 E561 R578	Q559-R563 HydrophobicContact CB-CG 4.46Å; Q559-R563 WeakPolarHBondContact O-CB 3.08Å; Q559-R563 VanDerWaalsContact O-CD 3.29Å; Q559-R563 WeakPolarHBondContact O-CD 3.38Å; Q559-R563 WeakPolarHBondContact O-CG 3.42Å; Q559-R563 PolarHBondContact O-N 3.07Å; Q559-R563 VanDerWaalsContact O-N 3.17Å; S560-R563 PolarHBondContact O-N 2.91Å; E561-R563 PolarHBondContact O-N 3.09Å; R563-R578 PolarHBondContact NH1-O 3.13Å
564	S	67.1	Low	64.1	Low	91 Å²	91	92.4 Å²	92.4	64%	0.636	47%	0.473	S	S	*	.	S	Bend	trans	-68.1	151.8	156.7	-164.7	0	0	0	0	110.1	H580	S564-H580 PolarHBondContact O-CE1 2.7Å; S564-H580 VanDerWaalsContact O-CE1 3.23Å
565	C	76.4	Confident	63.7	Low	9 Å²	9	97.6 Å²	97.6	6%	0.061	49%	0.489	C	S	.	.			trans	-77.4	132.9	173.7	-175.3	0	0	0	0	109	V567 C570 C612	C565-V567 PolarHBondContact O-N 2.74Å; C565-C570 HydrophobicContact CB-CB 3.78Å; C565-C570 WeakPolarHBondContact CB-SG 3.46Å; C565-C612 HydrophobicContact CB-CB 4.22Å; C565-C612 PolarHBondContact SG-N 2.82Å
566	P	76	Confident	63.5	Low	52 Å²	52	103.4 Å²	103.4	34%	0.338	51%	0.508	S	S	.	.	S	Bend	trans	-70.1	-11.8	-178.3	28.4	-35.9	0	0	0	114.2	F568 L604 A608 K610	P566-F568 PolarHBondContact O-N 3.29Å; P566-L604 HydrophobicContact CB-CD2 4.42Å; P566-L604 HydrophobicContact CG-CD2 4.21Å; P566-A608 HydrophobicContact CB-CB 4.28Å; P566-K610 WeakPolarHBondContact CD-O 3.4Å; P566-K610 VanDerWaalsContact CG-O 3.25Å; P566-K610 WeakPolarHBondContact CG-O 3.29Å
567	V	78.4	Confident	63.6	Low	8 Å²	8	100.1 Å²	100.1	5%	0.048	49%	0.488	C	S	.	.	S	Bend	trans	-69.6	117.8	172.5	173.8	0	0	0	0	109.5	C565 C570 Y602 L604 C611 C615 I619	C565-V567 PolarHBondContact O-N 2.74Å; V567-C570 VanDerWaalsContact O-CB 3.27Å; V567-C570 WeakPolarHBondContact O-CB 3.44Å; V567-C570 PolarHBondContact O-N 3.24Å; V567-Y602 HydrophobicContact CG1-CD1 3.95Å; V567-Y602 HydrophobicContact CG1-CG 4.46Å; V567-L604 HydrophobicContact CG2-CD1 4.22Å; V567-L604 HydrophobicContact CG2-CD2 3.63Å; V567-L604 HydrophobicContact CG2-CG 3.98Å; V567-C611 HydrophobicContact CG2-CB 3.79Å; V567-C615 HydrophobicContact CB-CB 4.22Å; V567-C615 HydrophobicContact CG1-CB 4.36Å; V567-C615 HydrophobicContact CG2-CB 3.87Å; V567-I619 HydrophobicContact CG2-CD1 4.26Å
568	F	69.5	Low	63.8	Low	121 Å²	121	104.3 Å²	104.3	53%	0.531	49%	0.493	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.3	146.6	175.1	-163.9	-128.5	0	0	0	110	P566 C570 Y602 H603	P566-F568 PolarHBondContact O-N 3.29Å; F568-C570 VanDerWaalsContact C-N 3.3Å; F568-C570 PolarHBondContact O-N 2.92Å; F568-Y602 PolarHBondContact N-O 3.23Å; F568-H603 HydrophobicContact CB-CB 3.68Å; F568-H603 AromaticContact CD1-CD2 3.57Å; F568-H603 AromaticContact CD1-CG 3.98Å; F568-H603 AromaticContact CD1-NE2 3.81Å; F568-H603 HydrophobicContact CG-CB 4.38Å
569	H	70.7	Confident	64.5	Low	146 Å²	146	102 Å²	102	68%	0.676	49%	0.485	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.7	35.6	-168.9	-54.6	104.5	0	0	0	115.2	T571	H569-T571 WeakPolarHBondContact O-CG2 3.29Å; H569-T571 PolarHBondContact O-N 3.31Å
570	C	79.5	Confident	65.6	Low	33 Å²	33	102.8 Å²	102.8	22%	0.223	49%	0.488	C	S	.	.			trans	-63.1	92.8	173.5	-177	0	0	0	0	112.7	C565 V567 F568 A572 C612	C565-C570 HydrophobicContact CB-CB 3.78Å; C565-C570 WeakPolarHBondContact CB-SG 3.46Å; V567-C570 VanDerWaalsContact O-CB 3.27Å; V567-C570 WeakPolarHBondContact O-CB 3.44Å; V567-C570 PolarHBondContact O-N 3.24Å; F568-C570 VanDerWaalsContact C-N 3.3Å; F568-C570 PolarHBondContact O-N 2.92Å; C570-A572 PolarHBondContact O-N 2.93Å; C570-C612 VanDerWaalsContact SG-SG 3.67Å
571	T	76.4	Confident	66.9	Low	112 Å²	112	103.4 Å²	103.4	69%	0.687	48%	0.481	S	S	*	.			trans	-68	15.9	177.7	65.6	0	0	0	0	115	H569 K618	H569-T571 WeakPolarHBondContact O-CG2 3.29Å; H569-T571 PolarHBondContact O-N 3.31Å; T571-K618 PolarHBondContact OG1-NZ 3.49Å
572	A	71.7	Confident	68.3	Low	14 Å²	14	98.8 Å²	98.8	12%	0.116	47%	0.468	C	S	.	.	S	Bend	trans	-91.8	126.3	-177.2	0	0	0	0	0	111.1	C570 C577 A614	C570-A572 PolarHBondContact O-N 2.93Å; A572-C577 PolarHBondContact O-SG 3.36Å; A572-C577 VanDerWaalsContact O-SG 3.41Å; A572-A614 HydrophobicContact CB-CB 3.82Å
573	R	64.7	Low	69.7	Low	209 Å²	209	89.3 Å²	89.3	79%	0.789	43%	0.426	S	S	*	.			trans	-54	137.2	174.3	-64.2	-175	-179.6	-170.7	-1.2	109.9	R575 R576	R573-R575 PolarHBondContact O-N 3.32Å; R573-R576 PolarHBondContact O-N 2.57Å
574	P	62.4	Low	70.9	Confident	108 Å²	108	85.1 Å²	85.1	70%	0.701	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.5	-25.6	-172.7	-32	35.8	0	0	0	116.5	R576 C577	P574-R576 VanDerWaalsContact C-N 3.28Å; P574-R576 PolarHBondContact O-N 2.81Å; P574-C577 PolarHBondContact O-N 3.26Å
575	R	56	Low	71.5	Confident	211 Å²	211	85.4 Å²	85.4	80%	0.796	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.4	-24.4	173.1	-63.4	-175.1	-174	172.1	2.9	114	R573	R573-R575 PolarHBondContact O-N 3.32Å
576	R	58.4	Low	71.7	Confident	190 Å²	190	87.3 Å²	87.3	72%	0.717	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91	-14.4	174.2	-67.9	-173.9	177.9	178.8	-1	113.3	R573 P574 R578	R573-R576 PolarHBondContact O-N 2.57Å; P574-R576 VanDerWaalsContact C-N 3.28Å; P574-R576 PolarHBondContact O-N 2.81Å; R576-R578 PolarHBondContact O-N 3.23Å
577	C	62.9	Low	72	Confident	10 Å²	10	85 Å²	85	7%	0.068	40%	0.398	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.8	-8	173.5	-57.7	0	0	0	0	113.4	A572 P574 E579 H580 C612	A572-C577 PolarHBondContact O-SG 3.36Å; A572-C577 VanDerWaalsContact O-SG 3.41Å; P574-C577 PolarHBondContact O-N 3.26Å; C577-E579 PolarHBondContact O-N 2.87Å; C577-E579 VanDerWaalsContact O-N 3.17Å; C577-H580 PolarHBondContact O-CD2 2.64Å; C577-H580 PolarHBondContact O-NE2 3.48Å; C577-C612 HydrophobicContact CB-CB 4.36Å
578	R	58.1	Low	72.1	Confident	125 Å²	125	89.7 Å²	89.7	47%	0.472	42%	0.418	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.8	-21.5	-170.6	-66.9	-179.4	170.8	-166.9	-8.6	115.2	R563 R576	R563-R578 PolarHBondContact NH1-O 3.13Å; R576-R578 PolarHBondContact O-N 3.23Å
579	E	65.4	Low	72.6	Confident	117 Å²	117	91.8 Å²	91.8	55%	0.547	43%	0.427	S	S	.	.			trans	-117.9	106.5	176.8	-69.7	172.2	-156.4	0	0	108.5	C577 F613	C577-E579 PolarHBondContact O-N 2.87Å; C577-E579 VanDerWaalsContact O-N 3.17Å; E579-F613 PolarHBondContact O-N 3.3Å
580	H	73.8	Confident	73.1	Confident	69 Å²	69	85.3 Å²	85.3	32%	0.319	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	137.1	167.5	-68.1	-171.2	0	0	0	109.2	S564 C577 K610 C611	S564-H580 PolarHBondContact O-CE1 2.7Å; S564-H580 VanDerWaalsContact O-CE1 3.23Å; C577-H580 PolarHBondContact O-CD2 2.64Å; C577-H580 PolarHBondContact O-NE2 3.48Å; H580-K610 HydrophobicContact CB-CB 4.18Å; H580-K610 PolarHBondContact ND1-O 3.19Å; H580-K610 VanDerWaalsContact ND1-O 3.12Å; H580-C611 CarbonylContact C-O 3.45Å; H580-C611 VanDerWaalsContact CA-O 3.23Å; H580-C611 WeakPolarHBondContact CA-O 3.36Å
581	K	75.7	Confident	73.2	Confident	88 Å²	88	88.5 Å²	88.5	38%	0.383	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	157.4	170.6	-61.9	-163.7	175.1	-168.3	0	109.5	K610 C611 F613 F616	K581-K610 CarbonylContact O-C 3.45Å; K581-K610 VanDerWaalsContact O-CA 3.26Å; K581-K610 WeakPolarHBondContact O-CA 3.35Å; K581-C611 PolarHBondContact N-O 2.89Å; K581-C611 PolarHBondContact O-N 3.24Å; K581-F613 HydrophobicContact CD-CD2 4.06Å; K581-F616 HydrophobicContact CB-CD2 4Å; K581-F616 HydrophobicContact CB-CE2 4.41Å; K581-F616 HydrophobicContact CB-CG 4.41Å; K581-F616 HydrophobicContact CD-CD1 4.38Å; K581-F616 HydrophobicContact CD-CD2 4.43Å; K581-F616 HydrophobicContact CD-CG 4.34Å
582	S	80.9	Confident	73.4	Confident	72 Å²	72	89.2 Å²	89.2	50%	0.503	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-51.5	158.9	159.2	41.8	0	0	0	0	110.8	F609 F616	S582-F609 CarbonylContact C-O 3.52Å; S582-F609 VanDerWaalsContact CA-O 3.23Å; S582-F609 WeakPolarHBondContact CA-O 3.43Å; S582-F616 WeakPolarHBondContact O-CD2 3.25Å; S582-F616 VanDerWaalsContact O-CE2 3.26Å; S582-F616 WeakPolarHBondContact O-CE2 3.29Å
583	L	81.9	Confident	73.9	Confident	1 Å²	1	91.6 Å²	91.6	1%	0.005	42%	0.422	C	S	.	.	P	Polyproline II helix	trans	-57.7	156.1	164.7	-66.5	-176.9	0	0	0	110.6	F587 F588 L604 F609 I619	L583-F587 HydrophobicContact CB-CB 4.37Å; L583-F587 HydrophobicContact CB-CD1 4.48Å; L583-F587 HydrophobicContact CB-CG 4.44Å; L583-F587 HydrophobicContact CD1-CD1 3.83Å; L583-F587 HydrophobicContact CD1-CD2 4.41Å; L583-F587 HydrophobicContact CD1-CE1 3.9Å; L583-F587 HydrophobicContact CD1-CE2 4.46Å; L583-F587 HydrophobicContact CD1-CG 4.11Å; L583-F587 HydrophobicContact CD1-CZ 4.23Å; L583-F588 HydrophobicContact CB-CE2 4.43Å; L583-L604 HydrophobicContact CD1-CD1 4.4Å; L583-L604 HydrophobicContact CD2-CD1 3.95Å; L583-F609 HydrophobicContact CD1-CD1 4.1Å; L583-F609 PolarHBondContact N-O 3.21Å; L583-I619 HydrophobicContact CD2-CD1 3.92Å; L583-I619 HydrophobicContact CD2-CG2 4.46Å
584	P	82.4	Confident	74.8	Confident	2 Å²	2	82.4 Å²	82.4	1%	0.013	39%	0.388	C	S	.	.	P	Polyproline II helix	trans	-61.7	144.2	178.8	-18.1	31.7	0	0	0	110.9	E586 F587 F616 I619 K620 I623	P584-E586 VanDerWaalsContact CB-OE2 3.25Å; P584-E586 WeakPolarHBondContact CB-OE2 3.49Å; P584-E586 PolarHBondContact O-N 3.05Å; P584-E586 VanDerWaalsContact O-N 3.12Å; P584-F587 WeakPolarHBondContact O-CB 3.5Å; P584-F587 PolarHBondContact O-N 3.17Å; P584-F616 HydrophobicContact CB-CE2 4.05Å; P584-F616 HydrophobicContact CB-CZ 4.23Å; P584-F616 HydrophobicContact CG-CD2 3.97Å; P584-F616 HydrophobicContact CG-CE2 3.71Å; P584-F616 HydrophobicContact CG-CZ 4.12Å; P584-I619 HydrophobicContact CG-CG2 4.39Å; P584-K620 HydrophobicContact CB-CB 4.15Å; P584-K620 HydrophobicContact CB-CD 4.44Å; P584-K620 HydrophobicContact CB-CG 3.99Å; P584-K620 HydrophobicContact CG-CB 3.6Å; P584-K620 HydrophobicContact CG-CG 4.02Å; P584-I623 HydrophobicContact CB-CD1 4.29Å; P584-I623 HydrophobicContact CG-CD1 4.02Å
585	D	80.2	Confident	75.8	Confident	96 Å²	96	79.4 Å²	79.4	51%	0.513	37%	0.365	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-23.6	-177.4	-45.9	-52.6	0	0	0	112.1	F587	D585-F587 VanDerWaalsContact C-N 3.25Å; D585-F587 PolarHBondContact O-N 3.34Å
586	E	81.6	Confident	77	Confident	50 Å²	50	74.7 Å²	74.7	23%	0.234	35%	0.352	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.1	-17.9	172.3	-54.7	94.1	163.1	0	0	114	P584 K589 K620 I623 L627	P584-E586 VanDerWaalsContact CB-OE2 3.25Å; P584-E586 WeakPolarHBondContact CB-OE2 3.49Å; P584-E586 PolarHBondContact O-N 3.05Å; P584-E586 VanDerWaalsContact O-N 3.12Å; E586-K589 PolarHBondContact O-N 3.35Å; E586-K620 IonicContact OE1-NZ 2.78Å; E586-K620 PolarHBondContact OE1-NZ 3.38Å; E586-K620 IonicContact OE2-NZ 3.5Å; E586-K620 PolarHBondContact OE2-NZ 3.4Å; E586-I623 HydrophobicContact CB-CG2 3.69Å; E586-L627 HydrophobicContact CB-CD1 4.03Å; E586-L627 HydrophobicContact CG-CD1 4.49Å
587	F	82.4	Confident	78.2	Confident	3 Å²	3	73.8 Å²	73.8	1%	0.013	35%	0.348	C	S	.	.	G	3₁₀ helix	trans	-62.1	-46.3	175.5	177.5	-98.3	0	0	0	110.9	L583 P584 D585 K589 L590 Q595 L598 L599 I623	L583-F587 HydrophobicContact CB-CB 4.37Å; L583-F587 HydrophobicContact CB-CD1 4.48Å; L583-F587 HydrophobicContact CB-CG 4.44Å; L583-F587 HydrophobicContact CD1-CD1 3.83Å; L583-F587 HydrophobicContact CD1-CD2 4.41Å; L583-F587 HydrophobicContact CD1-CE1 3.9Å; L583-F587 HydrophobicContact CD1-CE2 4.46Å; L583-F587 HydrophobicContact CD1-CG 4.11Å; L583-F587 HydrophobicContact CD1-CZ 4.23Å; P584-F587 WeakPolarHBondContact O-CB 3.5Å; P584-F587 PolarHBondContact O-N 3.17Å; D585-F587 VanDerWaalsContact C-N 3.25Å; D585-F587 PolarHBondContact O-N 3.34Å; F587-K589 PolarHBondContact O-N 3.05Å; F587-K589 VanDerWaalsContact O-N 3.15Å; F587-L590 WeakPolarHBondContact O-CB 3.46Å; F587-L590 PolarHBondContact O-N 2.89Å; F587-Q595 HydrophobicContact CD1-CG 4.5Å; F587-Q595 HydrophobicContact CE1-CB 4.16Å; F587-Q595 HydrophobicContact CE1-CG 4.03Å; F587-Q595 HydrophobicContact CE2-CB 4.19Å; F587-Q595 HydrophobicContact CE2-CG 4.25Å; F587-Q595 HydrophobicContact CZ-CB 3.66Å; F587-Q595 HydrophobicContact CZ-CG 3.89Å; F587-Q595 WeakPolarHBondContact O-CG 3.28Å; F587-L598 HydrophobicContact CD2-CD1 4.11Å; F587-L598 HydrophobicContact CE2-CB 3.9Å; F587-L598 HydrophobicContact CE2-CD1 4.08Å; F587-L599 HydrophobicContact CZ-CD1 4.25Å; F587-L599 HydrophobicContact CZ-CD2 4Å; F587-L599 HydrophobicContact CZ-CG 3.86Å; F587-I623 HydrophobicContact CB-CD1 3.69Å; F587-I623 HydrophobicContact CD2-CD1 4.06Å; F587-I623 HydrophobicContact CG-CD1 4.38Å
588	F	79.5	Confident	79.2	Confident	106 Å²	106	73.5 Å²	73.5	47%	0.465	35%	0.346	S	S	.	.	G	3₁₀ helix	trans	-73.4	-0.9	-179.6	-55.4	-78.2	0	0	0	113.6	L583 F609	L583-F588 HydrophobicContact CB-CE2 4.43Å; F588-F609 HydrophobicContact CE1-CD1 4.05Å; F588-F609 AromaticContact CE1-CE1 3.73Å; F588-F609 HydrophobicContact CE1-CE1 3.73Å; F588-F609 AromaticContact CZ-CD1 3.84Å; F588-F609 HydrophobicContact CZ-CD1 3.84Å; F588-F609 HydrophobicContact CZ-CE1 4.02Å
589	K	80.6	Confident	80.3	Confident	166 Å²	166	69 Å²	69	72%	0.722	33%	0.331	S	S	*	.	G	3₁₀ helix	trans	-100	-6.5	173.7	-60.5	-171.6	178.1	-168.7	0	113.4	E586 F587	E586-K589 PolarHBondContact O-N 3.35Å; F587-K589 PolarHBondContact O-N 3.05Å; F587-K589 VanDerWaalsContact O-N 3.15Å
590	L	80.2	Confident	81.1	Confident	10 Å²	10	66.4 Å²	66.4	5%	0.052	33%	0.33	C	S	.	.	S	Bend	trans	-78.5	152	172.4	-66.8	174.4	0	0	0	110.1	F587 L594 Q595 L598 I623 L627	F587-L590 WeakPolarHBondContact O-CB 3.46Å; F587-L590 PolarHBondContact O-N 2.89Å; L590-L594 HydrophobicContact CB-CB 4.03Å; L590-L594 HydrophobicContact CD1-CB 4.42Å; L590-L594 HydrophobicContact CD2-CD1 4.34Å; L590-Q595 HydrophobicContact CB-CG 4Å; L590-Q595 PolarHBondContact O-NE2 2.9Å; L590-L598 HydrophobicContact CD1-CD1 3.44Å; L590-L598 VanDerWaalsContact CD1-CD1 3.44Å; L590-I623 HydrophobicContact CD1-CB 4.47Å; L590-I623 HydrophobicContact CD1-CG1 4Å; L590-I623 HydrophobicContact CD1-CG2 4.06Å; L590-I623 HydrophobicContact CG-CG2 4.31Å; L590-L627 HydrophobicContact CD2-CD2 3.71Å; L590-L627 HydrophobicContact CD2-CG 4.01Å
591	D	82.2	Confident	81.6	Confident	100 Å²	100	67.4 Å²	67.4	54%	0.535	34%	0.335	S	S	.	.			trans	-54.3	150.3	167.4	173.7	42.9	0	0	0	111.5	V593 L594 Q595	D591-V593 VanDerWaalsContact C-N 3.25Å; D591-V593 PolarHBondContact O-N 2.92Å; D591-V593 WeakPolarHBondContact OD2-CB 3.28Å; D591-V593 WeakPolarHBondContact OD2-CG2 3.49Å; D591-V593 PolarHBondContact OD2-N 3.4Å; D591-L594 HydrophobicContact CB-CD1 4.34Å; D591-L594 WeakPolarHBondContact O-CA 3.34Å; D591-L594 WeakPolarHBondContact O-CB 3.42Å; D591-L594 PolarHBondContact O-N 2.66Å; D591-Q595 PolarHBondContact O-N 2.72Å
592	M	80	Confident	81.8	Confident	126 Å²	126	65 Å²	65	62%	0.621	32%	0.324	S	S	*	.	H	α-helix	trans	-56.3	-40	-176.5	-169.5	170.6	73.2	0	0	111.6	L594 Q595 E596	M592-L594 VanDerWaalsContact C-N 3.27Å; M592-L594 PolarHBondContact O-N 3.28Å; M592-Q595 PolarHBondContact O-N 3.06Å; M592-E596 WeakPolarHBondContact O-CG 3.1Å; M592-E596 PolarHBondContact O-N 3.01Å
593	V	82.7	Confident	81.5	Confident	65 Å²	65	67 Å²	67	39%	0.394	33%	0.325	S	S	.	.	H	α-helix	trans	-63.5	-32.8	177.3	-174.2	0	0	0	0	111.9	D591 R597	D591-V593 VanDerWaalsContact C-N 3.25Å; D591-V593 PolarHBondContact O-N 2.92Å; D591-V593 WeakPolarHBondContact OD2-CB 3.28Å; D591-V593 WeakPolarHBondContact OD2-CG2 3.49Å; D591-V593 PolarHBondContact OD2-N 3.4Å; V593-R597 WeakPolarHBondContact O-CB 3.49Å; V593-R597 WeakPolarHBondContact O-CD 3.21Å; V593-R597 WeakPolarHBondContact O-CG 3.23Å; V593-R597 PolarHBondContact O-N 3.35Å
594	L	82.6	Confident	81.3	Confident	16 Å²	16	67.4 Å²	67.4	8%	0.084	33%	0.327	C	S	.	.	H	α-helix	trans	-78.4	-36.4	175	-74	165.6	0	0	0	112	L590 D591 M592 L598 Y630	L590-L594 HydrophobicContact CB-CB 4.03Å; L590-L594 HydrophobicContact CD1-CB 4.42Å; L590-L594 HydrophobicContact CD2-CD1 4.34Å; D591-L594 HydrophobicContact CB-CD1 4.34Å; D591-L594 WeakPolarHBondContact O-CA 3.34Å; D591-L594 WeakPolarHBondContact O-CB 3.42Å; D591-L594 PolarHBondContact O-N 2.66Å; M592-L594 VanDerWaalsContact C-N 3.27Å; M592-L594 PolarHBondContact O-N 3.28Å; L594-L598 WeakPolarHBondContact O-CB 3.48Å; L594-L598 WeakPolarHBondContact O-CG 3.36Å; L594-L598 PolarHBondContact O-N 3.37Å; L594-L598 VanDerWaalsContact O-N 3.13Å; L594-Y630 HydrophobicContact CD1-CD2 4.42Å; L594-Y630 HydrophobicContact CD1-CE2 3.63Å
595	Q	84	Confident	80.6	Confident	44 Å²	44	70.4 Å²	70.4	21%	0.206	35%	0.348	C	S	.	.	H	α-helix	trans	-62.1	-47.8	172.5	-68.3	-170.9	47.2	0	0	111.1	F587 L590 D591 M592 L598 L599	F587-Q595 HydrophobicContact CD1-CG 4.5Å; F587-Q595 HydrophobicContact CE1-CB 4.16Å; F587-Q595 HydrophobicContact CE1-CG 4.03Å; F587-Q595 HydrophobicContact CE2-CB 4.19Å; F587-Q595 HydrophobicContact CE2-CG 4.25Å; F587-Q595 HydrophobicContact CZ-CB 3.66Å; F587-Q595 HydrophobicContact CZ-CG 3.89Å; F587-Q595 WeakPolarHBondContact O-CG 3.28Å; L590-Q595 HydrophobicContact CB-CG 4Å; L590-Q595 PolarHBondContact O-NE2 2.9Å; D591-Q595 PolarHBondContact O-N 2.72Å; M592-Q595 PolarHBondContact O-N 3.06Å; Q595-L598 PolarHBondContact O-N 3.06Å; Q595-L599 WeakPolarHBondContact O-CG 3.43Å; Q595-L599 PolarHBondContact O-N 3Å
596	E	82.2	Confident	79.7	Confident	113 Å²	113	70 Å²	70	53%	0.528	35%	0.351	S	S	.	.	H	α-helix	trans	-59.8	-47.8	177	-74.7	-179.2	168.1	0	0	112.4	M592 L598 L599 A600	M592-E596 WeakPolarHBondContact O-CG 3.1Å; M592-E596 PolarHBondContact O-N 3.01Å; E596-L598 VanDerWaalsContact C-N 3.26Å; E596-L598 PolarHBondContact O-N 2.91Å; E596-L599 PolarHBondContact O-N 3.32Å; E596-L599 VanDerWaalsContact O-N 3.16Å; E596-A600 WeakPolarHBondContact O-CB 3.28Å; E596-A600 PolarHBondContact O-N 3.22Å
597	R	82.7	Confident	78.7	Confident	170 Å²	170	75.2 Å²	75.2	64%	0.642	38%	0.379	S	S	*	.	H	α-helix	trans	-57	-39.9	176.1	-75.6	171.4	-175.2	-168.1	4.4	112.2	V593 E601	V593-R597 WeakPolarHBondContact O-CB 3.49Å; V593-R597 WeakPolarHBondContact O-CD 3.21Å; V593-R597 WeakPolarHBondContact O-CG 3.23Å; V593-R597 PolarHBondContact O-N 3.35Å; R597-E601 WeakPolarHBondContact O-CB 3.35Å; R597-E601 PolarHBondContact O-N 3.04Å
598	L	83.3	Confident	77.9	Confident	4 Å²	4	76.4 Å²	76.4	2%	0.021	39%	0.39	C	S	.	.	H	α-helix	trans	-72	-38	176.6	-76.1	172.3	0	0	0	112.9	F587 L590 L594 Q595 E596 Y602 K622 I623 F626	F587-L598 HydrophobicContact CD2-CD1 4.11Å; F587-L598 HydrophobicContact CE2-CB 3.9Å; F587-L598 HydrophobicContact CE2-CD1 4.08Å; L590-L598 HydrophobicContact CD1-CD1 3.44Å; L590-L598 VanDerWaalsContact CD1-CD1 3.44Å; L594-L598 WeakPolarHBondContact O-CB 3.48Å; L594-L598 WeakPolarHBondContact O-CG 3.36Å; L594-L598 PolarHBondContact O-N 3.37Å; L594-L598 VanDerWaalsContact O-N 3.13Å; Q595-L598 PolarHBondContact O-N 3.06Å; E596-L598 VanDerWaalsContact C-N 3.26Å; E596-L598 PolarHBondContact O-N 2.91Å; L598-Y602 HydrophobicContact CD2-CE2 4.1Å; L598-Y602 WeakPolarHBondContact O-CD2 3.43Å; L598-Y602 PolarHBondContact O-N 3.47Å; L598-K622 HydrophobicContact CD2-CD 3.95Å; L598-K622 HydrophobicContact CD2-CG 4.35Å; L598-I623 HydrophobicContact CD1-CG1 3.89Å; L598-F626 HydrophobicContact CD2-CE2 4.07Å
599	L	83.1	Confident	77.5	Confident	30 Å²	30	75.3 Å²	75.3	16%	0.157	39%	0.385	C	S	.	.	H	α-helix	trans	-64.9	-43.9	174.8	-70.5	171.4	0	0	0	111	F587 Q595 E596 H603 L604	F587-L599 HydrophobicContact CZ-CD1 4.25Å; F587-L599 HydrophobicContact CZ-CD2 4Å; F587-L599 HydrophobicContact CZ-CG 3.86Å; Q595-L599 WeakPolarHBondContact O-CG 3.43Å; Q595-L599 PolarHBondContact O-N 3Å; E596-L599 PolarHBondContact O-N 3.32Å; E596-L599 VanDerWaalsContact O-N 3.16Å; L599-H603 CarbonylContact O-C 2.7Å; L599-H603 VanDerWaalsContact O-CA 3.28Å; L599-H603 WeakPolarHBondContact O-CA 3.27Å; L599-H603 PolarHBondContact O-N 2.92Å; L599-L604 HydrophobicContact CD2-CB 3.65Å; L599-L604 HydrophobicContact CD2-CD1 4.32Å; L599-L604 PolarHBondContact O-N 2.84Å
600	A	81	Confident	77.4	Confident	64 Å²	64	73.7 Å²	73.7	53%	0.529	38%	0.378	S	S	.	.	H	α-helix	trans	-62.4	-50.2	176.5	0	0	0	0	0	112	E596 Y602 H603	E596-A600 WeakPolarHBondContact O-CB 3.28Å; E596-A600 PolarHBondContact O-N 3.22Å; A600-Y602 VanDerWaalsContact C-N 3.34Å; A600-Y602 PolarHBondContact O-N 2.77Å; A600-H603 PolarHBondContact O-N 2.81Å
601	E	83.7	Confident	77.5	Confident	90 Å²	90	73.2 Å²	73.2	42%	0.421	38%	0.375	S	S	.	.	H	α-helix	trans	-59.5	-40.3	-179.9	179.9	-173.6	-180	0	0	113.2	R597 H603 K622	R597-E601 WeakPolarHBondContact O-CB 3.35Å; R597-E601 PolarHBondContact O-N 3.04Å; E601-H603 VanDerWaalsContact C-N 3.33Å; E601-K622 IonicContact OE1-NZ 2.6Å; E601-K622 PolarHBondContact OE1-NZ 3.43Å; E601-K622 IonicContact OE2-NZ 3.59Å; E601-K622 PolarHBondContact OE2-NZ 2.81Å
602	Y	80.5	Confident	77.7	Confident	37 Å²	37	68.4 Å²	68.4	15%	0.145	35%	0.35	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90	1.7	178	-69.8	-62.2	0	0	0	113.5	V567 F568 L598 A600 L604 I619	V567-Y602 HydrophobicContact CG1-CD1 3.95Å; V567-Y602 HydrophobicContact CG1-CG 4.46Å; F568-Y602 PolarHBondContact N-O 3.23Å; L598-Y602 HydrophobicContact CD2-CE2 4.1Å; L598-Y602 WeakPolarHBondContact O-CD2 3.43Å; L598-Y602 PolarHBondContact O-N 3.47Å; A600-Y602 VanDerWaalsContact C-N 3.34Å; A600-Y602 PolarHBondContact O-N 2.77Å; Y602-L604 PolarHBondContact O-N 3.45Å; Y602-I619 HydrophobicContact CD1-CG1 4.49Å; Y602-I619 HydrophobicContact CD2-CD1 4.33Å; Y602-I619 HydrophobicContact CD2-CG1 3.71Å; Y602-I619 HydrophobicContact CE1-CG1 4.46Å; Y602-I619 HydrophobicContact CE2-CB 4.49Å; Y602-I619 HydrophobicContact CE2-CG1 3.65Å; Y602-I619 HydrophobicContact CG-CD1 4.44Å; Y602-I619 HydrophobicContact CG-CG1 4.15Å
603	H	74.8	Confident	77.9	Confident	114 Å²	114	67 Å²	67	53%	0.528	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	43.3	43.4	-171	-56	-101.8	0	0	0	112.9	F568 L599 A600 E601	F568-H603 HydrophobicContact CB-CB 3.68Å; F568-H603 AromaticContact CD1-CD2 3.57Å; F568-H603 AromaticContact CD1-CG 3.98Å; F568-H603 AromaticContact CD1-NE2 3.81Å; F568-H603 HydrophobicContact CG-CB 4.38Å; L599-H603 CarbonylContact O-C 2.7Å; L599-H603 VanDerWaalsContact O-CA 3.28Å; L599-H603 WeakPolarHBondContact O-CA 3.27Å; L599-H603 PolarHBondContact O-N 2.92Å; A600-H603 PolarHBondContact O-N 2.81Å; E601-H603 VanDerWaalsContact C-N 3.33Å
604	L	78.6	Confident	77.9	Confident	10 Å²	10	65.5 Å²	65.5	5%	0.052	34%	0.335	C	S	.	.			trans	-81.1	117.1	173.7	-78.6	170	0	0	0	108.8	P566 V567 L583 L599 Y602 I619	P566-L604 HydrophobicContact CB-CD2 4.42Å; P566-L604 HydrophobicContact CG-CD2 4.21Å; V567-L604 HydrophobicContact CG2-CD1 4.22Å; V567-L604 HydrophobicContact CG2-CD2 3.63Å; V567-L604 HydrophobicContact CG2-CG 3.98Å; L583-L604 HydrophobicContact CD1-CD1 4.4Å; L583-L604 HydrophobicContact CD2-CD1 3.95Å; L599-L604 HydrophobicContact CD2-CB 3.65Å; L599-L604 HydrophobicContact CD2-CD1 4.32Å; L599-L604 PolarHBondContact O-N 2.84Å; Y602-L604 PolarHBondContact O-N 3.45Å; L604-I619 HydrophobicContact CD1-CD1 3.99Å
605	S	66.7	Low	78.1	Confident	64 Å²	64	64.9 Å²	64.9	45%	0.448	33%	0.332	S	S	.	.			trans	-54.1	139	166.8	169.1	0	0	0	0	109.7	L607 A608	S605-L607 PolarHBondContact O-N 2.94Å; S605-L607 PolarHBondContact OG-N 3.36Å; S605-A608 WeakPolarHBondContact O-CB 3.11Å; S605-A608 PolarHBondContact O-N 3.22Å
606	P	61.9	Low	78.2	Confident	89 Å²	89	64.1 Å²	64.1	58%	0.578	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.7	-16.7	177.1	-28.8	36.3	0	0	0	115.1	F609	P606-F609 WeakPolarHBondContact O-CE2 3.08Å; P606-F609 WeakPolarHBondContact O-CZ 3.35Å
607	L	59.6	Low	78.4	Confident	158 Å²	158	62 Å²	62	83%	0.827	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94	-10.3	176.1	-57.2	176	0	0	0	113.2	S605 F609	S605-L607 PolarHBondContact O-N 2.94Å; S605-L607 PolarHBondContact OG-N 3.36Å; L607-F609 PolarHBondContact O-N 3.32Å
608	A	65.3	Low	78.6	Confident	28 Å²	28	58.1 Å²	58.1	23%	0.231	31%	0.308	C	S	.	.			trans	-101.7	46.6	-165.4	0	0	0	0	0	114.1	P566 S605 K610	P566-A608 HydrophobicContact CB-CB 4.28Å; S605-A608 WeakPolarHBondContact O-CB 3.11Å; S605-A608 PolarHBondContact O-N 3.22Å; A608-K610 PolarHBondContact O-N 3.24Å
609	F	71	Confident	78.7	Confident	84 Å²	84	58 Å²	58	37%	0.368	31%	0.307	S	S	.	.			trans	-57.9	6.6	-177.3	-62.3	-75.9	0	0	0	117.2	S582 L583 F588 P606 L607	S582-F609 CarbonylContact C-O 3.52Å; S582-F609 VanDerWaalsContact CA-O 3.23Å; S582-F609 WeakPolarHBondContact CA-O 3.43Å; L583-F609 HydrophobicContact CD1-CD1 4.1Å; L583-F609 PolarHBondContact N-O 3.21Å; F588-F609 HydrophobicContact CE1-CD1 4.05Å; F588-F609 AromaticContact CE1-CE1 3.73Å; F588-F609 HydrophobicContact CE1-CE1 3.73Å; F588-F609 AromaticContact CZ-CD1 3.84Å; F588-F609 HydrophobicContact CZ-CD1 3.84Å; F588-F609 HydrophobicContact CZ-CE1 4.02Å; P606-F609 WeakPolarHBondContact O-CE2 3.08Å; P606-F609 WeakPolarHBondContact O-CZ 3.35Å; L607-F609 PolarHBondContact O-N 3.32Å
610	K	80	Confident	79	Confident	131 Å²	131	59.3 Å²	59.3	57%	0.57	31%	0.312	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-119.3	95.2	-169.2	-71	169.5	-175.7	160	0	112.3	P566 H580 K581 A608	P566-K610 WeakPolarHBondContact CD-O 3.4Å; P566-K610 VanDerWaalsContact CG-O 3.25Å; P566-K610 WeakPolarHBondContact CG-O 3.29Å; H580-K610 HydrophobicContact CB-CB 4.18Å; H580-K610 PolarHBondContact ND1-O 3.19Å; H580-K610 VanDerWaalsContact ND1-O 3.12Å; K581-K610 CarbonylContact O-C 3.45Å; K581-K610 VanDerWaalsContact O-CA 3.26Å; K581-K610 WeakPolarHBondContact O-CA 3.35Å; A608-K610 PolarHBondContact O-N 3.24Å
611	C	82.3	Confident	79.3	Confident	0 Å²	0	63 Å²	63	0%	0	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	158.4	-178.8	73.9	0	0	0	0	113.1	V567 H580 K581 C615 F616	V567-C611 HydrophobicContact CG2-CB 3.79Å; H580-C611 CarbonylContact C-O 3.45Å; H580-C611 VanDerWaalsContact CA-O 3.23Å; H580-C611 WeakPolarHBondContact CA-O 3.36Å; K581-C611 PolarHBondContact N-O 2.89Å; K581-C611 PolarHBondContact O-N 3.24Å; C611-C615 HydrophobicContact CB-CB 4.21Å; C611-F616 PolarHBondContact SG-N 3.14Å; C611-F616 VanDerWaalsContact SG-N 3.44Å
612	C	85.2	Confident	79.4	Confident	0 Å²	0	61.7 Å²	61.7	0%	0	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.4	154.3	179.8	78.4	0	0	0	0	112.6	C565 C570 C577 A614 C615 F616	C565-C612 HydrophobicContact CB-CB 4.22Å; C565-C612 PolarHBondContact SG-N 2.82Å; C570-C612 VanDerWaalsContact SG-SG 3.67Å; C577-C612 HydrophobicContact CB-CB 4.36Å; C612-A614 PolarHBondContact O-N 2.75Å; C612-C615 PolarHBondContact O-N 3.15Å; C612-F616 PolarHBondContact O-N 2.78Å
613	F	84	Confident	79.7	Confident	96 Å²	96	59.9 Å²	59.9	42%	0.421	30%	0.302	S	S	.	.	H	α-helix	trans	-54.1	-27.7	-178	-177.5	-124.4	0	0	0	114.6	E579 K581 F616 N617	E579-F613 PolarHBondContact O-N 3.3Å; K581-F613 HydrophobicContact CD-CD2 4.06Å; F613-F616 HydrophobicContact CD2-CD1 4.05Å; F613-F616 HydrophobicContact CE2-CD1 4.21Å; F613-N617 WeakPolarHBondContact CE1-ND2 3.32Å; F613-N617 VanDerWaalsContact CE2-ND2 3.32Å; F613-N617 WeakPolarHBondContact CE2-ND2 3.44Å; F613-N617 WeakPolarHBondContact CE2-OD1 3.33Å; F613-N617 WeakPolarHBondContact CZ-ND2 3.32Å; F613-N617 VanDerWaalsContact O-CG 3.27Å; F613-N617 PolarHBondContact O-N 3.41Å; F613-N617 VanDerWaalsContact O-N 3.17Å; F613-N617 PolarHBondContact O-ND2 3.32Å
614	A	83.5	Confident	80.2	Confident	33 Å²	33	57.9 Å²	57.9	27%	0.273	30%	0.295	S	S	.	.	H	α-helix	trans	-70.9	-41.5	174.8	0	0	0	0	0	112.6	A572 C612 K618	A572-A614 HydrophobicContact CB-CB 3.82Å; C612-A614 PolarHBondContact O-N 2.75Å; A614-K618 PolarHBondContact O-N 3.33Å
615	C	86.3	Confident	80.5	Confident	3 Å²	3	61.3 Å²	61.3	2%	0.02	31%	0.313	C	S	.	.	H	α-helix	trans	-73.8	-38.3	174.8	-66	0	0	0	0	111.7	V567 C611 C612 N617 K618 I619	V567-C615 HydrophobicContact CB-CB 4.22Å; V567-C615 HydrophobicContact CG1-CB 4.36Å; V567-C615 HydrophobicContact CG2-CB 3.87Å; C611-C615 HydrophobicContact CB-CB 4.21Å; C612-C615 PolarHBondContact O-N 3.15Å; C615-N617 VanDerWaalsContact C-N 3.26Å; C615-N617 PolarHBondContact O-N 3.42Å; C615-K618 WeakPolarHBondContact O-CA 3.19Å; C615-K618 WeakPolarHBondContact O-CB 3.3Å; C615-K618 PolarHBondContact O-N 3.38Å; C615-I619 WeakPolarHBondContact O-CB 3.26Å; C615-I619 WeakPolarHBondContact O-CG1 3.34Å; C615-I619 PolarHBondContact O-N 2.88Å
616	F	87.4	Confident	81.1	Confident	28 Å²	28	61.3 Å²	61.3	12%	0.123	31%	0.305	C	S	.	.	H	α-helix	trans	-50	-47.2	170.7	176.9	-92.5	0	0	0	111.5	K581 S582 P584 C611 C612 F613 I619 K620	K581-F616 HydrophobicContact CB-CD2 4Å; K581-F616 HydrophobicContact CB-CE2 4.41Å; K581-F616 HydrophobicContact CB-CG 4.41Å; K581-F616 HydrophobicContact CD-CD1 4.38Å; K581-F616 HydrophobicContact CD-CD2 4.43Å; K581-F616 HydrophobicContact CD-CG 4.34Å; S582-F616 WeakPolarHBondContact O-CD2 3.25Å; S582-F616 VanDerWaalsContact O-CE2 3.26Å; S582-F616 WeakPolarHBondContact O-CE2 3.29Å; P584-F616 HydrophobicContact CB-CE2 4.05Å; P584-F616 HydrophobicContact CB-CZ 4.23Å; P584-F616 HydrophobicContact CG-CD2 3.97Å; P584-F616 HydrophobicContact CG-CE2 3.71Å; P584-F616 HydrophobicContact CG-CZ 4.12Å; C611-F616 PolarHBondContact SG-N 3.14Å; C611-F616 VanDerWaalsContact SG-N 3.44Å; C612-F616 PolarHBondContact O-N 2.78Å; F613-F616 HydrophobicContact CD2-CD1 4.05Å; F613-F616 HydrophobicContact CE2-CD1 4.21Å; F616-I619 PolarHBondContact O-N 2.85Å; F616-K620 HydrophobicContact CE1-CD 4.15Å; F616-K620 HydrophobicContact CZ-CD 4.44Å; F616-K620 VanDerWaalsContact O-CB 3.24Å; F616-K620 WeakPolarHBondContact O-CB 3.37Å; F616-K620 PolarHBondContact O-N 2.9Å
617	N	86.2	Confident	81.9	Confident	70 Å²	70	59.1 Å²	59.1	37%	0.374	29%	0.289	S	S	.	.	H	α-helix	trans	-71.5	-30.6	177.7	-67.5	-30.7	0	0	0	113.6	F613 C615 K621	F613-N617 WeakPolarHBondContact CE1-ND2 3.32Å; F613-N617 VanDerWaalsContact CE2-ND2 3.32Å; F613-N617 WeakPolarHBondContact CE2-ND2 3.44Å; F613-N617 WeakPolarHBondContact CE2-OD1 3.33Å; F613-N617 WeakPolarHBondContact CZ-ND2 3.32Å; F613-N617 VanDerWaalsContact O-CG 3.27Å; F613-N617 PolarHBondContact O-N 3.41Å; F613-N617 VanDerWaalsContact O-N 3.17Å; F613-N617 PolarHBondContact O-ND2 3.32Å; C615-N617 VanDerWaalsContact C-N 3.26Å; C615-N617 PolarHBondContact O-N 3.42Å; N617-K621 VanDerWaalsContact O-CB 3.27Å; N617-K621 WeakPolarHBondContact O-CB 3.36Å; N617-K621 PolarHBondContact O-N 2.93Å
618	K	86.4	Confident	82.7	Confident	87 Å²	87	57.5 Å²	57.5	38%	0.378	28%	0.275	S	S	.	.	H	α-helix	trans	-63.8	-51.9	171	-72.2	-176.8	-177.2	-178	0	110.2	T571 A614 C615 K621 K622	T571-K618 PolarHBondContact OG1-NZ 3.49Å; A614-K618 PolarHBondContact O-N 3.33Å; C615-K618 WeakPolarHBondContact O-CA 3.19Å; C615-K618 WeakPolarHBondContact O-CB 3.3Å; C615-K618 PolarHBondContact O-N 3.38Å; K618-K621 PolarHBondContact O-N 2.86Å; K618-K622 PolarHBondContact O-N 3.08Å
619	I	86.2	Confident	82.9	Confident	2 Å²	2	62.4 Å²	62.4	1%	0.01	29%	0.291	C	S	.	.	H	α-helix	trans	-62.6	-50.8	-178.4	-66.1	162.7	0	0	0	110.1	V567 L583 P584 Y602 L604 C615 F616 K621 K622 I623	V567-I619 HydrophobicContact CG2-CD1 4.26Å; L583-I619 HydrophobicContact CD2-CD1 3.92Å; L583-I619 HydrophobicContact CD2-CG2 4.46Å; P584-I619 HydrophobicContact CG-CG2 4.39Å; Y602-I619 HydrophobicContact CD1-CG1 4.49Å; Y602-I619 HydrophobicContact CD2-CD1 4.33Å; Y602-I619 HydrophobicContact CD2-CG1 3.71Å; Y602-I619 HydrophobicContact CE1-CG1 4.46Å; Y602-I619 HydrophobicContact CE2-CB 4.49Å; Y602-I619 HydrophobicContact CE2-CG1 3.65Å; Y602-I619 HydrophobicContact CG-CD1 4.44Å; Y602-I619 HydrophobicContact CG-CG1 4.15Å; L604-I619 HydrophobicContact CD1-CD1 3.99Å; C615-I619 WeakPolarHBondContact O-CB 3.26Å; C615-I619 WeakPolarHBondContact O-CG1 3.34Å; C615-I619 PolarHBondContact O-N 2.88Å; F616-I619 PolarHBondContact O-N 2.85Å; I619-K621 VanDerWaalsContact C-N 3.3Å; I619-K621 PolarHBondContact O-N 3.08Å; I619-K622 PolarHBondContact O-N 3.48Å; I619-I623 HydrophobicContact CG2-CD1 3.63Å; I619-I623 HydrophobicContact CG2-CG1 4.34Å; I619-I623 WeakPolarHBondContact O-CG1 3.46Å; I619-I623 PolarHBondContact O-N 2.76Å
620	K	88.1	Confident	82.6	Confident	57 Å²	57	63.9 Å²	63.9	25%	0.248	30%	0.295	C	S	.	.	H	α-helix	trans	-56.2	-42.8	175.3	-164.8	-178.7	-179.7	80.8	0	111.9	P584 E586 F616 K622 I623 N624	P584-K620 HydrophobicContact CB-CB 4.15Å; P584-K620 HydrophobicContact CB-CD 4.44Å; P584-K620 HydrophobicContact CB-CG 3.99Å; P584-K620 HydrophobicContact CG-CB 3.6Å; P584-K620 HydrophobicContact CG-CG 4.02Å; E586-K620 IonicContact OE1-NZ 2.78Å; E586-K620 PolarHBondContact OE1-NZ 3.38Å; E586-K620 IonicContact OE2-NZ 3.5Å; E586-K620 PolarHBondContact OE2-NZ 3.4Å; F616-K620 HydrophobicContact CE1-CD 4.15Å; F616-K620 HydrophobicContact CZ-CD 4.44Å; F616-K620 VanDerWaalsContact O-CB 3.24Å; F616-K620 WeakPolarHBondContact O-CB 3.37Å; F616-K620 PolarHBondContact O-N 2.9Å; K620-K622 VanDerWaalsContact C-N 3.35Å; K620-K622 PolarHBondContact O-N 2.82Å; K620-I623 PolarHBondContact O-N 2.71Å; K620-N624 WeakPolarHBondContact O-CB 3.13Å; K620-N624 PolarHBondContact O-N 2.89Å; K620-N624 PolarHBondContact O-OD1 2.93Å
621	K	87.1	Confident	81.6	Confident	143 Å²	143	62 Å²	62	62%	0.622	29%	0.292	S	S	*	.	H	α-helix	trans	-64.6	-38.1	175.9	-172.1	176.1	179.8	-175.8	0	111.9	N617 K618 I619 N625	N617-K621 VanDerWaalsContact O-CB 3.27Å; N617-K621 WeakPolarHBondContact O-CB 3.36Å; N617-K621 PolarHBondContact O-N 2.93Å; K618-K621 PolarHBondContact O-N 2.86Å; I619-K621 VanDerWaalsContact C-N 3.3Å; I619-K621 PolarHBondContact O-N 3.08Å; K621-N625 WeakPolarHBondContact O-CB 3.17Å; K621-N625 VanDerWaalsContact O-CG 3.3Å; K621-N625 PolarHBondContact O-N 3.41Å; K621-N625 PolarHBondContact O-OD1 2.62Å
622	K	85.8	Confident	80.3	Confident	61 Å²	61	66.3 Å²	66.3	27%	0.265	31%	0.314	S	S	.	.	H	α-helix	trans	-69.6	-41.4	177.4	-156.5	176.3	-174	-175.2	0	112.1	L598 E601 K618 I619 K620 N625 F626	L598-K622 HydrophobicContact CD2-CD 3.95Å; L598-K622 HydrophobicContact CD2-CG 4.35Å; E601-K622 IonicContact OE1-NZ 2.6Å; E601-K622 PolarHBondContact OE1-NZ 3.43Å; E601-K622 IonicContact OE2-NZ 3.59Å; E601-K622 PolarHBondContact OE2-NZ 2.81Å; K618-K622 PolarHBondContact O-N 3.08Å; I619-K622 PolarHBondContact O-N 3.48Å; K620-K622 VanDerWaalsContact C-N 3.35Å; K620-K622 PolarHBondContact O-N 2.82Å; K622-N625 WeakPolarHBondContact O-CB 3.16Å; K622-N625 PolarHBondContact O-N 3.06Å; K622-F626 HydrophobicContact CD-CE2 3.97Å; K622-F626 HydrophobicContact CG-CD2 4.09Å; K622-F626 HydrophobicContact CG-CE2 3.79Å; K622-F626 VanDerWaalsContact O-CD2 3.28Å; K622-F626 WeakPolarHBondContact O-CD2 3.21Å; K622-F626 PolarHBondContact O-N 2.73Å
623	I	86.9	Confident	78.8	Confident	0 Å²	0	73.7 Å²	73.7	0%	0	35%	0.349	C	S	.	.	H	α-helix	trans	-58.9	-51.6	172.4	-63.6	158.5	0	0	0	110.5	P584 E586 F587 L590 L598 I619 K620 N625 F626 L627	P584-I623 HydrophobicContact CB-CD1 4.29Å; P584-I623 HydrophobicContact CG-CD1 4.02Å; E586-I623 HydrophobicContact CB-CG2 3.69Å; F587-I623 HydrophobicContact CB-CD1 3.69Å; F587-I623 HydrophobicContact CD2-CD1 4.06Å; F587-I623 HydrophobicContact CG-CD1 4.38Å; L590-I623 HydrophobicContact CD1-CB 4.47Å; L590-I623 HydrophobicContact CD1-CG1 4Å; L590-I623 HydrophobicContact CD1-CG2 4.06Å; L590-I623 HydrophobicContact CG-CG2 4.31Å; L598-I623 HydrophobicContact CD1-CG1 3.89Å; I619-I623 HydrophobicContact CG2-CD1 3.63Å; I619-I623 HydrophobicContact CG2-CG1 4.34Å; I619-I623 WeakPolarHBondContact O-CG1 3.46Å; I619-I623 PolarHBondContact O-N 2.76Å; K620-I623 PolarHBondContact O-N 2.71Å; I623-N625 VanDerWaalsContact C-N 3.25Å; I623-N625 PolarHBondContact O-N 3.06Å; I623-F626 PolarHBondContact O-N 3.47Å; I623-F626 VanDerWaalsContact O-N 3.09Å; I623-L627 HydrophobicContact CG2-CD1 3.79Å; I623-L627 HydrophobicContact CG2-CG 4.2Å; I623-L627 PolarHBondContact O-N 2.96Å
624	N	85.9	Confident	77.4	Confident	72 Å²	72	73.7 Å²	73.7	39%	0.385	36%	0.357	S	S	.	.	H	α-helix	trans	-63	-30.3	179.1	-74.4	39.2	0	0	0	112.8	K620 K628	K620-N624 WeakPolarHBondContact O-CB 3.13Å; K620-N624 PolarHBondContact O-N 2.89Å; K620-N624 PolarHBondContact O-OD1 2.93Å; N624-K628 WeakPolarHBondContact O-CB 3.11Å; N624-K628 PolarHBondContact O-N 2.54Å
625	N	84.2	Confident	75.8	Confident	82 Å²	82	76.1 Å²	76.1	44%	0.439	37%	0.371	S	S	.	.	H	α-helix	trans	-67.6	-48.1	170.9	-79.7	17.7	0	0	0	111.1	K621 K622 I623 K628 F629	K621-N625 WeakPolarHBondContact O-CB 3.17Å; K621-N625 VanDerWaalsContact O-CG 3.3Å; K621-N625 PolarHBondContact O-N 3.41Å; K621-N625 PolarHBondContact O-OD1 2.62Å; K622-N625 WeakPolarHBondContact O-CB 3.16Å; K622-N625 PolarHBondContact O-N 3.06Å; I623-N625 VanDerWaalsContact C-N 3.25Å; I623-N625 PolarHBondContact O-N 3.06Å; N625-K628 PolarHBondContact O-N 3.01Å; N625-F629 WeakPolarHBondContact O-CD2 3.35Å; N625-F629 PolarHBondContact O-N 2.67Å; N625-F629 VanDerWaalsContact O-N 3.14Å
626	F	80.1	Confident	73.6	Confident	63 Å²	63	82.6 Å²	82.6	28%	0.276	41%	0.406	S	S	.	.	H	α-helix	trans	-60.8	-48.2	176.8	-78	-57.8	0	0	0	112.1	L598 K622 I623 K628 F629 Y630	L598-F626 HydrophobicContact CD2-CE2 4.07Å; K622-F626 HydrophobicContact CD-CE2 3.97Å; K622-F626 HydrophobicContact CG-CD2 4.09Å; K622-F626 HydrophobicContact CG-CE2 3.79Å; K622-F626 VanDerWaalsContact O-CD2 3.28Å; K622-F626 WeakPolarHBondContact O-CD2 3.21Å; K622-F626 PolarHBondContact O-N 2.73Å; I623-F626 PolarHBondContact O-N 3.47Å; I623-F626 VanDerWaalsContact O-N 3.09Å; F626-K628 PolarHBondContact O-N 3.1Å; F626-F629 PolarHBondContact O-N 3.47Å; F626-F629 VanDerWaalsContact O-N 3.09Å; F626-Y630 WeakPolarHBondContact O-CD2 3.44Å; F626-Y630 PolarHBondContact O-N 3.22Å
627	L	78.8	Confident	71.3	Confident	44 Å²	44	88.8 Å²	88.8	23%	0.23	44%	0.44	C	S	.	.	H	α-helix	trans	-61.4	-29.6	175.7	-71.5	176.4	0	0	0	112.5	E586 L590 I623 N631	E586-L627 HydrophobicContact CB-CD1 4.03Å; E586-L627 HydrophobicContact CG-CD1 4.49Å; L590-L627 HydrophobicContact CD2-CD2 3.71Å; L590-L627 HydrophobicContact CD2-CG 4.01Å; I623-L627 HydrophobicContact CG2-CD1 3.79Å; I623-L627 HydrophobicContact CG2-CG 4.2Å; I623-L627 PolarHBondContact O-N 2.96Å; L627-N631 WeakPolarHBondContact O-CB 3.32Å; L627-N631 PolarHBondContact O-N 3.17Å; L627-N631 PolarHBondContact O-OD1 3.17Å
628	K	76.4	Confident	69.2	Low	123 Å²	123	91.2 Å²	91.2	54%	0.535	45%	0.449	S	S	.	.	H	α-helix	trans	-67.3	-46.3	171.6	-171.7	176.5	-164.3	-46	0	111.3	N624 N625 F626 Y630 N631 D632	N624-K628 WeakPolarHBondContact O-CB 3.11Å; N624-K628 PolarHBondContact O-N 2.54Å; N625-K628 PolarHBondContact O-N 3.01Å; F626-K628 PolarHBondContact O-N 3.1Å; K628-Y630 PolarHBondContact O-N 3.36Å; K628-N631 PolarHBondContact O-N 3.34Å; K628-D632 WeakPolarHBondContact CG-OD2 3.46Å; K628-D632 IonicContact NZ-OD1 2.71Å; K628-D632 PolarHBondContact NZ-OD1 3.4Å; K628-D632 IonicContact NZ-OD2 2.66Å; K628-D632 PolarHBondContact NZ-OD2 2.85Å; K628-D632 VanDerWaalsContact O-CB 3.23Å; K628-D632 WeakPolarHBondContact O-CB 3.31Å; K628-D632 PolarHBondContact O-N 3.09Å
629	F	69.2	Low	66.8	Low	132 Å²	132	93.1 Å²	93.1	58%	0.579	47%	0.47	S	S	*	.	H	α-helix	trans	-61.3	-42.9	176.9	-68.9	-65.5	0	0	0	112.3	N625 F626 E633	N625-F629 WeakPolarHBondContact O-CD2 3.35Å; N625-F629 PolarHBondContact O-N 2.67Å; N625-F629 VanDerWaalsContact O-N 3.14Å; F626-F629 PolarHBondContact O-N 3.47Å; F626-F629 VanDerWaalsContact O-N 3.09Å; F629-E633 WeakPolarHBondContact O-CG 3.45Å; F629-E633 PolarHBondContact O-N 2.88Å
630	Y	64.1	Low	64.2	Low	114 Å²	114	97.7 Å²	97.7	45%	0.447	50%	0.503	S	S	.	.	H	α-helix	trans	-67.1	-42.3	176	-86	-80.7	0	0	0	113.1	L594 F626 K628 E633 V634	L594-Y630 HydrophobicContact CD1-CD2 4.42Å; L594-Y630 HydrophobicContact CD1-CE2 3.63Å; F626-Y630 WeakPolarHBondContact O-CD2 3.44Å; F626-Y630 PolarHBondContact O-N 3.22Å; K628-Y630 PolarHBondContact O-N 3.36Å; Y630-E633 PolarHBondContact O-N 3.06Å; Y630-E633 VanDerWaalsContact O-N 3.15Å; Y630-V634 WeakPolarHBondContact O-CB 3.2Å; Y630-V634 WeakPolarHBondContact O-CG2 3.28Å; Y630-V634 PolarHBondContact O-N 3.14Å
631	N	59.6	Low	61.7	Low	93 Å²	93	99.4 Å²	99.4	50%	0.497	52%	0.522	S	S	.	.	H	α-helix	trans	-71.5	-33.5	179.2	-68	12.1	0	0	0	111.9	L627 K628 E633 S635	L627-N631 WeakPolarHBondContact O-CB 3.32Å; L627-N631 PolarHBondContact O-N 3.17Å; L627-N631 PolarHBondContact O-OD1 3.17Å; K628-N631 PolarHBondContact O-N 3.34Å; N631-E633 PolarHBondContact O-N 2.82Å; N631-S635 VanDerWaalsContact O-CB 3.26Å; N631-S635 WeakPolarHBondContact O-CB 3.47Å; N631-S635 PolarHBondContact O-N 3.26Å; N631-S635 PolarHBondContact O-OG 3.38Å
632	D	55.3	Low	59.1	Low	90 Å²	90	98.7 Å²	98.7	48%	0.481	54%	0.535	S	S	.	.	H	α-helix	trans	-68.5	-9.5	171.7	-66.6	-11.6	0	0	0	112.5	K628	K628-D632 WeakPolarHBondContact CG-OD2 3.46Å; K628-D632 IonicContact NZ-OD1 2.71Å; K628-D632 PolarHBondContact NZ-OD1 3.4Å; K628-D632 IonicContact NZ-OD2 2.66Å; K628-D632 PolarHBondContact NZ-OD2 2.85Å; K628-D632 VanDerWaalsContact O-CB 3.23Å; K628-D632 WeakPolarHBondContact O-CB 3.31Å; K628-D632 PolarHBondContact O-N 3.09Å
633	E	53.9	Low	57.1	Low	155 Å²	155	100.5 Å²	100.5	72%	0.724	55%	0.551	S	S	*	*	H	α-helix	trans	-112.5	-9.1	177.1	-74.8	-177.3	169.4	0	0	114.2	F629 Y630 N631	F629-E633 WeakPolarHBondContact O-CG 3.45Å; F629-E633 PolarHBondContact O-N 2.88Å; Y630-E633 PolarHBondContact O-N 3.06Å; Y630-E633 VanDerWaalsContact O-N 3.15Å; N631-E633 PolarHBondContact O-N 2.82Å
634	V	54.2	Low	55.2	Low	96 Å²	96	106.8 Å²	106.8	58%	0.582	58%	0.583	S	S	*	*	H	α-helix	trans	-128.6	1.6	-172.9	-176.7	0	0	0	0	113	Y630	Y630-V634 WeakPolarHBondContact O-CB 3.2Å; Y630-V634 WeakPolarHBondContact O-CG2 3.28Å; Y630-V634 PolarHBondContact O-N 3.14Å
635	S	49.5	Very low	53.9	Low	83 Å²	83	104.6 Å²	104.6	58%	0.58	58%	0.578	S	S	*	*	S	Bend	trans	-97.3	6.8	178.4	-49.1	0	0	0	0	114.6	N631	N631-S635 VanDerWaalsContact O-CB 3.26Å; N631-S635 WeakPolarHBondContact O-CB 3.47Å; N631-S635 PolarHBondContact O-N 3.26Å; N631-S635 PolarHBondContact O-OG 3.38Å
636	D	41.3	Very low	53.1	Low	139 Å²	139	108.3 Å²	108.3	74%	0.743	59%	0.592	S	S	*	*			trans	-93.2	9	-176.4	-77.1	-14.4	0	0	0	113.7	E638	D636-E638 PolarHBondContact O-N 2.93Å
637	D	37.3	Very low	53.3	Low	159 Å²	159	105.9 Å²	105.9	85%	0.85	58%	0.582	S	S	*	*			trans	-74.7	52.4	167.5	-76.2	-45	0	0	0	111.8
638	E	42.8	Very low	53.7	Low	121 Å²	121	106.3 Å²	106.3	57%	0.565	59%	0.586	S	S	*	*	S	Bend	trans	-136.3	118.6	171.3	-147.2	-64.1	141.1	0	0	107.1	D636 S640	D636-E638 PolarHBondContact O-N 2.93Å; E638-S640 PolarHBondContact O-N 3.45Å; E638-S640 WeakPolarHBondContact OE2-CB 3.44Å; E638-S640 PolarHBondContact OE2-N 3.09Å; E638-S640 PolarHBondContact OE2-OG 2.78Å
639	P	35.8	Very low	54.1	Low	126 Å²	126	108 Å²	108	82%	0.818	59%	0.593	S	S	*	*			trans	-77.5	47.4	-165	31.8	-37.2	0	0	0	114.3	S641	P639-S641 VanDerWaalsContact C-N 3.26Å; P639-S641 PolarHBondContact O-N 2.61Å
640	S	32.4	Very low	54.9	Low	99 Å²	99	106.5 Å²	106.5	69%	0.692	59%	0.591	S	S	*	*			trans	-75.5	63.5	-177.3	-86.1	0	0	0	0	114.2	E638	E638-S640 PolarHBondContact O-N 3.45Å; E638-S640 WeakPolarHBondContact OE2-CB 3.44Å; E638-S640 PolarHBondContact OE2-N 3.09Å; E638-S640 PolarHBondContact OE2-OG 2.78Å
641	S	34.8	Very low	56.1	Low	92 Å²	92	101.8 Å²	101.8	64%	0.643	57%	0.573	S	S	*	*			trans	66.2	117.6	163.7	-153.4	0	0	0	0	118	P639 T643	P639-S641 VanDerWaalsContact C-N 3.26Å; P639-S641 PolarHBondContact O-N 2.61Å; S641-T643 PolarHBondContact O-N 3.5Å; S641-T643 PolarHBondContact OG-OG1 3.05Å
642	S	33.6	Very low	57.5	Low	129 Å²	129	99.7 Å²	99.7	90%	0.902	56%	0.561	S	S	*	*	S	Bend	trans	-78.6	25.2	-176.1	47.7	0	0	0	0	115.3
643	T	42.8	Very low	58.9	Low	99 Å²	99	97.6 Å²	97.6	61%	0.607	55%	0.55	S	S	*	.			trans	-108.6	76.6	178.1	41.1	0	0	0	0	112	S641 G645	S641-T643 PolarHBondContact O-N 3.5Å; S641-T643 PolarHBondContact OG-OG1 3.05Å; T643-G645 PolarHBondContact O-N 3.28Å
644	I	48	Very low	60.5	Low	131 Å²	131	93.3 Å²	93.3	67%	0.672	53%	0.53	S	S	*	.			trans	-68.2	91.2	153.2	-60.9	177.8	0	0	0	106.3	H646	I644-H646 PolarHBondContact O-N 3.38Å
645	G	57.2	Low	62.2	Low	26 Å²	26	88.8 Å²	88.8	27%	0.268	50%	0.503	S	S	.	.			trans	-53.3	111.7	-178.8	0	0	0	0	0	110.6	T643 F647	T643-G645 PolarHBondContact O-N 3.28Å; G645-F647 WeakPolarHBondContact O-CD2 3.5Å; G645-F647 PolarHBondContact O-N 2.66Å
646	H	68.5	Low	64	Low	161 Å²	161	87 Å²	87	75%	0.745	48%	0.484	S	S	*	.			trans	-64.9	97.6	-173.8	174.4	-73.8	0	0	0	110.2	I644 T648	I644-H646 PolarHBondContact O-N 3.38Å; H646-T648 PolarHBondContact O-N 3.27Å
647	F	83.7	Confident	66.1	Low	12 Å²	12	84.7 Å²	84.7	5%	0.053	47%	0.471	C	S	.	.			trans	-59.9	109.2	175.6	-90.7	-99.9	0	0	0	109.8	G645 E651 Q652 L655 K677 E681 Y685	G645-F647 WeakPolarHBondContact O-CD2 3.5Å; G645-F647 PolarHBondContact O-N 2.66Å; F647-E651 VanDerWaalsContact CA-OE2 3.28Å; F647-E651 WeakPolarHBondContact CA-OE2 3.41Å; F647-E651 HydrophobicContact CD1-CB 3.94Å; F647-Q652 HydrophobicContact CB-CG 4.03Å; F647-Q652 PolarHBondContact O-NE2 2.86Å; F647-L655 HydrophobicContact CE1-CD2 4.07Å; F647-K677 HydrophobicContact CD2-CD 4.22Å; F647-K677 HydrophobicContact CE1-CD 4.13Å; F647-K677 HydrophobicContact CE1-CG 3.97Å; F647-K677 HydrophobicContact CE2-CD 3.69Å; F647-K677 HydrophobicContact CE2-CG 4.38Å; F647-K677 HydrophobicContact CZ-CB 4.27Å; F647-K677 HydrophobicContact CZ-CD 3.64Å; F647-K677 HydrophobicContact CZ-CG 3.81Å; F647-E681 HydrophobicContact CE2-CB 4.4Å; F647-Y685 HydrophobicContact CB-CD2 3.97Å; F647-Y685 HydrophobicContact CB-CE1 4.32Å; F647-Y685 HydrophobicContact CB-CE2 3.66Å; F647-Y685 HydrophobicContact CB-CG 4.41Å; F647-Y685 HydrophobicContact CD1-CD1 4.01Å; F647-Y685 HydrophobicContact CD1-CD2 4.47Å; F647-Y685 HydrophobicContact CD1-CE1 4.33Å; F647-Y685 HydrophobicContact CD1-CG 4.11Å; F647-Y685 HydrophobicContact CD2-CD1 4.26Å; F647-Y685 AromaticContact CD2-CD2 3.39Å; F647-Y685 HydrophobicContact CD2-CD2 3.39Å; F647-Y685 HydrophobicContact CD2-CE2 4.02Å; F647-Y685 AromaticContact CD2-CG 3.55Å; F647-Y685 HydrophobicContact CD2-CG 3.55Å; F647-Y685 HydrophobicContact CE1-CD1 4.25Å; F647-Y685 HydrophobicContact CE1-CG 4.27Å; F647-Y685 VanDerWaalsContact CE2-CB 3.47Å; F647-Y685 HydrophobicContact CE2-CD1 4.49Å; F647-Y685 AromaticContact CE2-CD2 3.97Å; F647-Y685 HydrophobicContact CE2-CD2 3.97Å; F647-Y685 AromaticContact CE2-CG 3.72Å; F647-Y685 HydrophobicContact CE2-CG 3.72Å; F647-Y685 HydrophobicContact CG-CD1 4.02Å; F647-Y685 AromaticContact CG-CD2 3.69Å; F647-Y685 HydrophobicContact CG-CD2 3.69Å; F647-Y685 HydrophobicContact CG-CE1 4.25Å; F647-Y685 AromaticContact CG-CE2 3.91Å; F647-Y685 HydrophobicContact CG-CE2 3.91Å; F647-Y685 AromaticContact CG-CG 3.76Å; F647-Y685 HydrophobicContact CG-CG 3.76Å; F647-Y685 HydrophobicContact CZ-CD1 4.48Å; F647-Y685 HydrophobicContact CZ-CG 4.08Å
648	T	86.8	Confident	68.6	Low	53 Å²	53	77.7 Å²	77.7	33%	0.325	43%	0.434	S	S	.	.			trans	-62.8	161.3	176	74.1	0	0	0	0	110.4	H646 D650 E651 Q652	H646-T648 PolarHBondContact O-N 3.27Å; T648-D650 PolarHBondContact O-N 3.41Å; T648-D650 VanDerWaalsContact O-N 3.15Å; T648-D650 PolarHBondContact OG1-N 3.23Å; T648-E651 PolarHBondContact N-OE2 3.08Å; T648-E651 PolarHBondContact O-N 2.9Å; T648-E651 VanDerWaalsContact O-N 3.17Å; T648-E651 WeakPolarHBondContact OG1-CG 3.42Å; T648-E651 PolarHBondContact OG1-N 3.32Å; T648-Q652 VanDerWaalsContact O-CG 3.27Å; T648-Q652 WeakPolarHBondContact O-CG 3.42Å; T648-Q652 PolarHBondContact O-N 2.78Å
649	K	84.8	Confident	70.7	Confident	157 Å²	157	72.1 Å²	72.1	68%	0.683	41%	0.408	S	S	*	.	H	α-helix	trans	-58.2	-30.8	177.9	-166.3	177.7	179.7	-174	0	111.5	Q652 N653	K649-Q652 WeakPolarHBondContact O-CB 3.48Å; K649-Q652 PolarHBondContact O-N 3.37Å; K649-N653 PolarHBondContact O-N 2.71Å; K649-N653 PolarHBondContact O-ND2 2.93Å; K649-N653 PolarHBondContact O-OD1 2.74Å
650	D	85.7	Confident	73.1	Confident	101 Å²	101	69.9 Å²	69.9	54%	0.54	39%	0.385	S	S	.	.	H	α-helix	trans	-79.2	-37.3	179.6	-45.8	-61.7	0	0	0	111.8	T648 Q652 N653 M654	T648-D650 PolarHBondContact O-N 3.41Å; T648-D650 VanDerWaalsContact O-N 3.15Å; T648-D650 PolarHBondContact OG1-N 3.23Å; D650-Q652 VanDerWaalsContact C-N 3.29Å; D650-Q652 PolarHBondContact O-N 3.4Å; D650-N653 WeakPolarHBondContact O-CB 3.41Å; D650-N653 PolarHBondContact O-N 3.08Å; D650-N653 VanDerWaalsContact O-N 3.16Å; D650-M654 WeakPolarHBondContact O-CG 3.14Å; D650-M654 PolarHBondContact O-N 2.67Å
651	E	89.8	Confident	75.4	Confident	15 Å²	15	69 Å²	69	7%	0.07	38%	0.38	C	S	.	.	H	α-helix	trans	-63.8	-34.2	168.6	-69.4	171.9	155.2	0	0	112.1	F647 T648 M654 L655 I674 K677	F647-E651 VanDerWaalsContact CA-OE2 3.28Å; F647-E651 WeakPolarHBondContact CA-OE2 3.41Å; F647-E651 HydrophobicContact CD1-CB 3.94Å; T648-E651 PolarHBondContact N-OE2 3.08Å; T648-E651 PolarHBondContact O-N 2.9Å; T648-E651 VanDerWaalsContact O-N 3.17Å; T648-E651 WeakPolarHBondContact OG1-CG 3.42Å; T648-E651 PolarHBondContact OG1-N 3.32Å; E651-M654 HydrophobicContact CG-CE 4.14Å; E651-L655 VanDerWaalsContact O-CB 3.23Å; E651-L655 WeakPolarHBondContact O-CB 3.47Å; E651-L655 PolarHBondContact O-N 3.31Å; E651-I674 HydrophobicContact CB-CG2 4.44Å; E651-I674 HydrophobicContact CG-CG2 4.43Å; E651-K677 IonicContact OE1-NZ 2.7Å; E651-K677 PolarHBondContact OE1-NZ 2.86Å; E651-K677 WeakPolarHBondContact OE2-CE 3.19Å; E651-K677 IonicContact OE2-NZ 2.81Å; E651-K677 PolarHBondContact OE2-NZ 3.24Å
652	Q	88.4	Confident	77.3	Confident	50 Å²	50	67 Å²	67	23%	0.234	37%	0.374	C	S	.	.	H	α-helix	trans	-68.9	-32.3	172.1	-65.7	171.8	41.1	0	0	112.5	F647 T648 K649 D650 R656 Y685	F647-Q652 HydrophobicContact CB-CG 4.03Å; F647-Q652 PolarHBondContact O-NE2 2.86Å; T648-Q652 VanDerWaalsContact O-CG 3.27Å; T648-Q652 WeakPolarHBondContact O-CG 3.42Å; T648-Q652 PolarHBondContact O-N 2.78Å; K649-Q652 WeakPolarHBondContact O-CB 3.48Å; K649-Q652 PolarHBondContact O-N 3.37Å; D650-Q652 VanDerWaalsContact C-N 3.29Å; D650-Q652 PolarHBondContact O-N 3.4Å; Q652-R656 WeakPolarHBondContact O-CG 3.49Å; Q652-R656 PolarHBondContact O-N 3.24Å; Q652-Y685 HydrophobicContact CG-CE1 3.91Å; Q652-Y685 WeakPolarHBondContact CG-OH 3.45Å; Q652-Y685 PolarHBondContact NE2-OH 3.16Å; Q652-Y685 PolarHBondContact OE1-OH 3.32Å
653	N	84.8	Confident	79	Confident	46 Å²	46	63.3 Å²	63.3	25%	0.246	35%	0.347	C	S	.	.	H	α-helix	trans	-71.5	-53.4	173	-65.3	-20.6	0	0	0	110.1	K649 D650 L655 R656 D657	K649-N653 PolarHBondContact O-N 2.71Å; K649-N653 PolarHBondContact O-ND2 2.93Å; K649-N653 PolarHBondContact O-OD1 2.74Å; D650-N653 WeakPolarHBondContact O-CB 3.41Å; D650-N653 PolarHBondContact O-N 3.08Å; D650-N653 VanDerWaalsContact O-N 3.16Å; N653-L655 VanDerWaalsContact C-N 3.3Å; N653-L655 PolarHBondContact O-N 3.04Å; N653-R656 CarbonylContact O-C 3.55Å; N653-R656 WeakPolarHBondContact O-CA 3.19Å; N653-R656 WeakPolarHBondContact O-CB 3.31Å; N653-R656 PolarHBondContact O-N 3.38Å; N653-R656 PolarHBondContact OD1-NH2 2.61Å; N653-D657 VanDerWaalsContact O-CG 3.25Å; N653-D657 PolarHBondContact O-N 3.02Å
654	M	87.3	Confident	80.7	Confident	65 Å²	65	58.8 Å²	58.8	32%	0.32	32%	0.32	S	S	.	.	H	α-helix	trans	-54.5	-43.2	176.2	-71.1	-175.4	-77.3	0	0	112.1	D650 E651 R656 D657 V658 I674 P675	D650-M654 WeakPolarHBondContact O-CG 3.14Å; D650-M654 PolarHBondContact O-N 2.67Å; E651-M654 HydrophobicContact CG-CE 4.14Å; M654-R656 PolarHBondContact O-N 3.14Å; M654-D657 PolarHBondContact O-N 3.12Å; M654-V658 VanDerWaalsContact O-CB 3.27Å; M654-V658 WeakPolarHBondContact O-CB 3.25Å; M654-V658 WeakPolarHBondContact O-CG2 3.34Å; M654-V658 PolarHBondContact O-N 3.11Å; M654-I674 HydrophobicContact CB-CG1 4.44Å; M654-P675 HydrophobicContact CE-CG 4.05Å
655	L	90	Very high	82.2	Confident	0 Å²	0	57.7 Å²	57.7	0%	0	32%	0.323	C	S	.	.	H	α-helix	trans	-62.7	-38.9	174.4	179.7	61.6	0	0	0	112.7	F647 E651 N653 L659 V670 I674 C682 Y685 A686 I693	F647-L655 HydrophobicContact CE1-CD2 4.07Å; E651-L655 VanDerWaalsContact O-CB 3.23Å; E651-L655 WeakPolarHBondContact O-CB 3.47Å; E651-L655 PolarHBondContact O-N 3.31Å; N653-L655 VanDerWaalsContact C-N 3.3Å; N653-L655 PolarHBondContact O-N 3.04Å; L655-L659 HydrophobicContact CD1-CD1 3.82Å; L655-L659 HydrophobicContact CD1-CG 4.19Å; L655-L659 HydrophobicContact CG-CD1 4.04Å; L655-L659 VanDerWaalsContact O-CB 3.31Å; L655-L659 WeakPolarHBondContact O-CB 3.39Å; L655-L659 WeakPolarHBondContact O-CD1 3.46Å; L655-L659 WeakPolarHBondContact O-CG 3.44Å; L655-L659 PolarHBondContact O-N 3.48Å; L655-V670 HydrophobicContact CD1-CG1 3.75Å; L655-I674 HydrophobicContact CB-CD1 3.8Å; L655-I674 HydrophobicContact CD1-CD1 3.55Å; L655-I674 HydrophobicContact CG-CD1 4.23Å; L655-C682 HydrophobicContact CD1-CB 4.38Å; L655-Y685 HydrophobicContact CD2-CD1 3.67Å; L655-Y685 HydrophobicContact CD2-CE1 4.37Å; L655-A686 HydrophobicContact CD2-CB 4.41Å; L655-I693 HydrophobicContact CD2-CD1 3.74Å; L655-I693 HydrophobicContact CG-CD1 4.43Å
656	R	88.3	Confident	83.6	Confident	47 Å²	47	58.1 Å²	58.1	18%	0.177	32%	0.322	C	S	.	.	H	α-helix	trans	-64.6	-51.6	172.7	-80.2	-169.9	-70.1	164.6	0.6	111	Q652 N653 M654 V658 L659 F660 I693	Q652-R656 WeakPolarHBondContact O-CG 3.49Å; Q652-R656 PolarHBondContact O-N 3.24Å; N653-R656 CarbonylContact O-C 3.55Å; N653-R656 WeakPolarHBondContact O-CA 3.19Å; N653-R656 WeakPolarHBondContact O-CB 3.31Å; N653-R656 PolarHBondContact O-N 3.38Å; N653-R656 PolarHBondContact OD1-NH2 2.61Å; M654-R656 PolarHBondContact O-N 3.14Å; R656-V658 VanDerWaalsContact C-N 3.35Å; R656-V658 PolarHBondContact O-N 3.34Å; R656-L659 CarbonylContact O-C 3.39Å; R656-L659 PolarHBondContact O-N 2.94Å; R656-L659 VanDerWaalsContact O-N 3.12Å; R656-F660 HydrophobicContact CB-CD2 4.15Å; R656-F660 HydrophobicContact CB-CE2 4.24Å; R656-F660 HydrophobicContact CG-CE2 4.41Å; R656-F660 WeakPolarHBondContact O-CB 3.35Å; R656-F660 WeakPolarHBondContact O-CD2 3.41Å; R656-F660 PolarHBondContact O-N 3.26Å; R656-I693 WeakPolarHBondContact CD-O 3.4Å; R656-I693 HydrophobicContact CG-CB 4.18Å; R656-I693 HydrophobicContact CG-CG1 4.26Å; R656-I693 HydrophobicContact CG-CG2 4.01Å; R656-I693 WeakPolarHBondContact CG-O 3.32Å
657	D	85.4	Confident	84.6	Confident	89 Å²	89	52.1 Å²	52.1	48%	0.476	29%	0.293	S	S	.	.	H	α-helix	trans	-65.3	-39	-172.9	-60.7	-28.7	0	0	0	111.5	N653 M654 F660 S661	N653-D657 VanDerWaalsContact O-CG 3.25Å; N653-D657 PolarHBondContact O-N 3.02Å; M654-D657 PolarHBondContact O-N 3.12Å; D657-F660 PolarHBondContact O-N 3.07Å; D657-S661 WeakPolarHBondContact O-CB 3.21Å; D657-S661 PolarHBondContact O-N 2.99Å; D657-S661 PolarHBondContact O-OG 3.37Å
658	V	89.2	Confident	84.9	Confident	12 Å²	12	56.1 Å²	56.1	7%	0.073	32%	0.315	C	S	.	.	H	α-helix	trans	-65.1	-40.8	172.9	171.8	0	0	0	0	111.8	M654 R656 C664 V670 R673	M654-V658 VanDerWaalsContact O-CB 3.27Å; M654-V658 WeakPolarHBondContact O-CB 3.25Å; M654-V658 WeakPolarHBondContact O-CG2 3.34Å; M654-V658 PolarHBondContact O-N 3.11Å; R656-V658 VanDerWaalsContact C-N 3.35Å; R656-V658 PolarHBondContact O-N 3.34Å; V658-C664 HydrophobicContact CG1-CB 4.47Å; V658-V670 HydrophobicContact CG1-CB 4.31Å; V658-V670 HydrophobicContact CG1-CG1 4.16Å; V658-V670 HydrophobicContact CG1-CG2 4.07Å; V658-R673 HydrophobicContact CG1-CB 4.44Å; V658-R673 HydrophobicContact CG2-CB 3.69Å; V658-R673 HydrophobicContact CG2-CG 4.37Å
659	L	87.6	Confident	84.9	Confident	5 Å²	5	56.9 Å²	56.9	3%	0.026	32%	0.315	C	S	.	.	H	α-helix	trans	-71.8	-29.5	175.9	-70.9	172.8	0	0	0	113.2	L655 R656 W667 V670 A686 I693 F694 F791	L655-L659 HydrophobicContact CD1-CD1 3.82Å; L655-L659 HydrophobicContact CD1-CG 4.19Å; L655-L659 HydrophobicContact CG-CD1 4.04Å; L655-L659 VanDerWaalsContact O-CB 3.31Å; L655-L659 WeakPolarHBondContact O-CB 3.39Å; L655-L659 WeakPolarHBondContact O-CD1 3.46Å; L655-L659 WeakPolarHBondContact O-CG 3.44Å; L655-L659 PolarHBondContact O-N 3.48Å; R656-L659 CarbonylContact O-C 3.39Å; R656-L659 PolarHBondContact O-N 2.94Å; R656-L659 VanDerWaalsContact O-N 3.12Å; L659-W667 HydrophobicContact CD2-CH2 4.36Å; L659-W667 HydrophobicContact CD2-CZ3 4.45Å; L659-V670 HydrophobicContact CD2-CG2 4.39Å; L659-A686 HydrophobicContact CD1-CB 4.42Å; L659-I693 HydrophobicContact CD1-CG2 3.78Å; L659-F694 HydrophobicContact CD1-CZ 4.14Å; L659-F791 HydrophobicContact CD2-CE2 4.07Å; L659-F791 HydrophobicContact CD2-CZ 3.61Å
660	F	85.5	Confident	85.1	Confident	78 Å²	78	49.4 Å²	49.4	34%	0.342	28%	0.282	S	S	.	.	H	α-helix	trans	-85.6	-27.2	176.9	-76.7	-61.1	0	0	0	113.6	R656 D657 G662 I693 F694	R656-F660 HydrophobicContact CB-CD2 4.15Å; R656-F660 HydrophobicContact CB-CE2 4.24Å; R656-F660 HydrophobicContact CG-CE2 4.41Å; R656-F660 WeakPolarHBondContact O-CB 3.35Å; R656-F660 WeakPolarHBondContact O-CD2 3.41Å; R656-F660 PolarHBondContact O-N 3.26Å; D657-F660 PolarHBondContact O-N 3.07Å; F660-G662 PolarHBondContact O-N 2.88Å; F660-G662 VanDerWaalsContact O-N 3.14Å; F660-I693 WeakPolarHBondContact CE2-O 3.05Å; F660-F694 HydrophobicContact CE1-CD1 4.49Å; F660-F694 HydrophobicContact CZ-CD1 4.27Å
661	S	81	Confident	85.3	Confident	82 Å²	82	45.2 Å²	45.2	57%	0.573	26%	0.262	S	S	*	.	S	Bend	trans	-66.3	-10.9	178.2	-66.8	0	0	0	0	114	D657 C663	D657-S661 WeakPolarHBondContact O-CB 3.21Å; D657-S661 PolarHBondContact O-N 2.99Å; D657-S661 PolarHBondContact O-OG 3.37Å; S661-C663 VanDerWaalsContact CB-SG 3.51Å; S661-C663 PolarHBondContact O-N 2.91Å
662	G	75.8	Confident	85.1	Confident	50 Å²	50	51.4 Å²	51.4	52%	0.515	30%	0.295	S	S	.	.			trans	67.5	5.9	176.8	0	0	0	0	0	115.2	F660	F660-G662 PolarHBondContact O-N 2.88Å; F660-G662 VanDerWaalsContact O-N 3.14Å
663	C	69.3	Low	85	Confident	50 Å²	50	55.3 Å²	55.3	34%	0.338	31%	0.308	S	S	.	.			trans	-95.7	4.9	-163.8	61.1	0	0	0	0	115.1	S661 R673	S661-C663 VanDerWaalsContact CB-SG 3.51Å; S661-C663 PolarHBondContact O-N 2.91Å; C663-R673 VanDerWaalsContact SG-CZ 3.51Å
664	C	78	Confident	85.1	Confident	5 Å²	5	53.3 Å²	53.3	3%	0.034	30%	0.297	C	S	.	.			trans	-125.5	127.2	-178.5	-64.5	0	0	0	0	111.3	V658 E669 V670	V658-C664 HydrophobicContact CG1-CB 4.47Å; C664-E669 WeakPolarHBondContact CA-OE2 3.38Å; C664-E669 HydrophobicContact CB-CB 3.83Å; C664-V670 HydrophobicContact CB-CG2 3.69Å
665	S	79.7	Confident	85	Confident	107 Å²	107	53.4 Å²	53.4	75%	0.748	30%	0.303	S	S	*	.	S	Bend	trans	-95.8	-34	-179.5	-56.5	0	0	0	0	112.8	E669	S665-E669 PolarHBondContact N-OE1 3.4Å; S665-E669 PolarHBondContact N-OE2 3.29Å
666	S	86.9	Confident	84.6	Confident	35 Å²	35	60.5 Å²	60.5	25%	0.245	34%	0.34	C	S	.	.	S	Bend	trans	-108	168.1	176.5	65.2	0	0	0	0	112.6	D668 E669 V670	S666-D668 VanDerWaalsContact C-N 3.25Å; S666-E669 VanDerWaalsContact CB-OE1 3.23Å; S666-E669 WeakPolarHBondContact CB-OE1 3.23Å; S666-E669 PolarHBondContact N-OE1 3.33Å; S666-E669 VanDerWaalsContact OG-CD 3.29Å; S666-E669 VanDerWaalsContact OG-CG 3.3Å; S666-E669 WeakPolarHBondContact OG-CG 3.42Å; S666-E669 PolarHBondContact OG-N 3.35Å; S666-E669 PolarHBondContact OG-OE1 2.93Å; S666-V670 WeakPolarHBondContact O-CG2 3.27Å
667	W	89.3	Confident	84.5	Confident	35 Å²	35	59.5 Å²	59.5	13%	0.133	34%	0.338	C	S	.	.	H	α-helix	trans	-77.4	-16.5	170.9	-74.1	93.9	0	0	0	112.4	L659 V670 A671 A679 C682 R683 A686 F791	L659-W667 HydrophobicContact CD2-CH2 4.36Å; L659-W667 HydrophobicContact CD2-CZ3 4.45Å; W667-V670 HydrophobicContact CE3-CB 4.48Å; W667-V670 HydrophobicContact CE3-CG1 4.42Å; W667-V670 WeakPolarHBondContact O-CB 3.48Å; W667-V670 PolarHBondContact O-N 2.82Å; W667-A671 PolarHBondContact O-N 3.13Å; W667-A679 HydrophobicContact CB-CB 3.97Å; W667-A679 WeakPolarHBondContact O-CB 3.45Å; W667-C682 HydrophobicContact CE3-CB 4.34Å; W667-R683 HydrophobicContact CD2-CB 3.68Å; W667-R683 HydrophobicContact CD2-CG 3.88Å; W667-R683 HydrophobicContact CE3-CB 3.74Å; W667-R683 HydrophobicContact CE3-CG 4.33Å; W667-R683 HydrophobicContact CG-CB 4.12Å; W667-R683 HydrophobicContact CG-CG 4.29Å; W667-R683 HydrophobicContact CZ2-CB 4.49Å; W667-R683 HydrophobicContact CZ2-CG 4.09Å; W667-R683 HydrophobicContact CZ3-CB 4.18Å; W667-A686 HydrophobicContact CH2-CB 3.64Å; W667-A686 HydrophobicContact CZ3-CB 3.82Å; W667-F791 HydrophobicContact CZ2-CD1 4.34Å; W667-F791 HydrophobicContact CZ2-CE1 4.28Å; W667-F791 HydrophobicContact CZ2-CZ 4.47Å; W667-F791 AromaticContact NE1-CD1 3.97Å
668	D	88.5	Confident	84.8	Confident	97 Å²	97	57.7 Å²	57.7	52%	0.519	33%	0.332	S	S	.	.	H	α-helix	trans	-78.4	-40.1	179	-45.6	-83.8	0	0	0	110.1	S666 V670 A671 N672 A679	S666-D668 VanDerWaalsContact C-N 3.25Å; D668-V670 PolarHBondContact O-N 2.89Å; D668-A671 PolarHBondContact O-N 2.87Å; D668-N672 WeakPolarHBondContact O-CB 3.35Å; D668-N672 PolarHBondContact O-N 3.29Å; D668-N672 PolarHBondContact O-OD1 3.39Å; D668-A679 WeakPolarHBondContact OD1-CB 3.2Å
669	E	87	Confident	84.8	Confident	68 Å²	68	58 Å²	58	32%	0.318	34%	0.336	S	S	.	.	H	α-helix	trans	-60.2	-31.2	165.9	-72.7	156.3	-101	0	0	113.1	C664 S665 S666	C664-E669 WeakPolarHBondContact CA-OE2 3.38Å; C664-E669 HydrophobicContact CB-CB 3.83Å; S665-E669 PolarHBondContact N-OE1 3.4Å; S665-E669 PolarHBondContact N-OE2 3.29Å; S666-E669 VanDerWaalsContact CB-OE1 3.23Å; S666-E669 WeakPolarHBondContact CB-OE1 3.23Å; S666-E669 PolarHBondContact N-OE1 3.33Å; S666-E669 VanDerWaalsContact OG-CD 3.29Å; S666-E669 VanDerWaalsContact OG-CG 3.3Å; S666-E669 WeakPolarHBondContact OG-CG 3.42Å; S666-E669 PolarHBondContact OG-N 3.35Å; S666-E669 PolarHBondContact OG-OE1 2.93Å
670	V	89.3	Confident	84.9	Confident	0 Å²	0	66.3 Å²	66.3	0%	0	37%	0.372	C	S	.	.	H	α-helix	trans	-73.3	-43.2	174.6	175	0	0	0	0	110.6	L655 V658 L659 C664 S666 W667 D668 R673 I674 C682	L655-V670 HydrophobicContact CD1-CG1 3.75Å; V658-V670 HydrophobicContact CG1-CB 4.31Å; V658-V670 HydrophobicContact CG1-CG1 4.16Å; V658-V670 HydrophobicContact CG1-CG2 4.07Å; L659-V670 HydrophobicContact CD2-CG2 4.39Å; C664-V670 HydrophobicContact CB-CG2 3.69Å; S666-V670 WeakPolarHBondContact O-CG2 3.27Å; W667-V670 HydrophobicContact CE3-CB 4.48Å; W667-V670 HydrophobicContact CE3-CG1 4.42Å; W667-V670 WeakPolarHBondContact O-CB 3.48Å; W667-V670 PolarHBondContact O-N 2.82Å; D668-V670 PolarHBondContact O-N 2.89Å; V670-R673 PolarHBondContact O-N 2.78Å; V670-I674 HydrophobicContact CG1-CD1 3.73Å; V670-I674 WeakPolarHBondContact O-CD1 3.45Å; V670-I674 WeakPolarHBondContact O-CG1 3.25Å; V670-C682 HydrophobicContact CG1-CB 4.23Å
671	A	89.7	Confident	85.1	Confident	14 Å²	14	65.6 Å²	65.6	12%	0.116	37%	0.369	C	S	.	.	H	α-helix	trans	-62.8	-42.2	176.2	0	0	0	0	0	112.4	W667 D668 R673 I674 A679	W667-A671 PolarHBondContact O-N 3.13Å; D668-A671 PolarHBondContact O-N 2.87Å; A671-R673 PolarHBondContact O-N 3.1Å; A671-I674 PolarHBondContact O-N 2.92Å; A671-A679 HydrophobicContact CB-CB 4.19Å
672	N	86.9	Confident	85.6	Confident	144 Å²	144	61.7 Å²	61.7	77%	0.77	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.2	-11.1	177.8	-69.5	-9.7	0	0	0	114.3	D668	D668-N672 WeakPolarHBondContact O-CB 3.35Å; D668-N672 PolarHBondContact O-N 3.29Å; D668-N672 PolarHBondContact O-OD1 3.39Å
673	R	85.5	Confident	86.3	Confident	133 Å²	133	64 Å²	64	50%	0.502	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108.9	-1.6	175.9	-63.8	-177.9	-175.9	-126.4	5.3	114	V658 C663 V670 A671	V658-R673 HydrophobicContact CG1-CB 4.44Å; V658-R673 HydrophobicContact CG2-CB 3.69Å; V658-R673 HydrophobicContact CG2-CG 4.37Å; C663-R673 VanDerWaalsContact SG-CZ 3.51Å; V670-R673 PolarHBondContact O-N 2.78Å; A671-R673 PolarHBondContact O-N 3.1Å
674	I	87.5	Confident	87.3	Confident	4 Å²	4	68 Å²	68	2%	0.021	34%	0.343	C	S	.	.	S	Bend	trans	-123.1	107.5	-178.3	-59.4	164.5	0	0	0	107.6	E651 M654 L655 V670 A671 N676 K677	E651-I674 HydrophobicContact CB-CG2 4.44Å; E651-I674 HydrophobicContact CG-CG2 4.43Å; M654-I674 HydrophobicContact CB-CG1 4.44Å; L655-I674 HydrophobicContact CB-CD1 3.8Å; L655-I674 HydrophobicContact CD1-CD1 3.55Å; L655-I674 HydrophobicContact CG-CD1 4.23Å; V670-I674 HydrophobicContact CG1-CD1 3.73Å; V670-I674 WeakPolarHBondContact O-CD1 3.45Å; V670-I674 WeakPolarHBondContact O-CG1 3.25Å; A671-I674 PolarHBondContact O-N 2.92Å; I674-N676 PolarHBondContact O-N 3.04Å; I674-K677 HydrophobicContact CB-CB 4.49Å; I674-K677 HydrophobicContact CG2-CB 3.89Å; I674-K677 HydrophobicContact CG2-CG 3.72Å
675	P	84.5	Confident	87.9	Confident	66 Å²	66	69.3 Å²	69.3	43%	0.429	35%	0.348	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.7	142.3	-175.3	25.7	-34.3	0	0	0	111	M654 K677	M654-P675 HydrophobicContact CE-CG 4.05Å; P675-K677 VanDerWaalsContact C-N 3.27Å; P675-K677 PolarHBondContact O-N 3.34Å
676	N	81.7	Confident	88.3	Confident	149 Å²	149	64.4 Å²	64.4	80%	0.797	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	56	33.7	173.7	-49.5	-39.1	0	0	0	114.8	I674	I674-N676 PolarHBondContact O-N 3.04Å
677	K	86.8	Confident	88.3	Confident	27 Å²	27	65.3 Å²	65.3	12%	0.117	32%	0.316	C	S	.	.			trans	-137.8	130	173.1	-60.3	-65.5	170.9	-64.4	0	111.8	F647 E651 I674 P675 C682	F647-K677 HydrophobicContact CD2-CD 4.22Å; F647-K677 HydrophobicContact CE1-CD 4.13Å; F647-K677 HydrophobicContact CE1-CG 3.97Å; F647-K677 HydrophobicContact CE2-CD 3.69Å; F647-K677 HydrophobicContact CE2-CG 4.38Å; F647-K677 HydrophobicContact CZ-CB 4.27Å; F647-K677 HydrophobicContact CZ-CD 3.64Å; F647-K677 HydrophobicContact CZ-CG 3.81Å; E651-K677 IonicContact OE1-NZ 2.7Å; E651-K677 PolarHBondContact OE1-NZ 2.86Å; E651-K677 WeakPolarHBondContact OE2-CE 3.19Å; E651-K677 IonicContact OE2-NZ 2.81Å; E651-K677 PolarHBondContact OE2-NZ 3.24Å; I674-K677 HydrophobicContact CB-CB 4.49Å; I674-K677 HydrophobicContact CG2-CB 3.89Å; I674-K677 HydrophobicContact CG2-CG 3.72Å; P675-K677 VanDerWaalsContact C-N 3.27Å; P675-K677 PolarHBondContact O-N 3.34Å; K677-C682 VanDerWaalsContact CB-SG 3.56Å
678	S	90.3	Very high	88.1	Confident	50 Å²	50	68.6 Å²	68.6	35%	0.35	33%	0.333	S	S	.	.			trans	-78.3	160.2	175.9	67.9	0	0	0	0	112.8	K680 E681 C682	S678-K680 PolarHBondContact O-N 3.3Å; S678-K680 VanDerWaalsContact O-N 3.14Å; S678-E681 WeakPolarHBondContact CB-OE2 3.39Å; S678-E681 PolarHBondContact N-OE2 3.41Å; S678-E681 PolarHBondContact O-N 3.34Å; S678-E681 WeakPolarHBondContact OG-CG 3Å; S678-E681 PolarHBondContact OG-N 2.72Å; S678-E681 PolarHBondContact OG-OE2 3.12Å; S678-C682 PolarHBondContact O-N 2.8Å; S678-C682 PolarHBondContact O-SG 3.38Å
679	A	90.3	Very high	87.9	Confident	20 Å²	20	66.2 Å²	66.2	17%	0.165	32%	0.32	C	S	.	.	H	α-helix	trans	-55.1	-31.8	172.7	0	0	0	0	0	112.8	W667 D668 A671 R683	W667-A679 HydrophobicContact CB-CB 3.97Å; W667-A679 WeakPolarHBondContact O-CB 3.45Å; D668-A679 WeakPolarHBondContact OD1-CB 3.2Å; A671-A679 HydrophobicContact CB-CB 4.19Å; A679-R683 WeakPolarHBondContact O-CB 3.42Å; A679-R683 PolarHBondContact O-N 3.23Å; A679-R683 VanDerWaalsContact O-N 3.07Å
680	K	89	Confident	87.7	Confident	178 Å²	178	68 Å²	68	77%	0.774	33%	0.327	S	S	*	.	H	α-helix	trans	-69.9	-43	176.1	-169.9	-177.6	178.5	-171.3	0	111.6	S678 R684	S678-K680 PolarHBondContact O-N 3.3Å; S678-K680 VanDerWaalsContact O-N 3.14Å; K680-R684 VanDerWaalsContact O-CB 3.27Å; K680-R684 WeakPolarHBondContact O-CB 3.23Å; K680-R684 PolarHBondContact O-N 2.96Å
681	E	89.5	Confident	87	Confident	63 Å²	63	70.3 Å²	70.3	29%	0.294	34%	0.343	S	S	.	.	H	α-helix	trans	-70.9	-47.1	178.4	-70.4	159	124.9	0	0	111.9	F647 S678 R683 R684 Y685	F647-E681 HydrophobicContact CE2-CB 4.4Å; S678-E681 WeakPolarHBondContact CB-OE2 3.39Å; S678-E681 PolarHBondContact N-OE2 3.41Å; S678-E681 PolarHBondContact O-N 3.34Å; S678-E681 WeakPolarHBondContact OG-CG 3Å; S678-E681 PolarHBondContact OG-N 2.72Å; S678-E681 PolarHBondContact OG-OE2 3.12Å; E681-R683 VanDerWaalsContact C-N 3.26Å; E681-R683 PolarHBondContact O-N 3.43Å; E681-R684 PolarHBondContact O-N 3.31Å; E681-R684 VanDerWaalsContact O-N 3.1Å; E681-Y685 WeakPolarHBondContact O-CB 3.45Å; E681-Y685 PolarHBondContact O-N 3.49Å
682	C	92	Very high	86.3	Confident	0 Å²	0	72.3 Å²	72.3	0%	0	35%	0.353	C	S	.	.	H	α-helix	trans	-55.6	-43.8	173.9	-66.8	0	0	0	0	111	L655 W667 V670 K677 S678 A686	L655-C682 HydrophobicContact CD1-CB 4.38Å; W667-C682 HydrophobicContact CE3-CB 4.34Å; V670-C682 HydrophobicContact CG1-CB 4.23Å; K677-C682 VanDerWaalsContact CB-SG 3.56Å; S678-C682 PolarHBondContact O-N 2.8Å; S678-C682 PolarHBondContact O-SG 3.38Å; C682-A686 WeakPolarHBondContact O-CB 3.04Å; C682-A686 PolarHBondContact O-N 3.19Å
683	R	91.3	Very high	85.9	Confident	98 Å²	98	65.5 Å²	65.5	37%	0.37	32%	0.317	S	S	.	.	H	α-helix	trans	-68.2	-37.8	175.7	-171.6	176.3	-175.4	-166.9	4.2	113	W667 A679 E681 N687	W667-R683 HydrophobicContact CD2-CB 3.68Å; W667-R683 HydrophobicContact CD2-CG 3.88Å; W667-R683 HydrophobicContact CE3-CB 3.74Å; W667-R683 HydrophobicContact CE3-CG 4.33Å; W667-R683 HydrophobicContact CG-CB 4.12Å; W667-R683 HydrophobicContact CG-CG 4.29Å; W667-R683 HydrophobicContact CZ2-CB 4.49Å; W667-R683 HydrophobicContact CZ2-CG 4.09Å; W667-R683 HydrophobicContact CZ3-CB 4.18Å; A679-R683 WeakPolarHBondContact O-CB 3.42Å; A679-R683 PolarHBondContact O-N 3.23Å; A679-R683 VanDerWaalsContact O-N 3.07Å; E681-R683 VanDerWaalsContact C-N 3.26Å; E681-R683 PolarHBondContact O-N 3.43Å; R683-N687 WeakPolarHBondContact O-CB 3.44Å; R683-N687 PolarHBondContact O-N 2.92Å; R683-N687 VanDerWaalsContact O-N 3.13Å; R683-N687 PolarHBondContact O-ND2 2.86Å
684	R	89.4	Confident	85.4	Confident	136 Å²	136	63.8 Å²	63.8	51%	0.513	31%	0.313	S	S	.	.	H	α-helix	trans	-64.7	-57.2	176.7	179.5	177.5	-177.9	170.6	6.9	110.2	K680 E681 A686 N687 E688	K680-R684 VanDerWaalsContact O-CB 3.27Å; K680-R684 WeakPolarHBondContact O-CB 3.23Å; K680-R684 PolarHBondContact O-N 2.96Å; E681-R684 PolarHBondContact O-N 3.31Å; E681-R684 VanDerWaalsContact O-N 3.1Å; R684-A686 VanDerWaalsContact C-N 3.33Å; R684-A686 PolarHBondContact O-N 3.46Å; R684-N687 WeakPolarHBondContact O-CA 3.38Å; R684-N687 PolarHBondContact O-N 3.28Å; R684-E688 VanDerWaalsContact CG-OE1 3.23Å; R684-E688 WeakPolarHBondContact CG-OE1 3.35Å; R684-E688 IonicContact CZ-OE1 2.94Å; R684-E688 IonicContact NE-OE1 3.06Å; R684-E688 PolarHBondContact NE-OE1 2.91Å; R684-E688 IonicContact NE-OE2 3.31Å; R684-E688 IonicContact NH2-OE1 2.61Å; R684-E688 PolarHBondContact O-N 3.15Å
685	Y	90.3	Very high	84.6	Confident	31 Å²	31	66.6 Å²	66.6	12%	0.122	33%	0.328	C	S	.	.	H	α-helix	trans	-60.2	-41.1	-179.9	-170.7	-88.3	0	0	0	111.9	F647 Q652 L655 E681 N687 E688 N689 I693	F647-Y685 HydrophobicContact CB-CD2 3.97Å; F647-Y685 HydrophobicContact CB-CE1 4.32Å; F647-Y685 HydrophobicContact CB-CE2 3.66Å; F647-Y685 HydrophobicContact CB-CG 4.41Å; F647-Y685 HydrophobicContact CD1-CD1 4.01Å; F647-Y685 HydrophobicContact CD1-CD2 4.47Å; F647-Y685 HydrophobicContact CD1-CE1 4.33Å; F647-Y685 HydrophobicContact CD1-CG 4.11Å; F647-Y685 HydrophobicContact CD2-CD1 4.26Å; F647-Y685 AromaticContact CD2-CD2 3.39Å; F647-Y685 HydrophobicContact CD2-CD2 3.39Å; F647-Y685 HydrophobicContact CD2-CE2 4.02Å; F647-Y685 AromaticContact CD2-CG 3.55Å; F647-Y685 HydrophobicContact CD2-CG 3.55Å; F647-Y685 HydrophobicContact CE1-CD1 4.25Å; F647-Y685 HydrophobicContact CE1-CG 4.27Å; F647-Y685 VanDerWaalsContact CE2-CB 3.47Å; F647-Y685 HydrophobicContact CE2-CD1 4.49Å; F647-Y685 AromaticContact CE2-CD2 3.97Å; F647-Y685 HydrophobicContact CE2-CD2 3.97Å; F647-Y685 AromaticContact CE2-CG 3.72Å; F647-Y685 HydrophobicContact CE2-CG 3.72Å; F647-Y685 HydrophobicContact CG-CD1 4.02Å; F647-Y685 AromaticContact CG-CD2 3.69Å; F647-Y685 HydrophobicContact CG-CD2 3.69Å; F647-Y685 HydrophobicContact CG-CE1 4.25Å; F647-Y685 AromaticContact CG-CE2 3.91Å; F647-Y685 HydrophobicContact CG-CE2 3.91Å; F647-Y685 AromaticContact CG-CG 3.76Å; F647-Y685 HydrophobicContact CG-CG 3.76Å; F647-Y685 HydrophobicContact CZ-CD1 4.48Å; F647-Y685 HydrophobicContact CZ-CG 4.08Å; Q652-Y685 HydrophobicContact CG-CE1 3.91Å; Q652-Y685 WeakPolarHBondContact CG-OH 3.45Å; Q652-Y685 PolarHBondContact NE2-OH 3.16Å; Q652-Y685 PolarHBondContact OE1-OH 3.32Å; L655-Y685 HydrophobicContact CD2-CD1 3.67Å; L655-Y685 HydrophobicContact CD2-CE1 4.37Å; E681-Y685 WeakPolarHBondContact O-CB 3.45Å; E681-Y685 PolarHBondContact O-N 3.49Å; Y685-N687 PolarHBondContact O-N 3.03Å; Y685-E688 PolarHBondContact O-N 3.17Å; Y685-N689 HydrophobicContact CD1-CB 4.32Å; Y685-N689 WeakPolarHBondContact CD2-ND2 3.34Å; Y685-N689 HydrophobicContact CE1-CB 3.88Å; Y685-N689 WeakPolarHBondContact CE2-ND2 3.36Å; Y685-N689 WeakPolarHBondContact O-CB 3.39Å; Y685-N689 PolarHBondContact O-N 2.91Å; Y685-I693 HydrophobicContact CD1-CD1 3.83Å; Y685-I693 HydrophobicContact CE1-CD1 3.89Å
686	A	89.3	Confident	83.2	Confident	4 Å²	4	67.6 Å²	67.6	3%	0.033	34%	0.336	C	S	.	.	H	α-helix	trans	-64.7	-23.3	173.1	0	0	0	0	0	114.2	L655 L659 W667 C682 R684 K690 I693	L655-A686 HydrophobicContact CD2-CB 4.41Å; L659-A686 HydrophobicContact CD1-CB 4.42Å; W667-A686 HydrophobicContact CH2-CB 3.64Å; W667-A686 HydrophobicContact CZ3-CB 3.82Å; C682-A686 WeakPolarHBondContact O-CB 3.04Å; C682-A686 PolarHBondContact O-N 3.19Å; R684-A686 VanDerWaalsContact C-N 3.33Å; R684-A686 PolarHBondContact O-N 3.46Å; A686-K690 WeakPolarHBondContact O-CG 3.37Å; A686-I693 HydrophobicContact CB-CD1 4.23Å
687	N	86.2	Confident	81.9	Confident	55 Å²	55	64.5 Å²	64.5	29%	0.294	32%	0.322	S	S	.	.	H	α-helix	trans	-88.7	-32	175.9	-85.8	-79.9	0	0	0	113.9	R683 R684 Y685 K690	R683-N687 WeakPolarHBondContact O-CB 3.44Å; R683-N687 PolarHBondContact O-N 2.92Å; R683-N687 VanDerWaalsContact O-N 3.13Å; R683-N687 PolarHBondContact O-ND2 2.86Å; R684-N687 WeakPolarHBondContact O-CA 3.38Å; R684-N687 PolarHBondContact O-N 3.28Å; Y685-N687 PolarHBondContact O-N 3.03Å; N687-K690 VanDerWaalsContact CA-CE 3.44Å; N687-K690 WeakPolarHBondContact O-CE 3.43Å; N687-K690 WeakPolarHBondContact O-CG 3.33Å; N687-K690 WeakPolarHBondContact OD1-CE 3.4Å; N687-K690 PolarHBondContact OD1-NZ 3.33Å
688	E	85.4	Confident	80.1	Confident	103 Å²	103	67.1 Å²	67.1	48%	0.481	34%	0.337	S	S	.	.	H	α-helix	trans	-76.4	-47.2	175.7	-68.9	163.4	172.5	0	0	110.6	R684 Y685 K690	R684-E688 VanDerWaalsContact CG-OE1 3.23Å; R684-E688 WeakPolarHBondContact CG-OE1 3.35Å; R684-E688 IonicContact CZ-OE1 2.94Å; R684-E688 IonicContact NE-OE1 3.06Å; R684-E688 PolarHBondContact NE-OE1 2.91Å; R684-E688 IonicContact NE-OE2 3.31Å; R684-E688 IonicContact NH2-OE1 2.61Å; R684-E688 PolarHBondContact O-N 3.15Å; Y685-E688 PolarHBondContact O-N 3.17Å; E688-K690 PolarHBondContact O-N 3.05Å
689	N	84.4	Confident	78	Confident	48 Å²	48	69.5 Å²	69.5	26%	0.257	35%	0.346	S	S	.	.	S	Bend	trans	-97	28.9	-173.6	-66.5	-72.1	0	0	0	114.5	Y685 S691 V692 I693	Y685-N689 HydrophobicContact CD1-CB 4.32Å; Y685-N689 WeakPolarHBondContact CD2-ND2 3.34Å; Y685-N689 HydrophobicContact CE1-CB 3.88Å; Y685-N689 WeakPolarHBondContact CE2-ND2 3.36Å; Y685-N689 WeakPolarHBondContact O-CB 3.39Å; Y685-N689 PolarHBondContact O-N 2.91Å; N689-S691 PolarHBondContact O-N 3.44Å; N689-V692 HydrophobicContact CB-CB 4.47Å; N689-V692 PolarHBondContact O-N 2.88Å; N689-I693 HydrophobicContact CB-CD1 4.13Å; N689-I693 PolarHBondContact O-N 2.78Å
690	K	82	Confident	75.6	Confident	106 Å²	106	72.9 Å²	72.9	46%	0.461	36%	0.364	S	S	.	.	H	α-helix	trans	-47.9	-40	179.3	-71.9	176.9	-171.9	178.5	0	113.6	A686 N687 E688 V692 F694	A686-K690 WeakPolarHBondContact O-CG 3.37Å; N687-K690 VanDerWaalsContact CA-CE 3.44Å; N687-K690 WeakPolarHBondContact O-CE 3.43Å; N687-K690 WeakPolarHBondContact O-CG 3.33Å; N687-K690 WeakPolarHBondContact OD1-CE 3.4Å; N687-K690 PolarHBondContact OD1-NZ 3.33Å; E688-K690 PolarHBondContact O-N 3.05Å; K690-V692 VanDerWaalsContact C-N 3.28Å; K690-V692 PolarHBondContact O-N 3Å; K690-F694 HydrophobicContact CB-CD2 4.4Å; K690-F694 WeakPolarHBondContact O-CB 2.83Å; K690-F694 WeakPolarHBondContact O-CD2 3.47Å; K690-F694 PolarHBondContact O-N 3.07Å
691	S	74.9	Confident	73.1	Confident	48 Å²	48	67.8 Å²	67.8	34%	0.336	35%	0.351	S	S	.	.	H	α-helix	trans	-79.5	-2.5	-178.3	59.8	0	0	0	0	115.1	R375 N689	R375-S691 PolarHBondContact NH1-OG 2.78Å; N689-S691 PolarHBondContact O-N 3.44Å
692	V	75.4	Confident	70.7	Confident	55 Å²	55	68.2 Å²	68.2	33%	0.333	37%	0.366	S	S	.	.	H	α-helix	trans	-106.7	-43.2	173.6	-175.9	0	0	0	0	109.1	N689 K690	N689-V692 HydrophobicContact CB-CB 4.47Å; N689-V692 PolarHBondContact O-N 2.88Å; K690-V692 VanDerWaalsContact C-N 3.28Å; K690-V692 PolarHBondContact O-N 3Å
693	I	78.4	Confident	68.1	Low	2 Å²	2	73.4 Å²	73.4	1%	0.01	40%	0.397	C	S	.	.	H	α-helix	trans	-68.1	-43.1	-179.6	-71.1	162.6	0	0	0	111.8	L655 R656 L659 F660 Y685 A686 N689	L655-I693 HydrophobicContact CD2-CD1 3.74Å; L655-I693 HydrophobicContact CG-CD1 4.43Å; R656-I693 WeakPolarHBondContact CD-O 3.4Å; R656-I693 HydrophobicContact CG-CB 4.18Å; R656-I693 HydrophobicContact CG-CG1 4.26Å; R656-I693 HydrophobicContact CG-CG2 4.01Å; R656-I693 WeakPolarHBondContact CG-O 3.32Å; L659-I693 HydrophobicContact CD1-CG2 3.78Å; F660-I693 WeakPolarHBondContact CE2-O 3.05Å; Y685-I693 HydrophobicContact CD1-CD1 3.83Å; Y685-I693 HydrophobicContact CE1-CD1 3.89Å; A686-I693 HydrophobicContact CB-CD1 4.23Å; N689-I693 HydrophobicContact CB-CD1 4.13Å; N689-I693 PolarHBondContact O-N 2.78Å
694	F	75.9	Confident	65.5	Low	97 Å²	97	76.2 Å²	76.2	43%	0.425	41%	0.414	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.8	23.1	-178.1	-57.5	-69.5	0	0	0	113.8	L659 F660 K690 C696	L659-F694 HydrophobicContact CD1-CZ 4.14Å; F660-F694 HydrophobicContact CE1-CD1 4.49Å; F660-F694 HydrophobicContact CZ-CD1 4.27Å; K690-F694 HydrophobicContact CB-CD2 4.4Å; K690-F694 WeakPolarHBondContact O-CB 2.83Å; K690-F694 WeakPolarHBondContact O-CD2 3.47Å; K690-F694 PolarHBondContact O-N 3.07Å; F694-C696 PolarHBondContact O-N 3.21Å
695	D	69.5	Low	63	Low	63 Å²	63	74.3 Å²	74.3	34%	0.337	42%	0.422	S	S	.	.			trans	-84.6	101.8	174.9	-157.5	-39	0	0	0	111.5	T697 L698	D695-T697 VanDerWaalsContact CG-OG1 3.31Å; D695-T697 PolarHBondContact O-N 3.22Å; D695-T697 VanDerWaalsContact O-N 3.14Å; D695-T697 WeakPolarHBondContact OD1-CB 3.1Å; D695-T697 WeakPolarHBondContact OD1-CG2 3.35Å; D695-T697 PolarHBondContact OD1-N 2.6Å; D695-T697 PolarHBondContact OD1-OG1 2.9Å; D695-L698 PolarHBondContact O-N 2.79Å
696	C	54.7	Low	60.5	Low	86 Å²	86	77.8 Å²	77.8	58%	0.581	45%	0.446	S	S	*	.	G	3₁₀ helix	trans	-65.1	-12.2	179.6	-54.9	0	0	0	0	114.2	F694 L698 L699	F694-C696 PolarHBondContact O-N 3.21Å; C696-L698 PolarHBondContact O-N 3.04Å; C696-L699 PolarHBondContact O-N 3.14Å
697	T	55.8	Low	57.9	Low	84 Å²	84	85.4 Å²	85.4	52%	0.515	48%	0.481	S	S	.	.	G	3₁₀ helix	trans	-70.1	-19.3	178.7	60.7	0	0	0	0	113.4	D695 T700	D695-T697 VanDerWaalsContact CG-OG1 3.31Å; D695-T697 PolarHBondContact O-N 3.22Å; D695-T697 VanDerWaalsContact O-N 3.14Å; D695-T697 WeakPolarHBondContact OD1-CB 3.1Å; D695-T697 WeakPolarHBondContact OD1-CG2 3.35Å; D695-T697 PolarHBondContact OD1-N 2.6Å; D695-T697 PolarHBondContact OD1-OG1 2.9Å; T697-T700 PolarHBondContact O-OG1 3.36Å
698	L	48.2	Very low	55.4	Low	82 Å²	82	91.3 Å²	91.3	43%	0.429	51%	0.506	S	S	.	.	G	3₁₀ helix	trans	-83.3	-9.8	176.4	-62.2	176	0	0	0	113.7	D695 C696 S701	D695-L698 PolarHBondContact O-N 2.79Å; C696-L698 PolarHBondContact O-N 3.04Å; L698-S701 PolarHBondContact O-OG 3.42Å
699	L	46.5	Very low	53.1	Low	101 Å²	101	95.1 Å²	95.1	53%	0.529	52%	0.524	S	S	.	.	G	3₁₀ helix	trans	-82.6	-18.7	173.8	-74.3	163.6	0	0	0	112.5	C696	C696-L699 PolarHBondContact O-N 3.14Å
700	T	39.4	Very low	50.6	Low	91 Å²	91	96.9 Å²	96.9	56%	0.558	55%	0.545	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.5	-32.3	178.1	14.9	0	0	0	0	113.4	T697 A702	T697-T700 PolarHBondContact O-OG1 3.36Å; T700-A702 VanDerWaalsContact C-N 3.26Å; T700-A702 PolarHBondContact O-N 3.14Å
701	S	37.1	Very low	48.4	Very low	71 Å²	71	100.3 Å²	100.3	50%	0.497	56%	0.563	S	S	.	*	T	Hydrogen-bonded Turn	trans	-76.1	-4.4	-174.2	54.4	0	0	0	0	115.3	L698	L698-S701 PolarHBondContact O-OG 3.42Å
702	A	37.7	Very low	46.4	Very low	72 Å²	72	105.4 Å²	105.4	60%	0.595	59%	0.586	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90	-1.9	-178.6	0	0	0	0	0	114.1	T700	T700-A702 VanDerWaalsContact C-N 3.26Å; T700-A702 PolarHBondContact O-N 3.14Å
703	V	39.3	Very low	44.4	Very low	109 Å²	109	111.6 Å²	111.6	66%	0.661	62%	0.617	S	S	*	*	T	Hydrogen-bonded Turn	trans	-115.2	-22.9	-175.2	-172.1	0	0	0	0	112.2	S705	V703-S705 VanDerWaalsContact C-N 3.3Å; V703-S705 PolarHBondContact O-N 3.06Å
704	E	36.1	Very low	42.3	Very low	157 Å²	157	114.6 Å²	114.6	73%	0.734	65%	0.649	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.4	-16.5	-178.2	-66.3	174.6	148.5	0	0	112.9
705	S	36.6	Very low	40.2	Very low	95 Å²	95	113.4 Å²	113.4	66%	0.664	66%	0.664	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.2	16.5	-177.4	68.7	0	0	0	0	115.3	V703	V703-S705 VanDerWaalsContact C-N 3.3Å; V703-S705 PolarHBondContact O-N 3.06Å
706	V	38.8	Very low	38.7	Very low	105 Å²	105	118.9 Å²	118.9	64%	0.636	69%	0.687	S	S	*	*	S	Bend	trans	-124	-6.9	-174	-169.2	0	0	0	0	112.6
707	H	33.8	Very low	37.9	Very low	164 Å²	164	126.1 Å²	126.1	76%	0.759	70%	0.702	S	S	*	*	S	Bend	trans	-95.9	-0.9	-173.3	-148.9	-55.5	0	0	0	114.8
708	E	33.9	Very low	36.9	Very low	179 Å²	179	130.3 Å²	130.3	84%	0.836	72%	0.722	S	S	*	*	S	Bend	trans	-104	10.3	-179.4	-64.9	-170.1	140.8	0	0	114.1
709	H	35.9	Very low	36.3	Very low	183 Å²	183	129.9 Å²	129.9	85%	0.847	74%	0.737	S	S	*	*	S	Bend	trans	-127.3	30.6	-178.9	-69.1	-19.2	0	0	0	113.4
710	A	32.6	Very low	35.8	Very low	84 Å²	84	130.6 Å²	130.6	69%	0.694	75%	0.751	S	S	*	*	S	Bend	trans	-114.9	0.8	-176.2	0	0	0	0	0	114.9
711	E	35.1	Very low	35.7	Very low	179 Å²	179	134.8 Å²	134.8	84%	0.836	76%	0.764	S	S	*	*	S	Bend	trans	-122.9	137.3	179.1	-65.2	-172.2	172.4	0	0	111.4
712	N	34.7	Very low	35.9	Very low	154 Å²	154	137 Å²	137	82%	0.824	78%	0.775	S	S	*	*			trans	59	63.2	171.2	-62.1	-15.9	0	0	0	118.3	G714	N712-G714 PolarHBondContact O-N 2.65Å; N712-G714 VanDerWaalsContact O-N 3.13Å
713	N	33.4	Very low	35.8	Very low	186 Å²	186	141.8 Å²	141.8	100%	0.995	79%	0.788	S	S	*	*			trans	-70.4	85.7	134.1	-89.8	-45.2	0	0	0	108.8
714	G	33.9	Very low	35.6	Very low	65 Å²	65	140.3 Å²	140.3	67%	0.67	80%	0.795	S	S	*	*			trans	-140.2	121.2	171.2	0	0	0	0	0	107.9	N712	N712-G714 PolarHBondContact O-N 2.65Å; N712-G714 VanDerWaalsContact O-N 3.13Å
715	G	32.4	Very low	35.4	Very low	72 Å²	72	137.5 Å²	137.5	74%	0.742	80%	0.799	S	S	*	*			trans	-96.8	-145.8	-162.9	0	0	0	0	0	115.2
716	E	36.1	Very low	35.4	Very low	178 Å²	178	138.2 Å²	138.2	83%	0.832	80%	0.801	S	S	*	*			trans	81.5	90.8	171.2	-49.3	-152.9	103.1	0	0	117.6
717	R	37.8	Very low	35.3	Very low	237 Å²	237	138.1 Å²	138.1	89%	0.894	81%	0.805	S	S	*	*				35.5	98.8	129.1	-66.6	174.7	169.1	167.3	-5.4	117.5	G719	R717-G719 PolarHBondContact O-N 2.9Å; R717-G719 VanDerWaalsContact O-N 3.16Å
718	N	35.5	Very low	35.5	Very low	172 Å²	172	138.6 Å²	138.6	92%	0.92	81%	0.808	S	S	*	*			trans	-71.5	102.3	149	-72.5	-22	0	0	0	109.1
719	G	36	Very low	35.8	Very low	74 Å²	74	135.5 Å²	135.5	76%	0.763	80%	0.797	S	S	*	*			trans	-84.6	145.6	158.6	0	0	0	0	0	109.9	R717	R717-G719 PolarHBondContact O-N 2.9Å; R717-G719 VanDerWaalsContact O-N 3.16Å
720	S	36.5	Very low	35.6	Very low	115 Å²	115	132.8 Å²	132.8	80%	0.804	79%	0.793	S	S	*	*			trans	-78.9	169	-176.9	-62.3	0	0	0	0	113.8
721	E	36.6	Very low	35.6	Very low	180 Å²	180	133.9 Å²	133.9	84%	0.841	79%	0.792	S	S	*	*			trans	88.1	148.5	157.7	-49.9	-162.4	125.2	0	0	120.4
722	T	40.9	Very low	35.3	Very low	117 Å²	117	131 Å²	131	72%	0.718	79%	0.786	S	S	*	*			trans	82.7	88.4	156.5	-13.6	0	0	0	0	119.8
723	I	35.7	Very low	35.3	Very low	172 Å²	172	129.6 Å²	129.6	88%	0.882	78%	0.783	S	S	*	*				35.8	121.8	121.6	-51.7	163.2	0	0	0	117.7
724	G	34.9	Very low	35.1	Very low	78 Å²	78	125.1 Å²	125.1	80%	0.804	77%	0.767	S	S	*	*			trans	154.8	125.8	152.7	0	0	0	0	0	115.3
725	A	32.6	Very low	34.9	Very low	98 Å²	98	126.2 Å²	126.2	81%	0.81	77%	0.77	S	S	*	*			trans	-123.1	173.4	163.5	0	0	0	0	0	108
726	P	37	Very low	35.1	Very low	110 Å²	110	131.6 Å²	131.6	71%	0.714	77%	0.773	S	S	*	*			cis	-130.9	178.3	-5.5	39.3	-22.1	0	0	0	114.4
727	S	36.3	Very low	34.8	Very low	103 Å²	103	130.7 Å²	130.7	72%	0.72	77%	0.774	S	S	*	*			trans	31.3	132.8	145.5	63.9	0	0	0	0	122.4
728	E	38.1	Very low	34.3	Very low	174 Å²	174	124.1 Å²	124.1	81%	0.813	77%	0.77	S	S	*	*			trans	-152.7	166	131.3	-119.2	-178.3	-129.4	0	0	114.1
729	N	39.5	Very low	33.9	Very low	114 Å²	114	124.8 Å²	124.8	61%	0.61	77%	0.767	S	S	*	*			trans	-3.8	130.7	177.4	32	71.3	0	0	0	122.7
730	T	31.2	Very low	33.5	Very low	126 Å²	126	126.9 Å²	126.9	77%	0.773	77%	0.768	S	S	*	*				64.5	134.3	82	-14.8	0	0	0	0	113.8
731	T	32.4	Very low	33.2	Very low	108 Å²	108	127.9 Å²	127.9	66%	0.663	77%	0.769	S	S	*	*			cis	-169.4	165.8	39	-38.9	0	0	0	0	113.4
732	T	30	Very low	32.9	Very low	118 Å²	118	124 Å²	124	72%	0.724	77%	0.767	S	S	*	*			trans	68.1	135.1	150.8	32.6	0	0	0	0	120.3
733	T	33.7	Very low	32.3	Very low	124 Å²	124	125.1 Å²	125.1	76%	0.761	77%	0.774	S	S	*	*			cis	-160.8	152.8	-4.8	-8.5	0	0	0	0	114.5
734	S	30.4	Very low	32	Very low	93 Å²	93	124.9 Å²	124.9	65%	0.65	77%	0.769	S	S	*	*			trans	30.4	106.9	145.9	-169.2	0	0	0	0	119.3
735	A	30	Very low	31.8	Very low	88 Å²	88	124.5 Å²	124.5	73%	0.727	75%	0.752	S	S	*	*				64.5	126.8	68.6	0	0	0	0	0	117.1
736	K	36.7	Very low	31.9	Very low	185 Å²	185	124.9 Å²	124.9	80%	0.804	75%	0.746	S	S	*	*			trans	-178.4	121.9	131.6	-97.5	157	-170.5	173.8	0	114.1
737	N	28	Very low	31.8	Very low	159 Å²	159	128.9 Å²	128.9	85%	0.85	75%	0.749	S	S	*	*			trans	31.2	138.6	137.8	-52.9	-5.1	0	0	0	123.7
738	A	27.8	Very low	31.8	Very low	99 Å²	99	128.7 Å²	128.7	82%	0.818	74%	0.743	S	S	*	*			trans	100.9	134.7	132.8	0	0	0	0	0	122.1
739	E	27.5	Very low	31.7	Very low	185 Å²	185	124.4 Å²	124.4	86%	0.864	73%	0.731	S	S	*	*			trans	57.4	146.3	165.3	-73.2	-150.8	100.3	0	0	122.6
740	P	27.6	Very low	31.5	Very low	118 Å²	118	125.2 Å²	125.2	77%	0.766	74%	0.735	S	S	*	*			trans	-94	133.6	-178.5	36.5	-32.2	0	0	0	112.9
741	V	31.1	Very low	31.6	Very low	137 Å²	137	126.6 Å²	126.6	83%	0.83	73%	0.726	S	S	*	*			trans	-124.6	133.1	172.8	-177.8	0	0	0	0	110.3
742	A	28.7	Very low	31.8	Very low	97 Å²	97	124.3 Å²	124.3	80%	0.802	72%	0.718	S	S	*	*			trans	-77.8	135.3	-172.8	0	0	0	0	0	113.2
743	V	28.8	Very low	32.3	Very low	142 Å²	142	122.9 Å²	122.9	86%	0.861	71%	0.709	S	S	*	*			trans	-117.5	148.9	169.6	-175.1	0	0	0	0	109.2
744	Q	29.8	Very low	32.4	Very low	167 Å²	167	122.5 Å²	122.5	78%	0.78	70%	0.702	S	S	*	*			trans	-75.8	145.9	-157.3	-64.9	-76.6	-23.2	0	0	114.5
745	P	30.5	Very low	33	Very low	70 Å²	70	122.8 Å²	122.8	46%	0.455	70%	0.696	S	S	.	*			trans	-67.5	149.5	171.5	28.6	-34.7	0	0	0	112.2	Y747	P745-Y747 HydrophobicContact CB-CD2 4.18Å; P745-Y747 HydrophobicContact CB-CE2 3.9Å; P745-Y747 HydrophobicContact CG-CD2 3.87Å; P745-Y747 HydrophobicContact CG-CE2 3.69Å; P745-Y747 PolarHBondContact O-N 2.82Å
746	P	34.4	Very low	33.4	Very low	106 Å²	106	121.2 Å²	121.2	69%	0.688	68%	0.683	S	S	*	*	S	Bend	trans	-77.3	43.8	-163	31.9	-38.4	0	0	0	115.9	T748	P746-T748 PolarHBondContact O-N 3.35Å
747	Y	35.1	Very low	33.7	Very low	194 Å²	194	118.8 Å²	118.8	76%	0.761	68%	0.678	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.5	0.5	170.6	-57.4	-59.2	0	0	0	113.6	P745	P745-Y747 HydrophobicContact CB-CD2 4.18Å; P745-Y747 HydrophobicContact CB-CE2 3.9Å; P745-Y747 HydrophobicContact CG-CD2 3.87Å; P745-Y747 HydrophobicContact CG-CE2 3.69Å; P745-Y747 PolarHBondContact O-N 2.82Å
748	T	36	Very low	34.3	Very low	98 Å²	98	116.1 Å²	116.1	60%	0.601	67%	0.671	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.5	-32.4	179	30.2	0	0	0	0	113.7	P746 L750 R751 A752	P746-T748 PolarHBondContact O-N 3.35Å; T748-L750 PolarHBondContact O-N 2.9Å; T748-R751 WeakPolarHBondContact O-CA 3.33Å; T748-R751 VanDerWaalsContact O-CB 3.25Å; T748-R751 WeakPolarHBondContact O-CB 3.4Å; T748-R751 PolarHBondContact O-N 2.81Å; T748-A752 PolarHBondContact O-N 3.19Å
749	C	37	Very low	34.4	Very low	84 Å²	84	115.5 Å²	115.5	57%	0.568	66%	0.661	S	S	*	*	H	α-helix	trans	-64.9	-36.5	-174.1	-59.1	0	0	0	0	113.2	R751 A752 V753	C749-R751 PolarHBondContact O-N 2.82Å; C749-A752 WeakPolarHBondContact O-CB 3.11Å; C749-A752 PolarHBondContact O-N 3.25Å; C749-A752 VanDerWaalsContact O-N 3.1Å; C749-V753 PolarHBondContact O-N 3.45Å; C749-V753 VanDerWaalsContact O-N 3.16Å
750	L	34.6	Very low	34.7	Very low	132 Å²	132	112.7 Å²	112.7	69%	0.691	66%	0.656	S	S	*	*	H	α-helix	trans	-63.5	-22.5	172	-72.1	171.7	0	0	0	113	T748 L754	T748-L750 PolarHBondContact O-N 2.9Å; L750-L754 WeakPolarHBondContact O-CB 3.27Å; L750-L754 WeakPolarHBondContact O-CG 3.49Å; L750-L754 PolarHBondContact O-N 2.78Å
751	R	34	Very low	35.1	Very low	155 Å²	155	115.9 Å²	115.9	59%	0.585	66%	0.661	S	S	*	*	H	α-helix	trans	-81.6	-30.7	174.3	-150.2	176.7	-164.6	171.9	4.4	111.8	T748 C749 N755	T748-R751 WeakPolarHBondContact O-CA 3.33Å; T748-R751 VanDerWaalsContact O-CB 3.25Å; T748-R751 WeakPolarHBondContact O-CB 3.4Å; T748-R751 PolarHBondContact O-N 2.81Å; C749-R751 PolarHBondContact O-N 2.82Å; R751-N755 VanDerWaalsContact O-CB 3.22Å; R751-N755 WeakPolarHBondContact O-CB 3.38Å; R751-N755 PolarHBondContact O-N 2.82Å; R751-N755 PolarHBondContact O-OD1 3.44Å
752	A	36.2	Very low	35	Very low	60 Å²	60	115.2 Å²	115.2	50%	0.496	66%	0.659	S	S	.	*	H	α-helix	trans	-65.8	-47.1	172.6	0	0	0	0	0	111.4	T748 C749 L754 N755 A756	T748-A752 PolarHBondContact O-N 3.19Å; C749-A752 WeakPolarHBondContact O-CB 3.11Å; C749-A752 PolarHBondContact O-N 3.25Å; C749-A752 VanDerWaalsContact O-N 3.1Å; A752-L754 PolarHBondContact O-N 2.58Å; A752-N755 PolarHBondContact O-N 3.46Å; A752-A756 WeakPolarHBondContact O-CB 3.36Å; A752-A756 PolarHBondContact O-N 3.39Å
753	V	40.2	Very low	35.1	Very low	88 Å²	88	116.2 Å²	116.2	53%	0.533	66%	0.655	S	S	.	*	H	α-helix	trans	-62.4	-44.2	177.4	178.8	0	0	0	0	111.7	C749 N755 A756 I757	C749-V753 PolarHBondContact O-N 3.45Å; C749-V753 VanDerWaalsContact O-N 3.16Å; V753-N755 VanDerWaalsContact C-N 3.34Å; V753-N755 PolarHBondContact O-N 2.96Å; V753-A756 PolarHBondContact O-N 3.05Å; V753-I757 HydrophobicContact CG1-CD1 4.06Å; V753-I757 WeakPolarHBondContact O-CG1 3.15Å; V753-I757 PolarHBondContact O-N 3.07Å; V753-I757 VanDerWaalsContact O-N 3.16Å
754	L	36.7	Very low	35	Very low	116 Å²	116	115.4 Å²	115.4	61%	0.607	65%	0.651	S	S	*	*	H	α-helix	trans	-70.5	-27.2	176.9	-73.1	171.5	0	0	0	113.5	L750 A752 S758	L750-L754 WeakPolarHBondContact O-CB 3.27Å; L750-L754 WeakPolarHBondContact O-CG 3.49Å; L750-L754 PolarHBondContact O-N 2.78Å; A752-L754 PolarHBondContact O-N 2.58Å; L754-S758 VanDerWaalsContact O-CB 3.3Å; L754-S758 WeakPolarHBondContact O-CB 3.4Å; L754-S758 PolarHBondContact O-N 2.96Å
755	N	42.9	Very low	35	Very low	98 Å²	98	113.7 Å²	113.7	52%	0.524	65%	0.652	S	S	.	*	H	α-helix	trans	-73.5	-40.7	171.8	-76.8	6.3	0	0	0	111.5	R751 A752 V753 I757 S758 S759	R751-N755 VanDerWaalsContact O-CB 3.22Å; R751-N755 WeakPolarHBondContact O-CB 3.38Å; R751-N755 PolarHBondContact O-N 2.82Å; R751-N755 PolarHBondContact O-OD1 3.44Å; A752-N755 PolarHBondContact O-N 3.46Å; V753-N755 VanDerWaalsContact C-N 3.34Å; V753-N755 PolarHBondContact O-N 2.96Å; N755-I757 VanDerWaalsContact C-N 3.33Å; N755-I757 PolarHBondContact O-N 3.22Å; N755-S758 CarbonylContact O-C 3.24Å; N755-S758 VanDerWaalsContact O-C 3.24Å; N755-S758 VanDerWaalsContact O-CA 3.32Å; N755-S758 WeakPolarHBondContact O-CA 3.49Å; N755-S758 WeakPolarHBondContact O-CB 3.36Å; N755-S758 PolarHBondContact O-N 2.95Å; N755-S759 WeakPolarHBondContact O-CB 3.31Å; N755-S759 PolarHBondContact O-N 3.27Å; N755-S759 PolarHBondContact O-OG 3.33Å
756	A	38.9	Very low	35.3	Very low	56 Å²	56	114.5 Å²	114.5	46%	0.463	66%	0.659	S	S	.	*	H	α-helix	trans	-62.9	-37.8	178.2	0	0	0	0	0	112.5	A752 V753 S758 S759	A752-A756 WeakPolarHBondContact O-CB 3.36Å; A752-A756 PolarHBondContact O-N 3.39Å; V753-A756 PolarHBondContact O-N 3.05Å; A756-S758 PolarHBondContact O-N 3.38Å; A756-S759 PolarHBondContact O-N 2.89Å; A756-S759 PolarHBondContact O-OG 3.06Å
757	I	41.5	Very low	35.4	Very low	134 Å²	134	117.2 Å²	117.2	69%	0.687	66%	0.663	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.8	-14.4	172.1	-63.2	165.7	0	0	0	111.7	V753 N755	V753-I757 HydrophobicContact CG1-CD1 4.06Å; V753-I757 WeakPolarHBondContact O-CG1 3.15Å; V753-I757 PolarHBondContact O-N 3.07Å; V753-I757 VanDerWaalsContact O-N 3.16Å; N755-I757 VanDerWaalsContact C-N 3.33Å; N755-I757 PolarHBondContact O-N 3.22Å
758	S	40.9	Very low	35.5	Very low	102 Å²	102	117.4 Å²	117.4	71%	0.713	67%	0.671	S	S	*	*	T	Hydrogen-bonded Turn	trans	-109.4	12.4	-179.7	-172.4	0	0	0	0	113.4	L754 N755 A756	L754-S758 VanDerWaalsContact O-CB 3.3Å; L754-S758 WeakPolarHBondContact O-CB 3.4Å; L754-S758 PolarHBondContact O-N 2.96Å; N755-S758 CarbonylContact O-C 3.24Å; N755-S758 VanDerWaalsContact O-C 3.24Å; N755-S758 VanDerWaalsContact O-CA 3.32Å; N755-S758 WeakPolarHBondContact O-CA 3.49Å; N755-S758 WeakPolarHBondContact O-CB 3.36Å; N755-S758 PolarHBondContact O-N 2.95Å; A756-S758 PolarHBondContact O-N 3.38Å
759	S	30.9	Very low	35.6	Very low	86 Å²	86	117.1 Å²	117.1	60%	0.601	68%	0.678	S	S	*	*			trans	-132.6	34.1	-175.4	73	0	0	0	0	113.6	N755 A756	N755-S759 WeakPolarHBondContact O-CB 3.31Å; N755-S759 PolarHBondContact O-N 3.27Å; N755-S759 PolarHBondContact O-OG 3.33Å; A756-S759 PolarHBondContact O-N 2.89Å; A756-S759 PolarHBondContact O-OG 3.06Å
760	V	32.5	Very low	35.7	Very low	126 Å²	126	118.6 Å²	118.6	76%	0.764	69%	0.687	S	S	*	*			trans	-121.1	77.6	176.8	-173.1	0	0	0	0	110.7
761	E	35.8	Very low	35.5	Very low	186 Å²	186	117.3 Å²	117.3	87%	0.869	69%	0.687	S	S	*	*			trans	-139.2	125.9	146.2	-73.1	-169.8	-168.9	0	0	105.5
762	P	29.6	Very low	35.5	Very low	122 Å²	122	118.5 Å²	118.5	79%	0.792	70%	0.7	S	S	*	*				-138.4	-174.9	89.8	28.4	-5.3	0	0	0	111.1
763	V	30.8	Very low	35.2	Very low	119 Å²	119	118.6 Å²	118.6	72%	0.721	71%	0.707	S	S	*	*			cis	-161.3	131	47.5	166.8	0	0	0	0	111.4
764	T	27.4	Very low	34.7	Very low	125 Å²	125	120.8 Å²	120.8	77%	0.767	72%	0.72	S	S	*	*			trans	14.8	145.3	153.2	71.3	0	0	0	0	121.7
765	T	30.3	Very low	34.2	Very low	130 Å²	130	123.1 Å²	123.1	80%	0.798	73%	0.727	S	S	*	*			cis	-136.1	-171.4	12.5	62.8	0	0	0	0	109.2
766	S	35.9	Very low	33.9	Very low	87 Å²	87	123.8 Å²	123.8	61%	0.608	74%	0.737	S	S	*	*			cis	-151.2	-164.1	0.5	59.3	0	0	0	0	108.1
767	E	37.1	Very low	33.4	Very low	164 Å²	164	127.4 Å²	127.4	77%	0.766	76%	0.759	S	S	*	*			cis	-159.9	137.8	-4	-137.1	149	121.7	0	0	108.2
768	E	36.6	Very low	32.9	Very low	198 Å²	198	125.9 Å²	125.9	93%	0.925	76%	0.761	S	S	*	*			trans	48.6	150.6	170	-62	-160.6	148.1	0	0	119.7
769	A	39	Very low	32.3	Very low	92 Å²	92	128.7 Å²	128.7	76%	0.76	77%	0.768	S	S	*	*			cis	-143.8	169.9	-1.2	0	0	0	0	0	110.4
770	P	38.4	Very low	32.3	Very low	115 Å²	115	136.3 Å²	136.3	75%	0.747	78%	0.783	S	S	*	*			trans	-119.1	-176.4	-155.1	42.9	-34.5	0	0	0	118.8
771	C	30.3	Very low	32.5	Very low	105 Å²	105	137 Å²	137	71%	0.709	79%	0.788	S	S	*	*			trans	89.6	140.3	173.8	-54.5	0	0	0	0	116.6
772	Q	33.5	Very low	32.2	Very low	180 Å²	180	132 Å²	132	84%	0.841	77%	0.773	S	S	*	*			cis	-166.9	169.4	-11.5	-110.3	175.1	77.4	0	0	107.2
773	G	29.9	Very low	32.4	Very low	62 Å²	62	132 Å²	132	64%	0.639	77%	0.774	S	S	*	*			cis	165.5	174.1	-2.4	0	0	0	0	0	112
774	V	30.7	Very low	32.5	Very low	134 Å²	134	136 Å²	136	81%	0.812	78%	0.781	S	S	*	*			trans	77.8	136.6	161.9	-177.2	0	0	0	0	120.7
775	E	26.5	Very low	32.6	Very low	164 Å²	164	135.5 Å²	135.5	77%	0.766	78%	0.78	S	S	*	*			trans	61.7	114	169.3	-75.6	-52.6	97.3	0	0	123.2
776	P	34.8	Very low	32.7	Very low	112 Å²	112	134.3 Å²	134.3	73%	0.727	78%	0.777	S	S	*	*			trans	-109.1	144.1	162.6	37.7	-27.5	0	0	0	113.6
777	S	30	Very low	32.4	Very low	132 Å²	132	141.5 Å²	141.5	92%	0.923	79%	0.791	S	S	*	*			trans	-143.4	149.2	162.9	-158.6	0	0	0	0	112.9
778	S	29.8	Very low	32.1	Very low	103 Å²	103	138.5 Å²	138.5	72%	0.72	78%	0.78	S	S	*	*			trans	-99.7	137.7	-160.2	-174.7	0	0	0	0	113.8
779	N	29.4	Very low	31.9	Very low	161 Å²	161	133.1 Å²	133.1	86%	0.861	76%	0.756	S	S	*	*			trans	-177.3	94	139.2	-100.9	-54.7	0	0	0	111
780	R	30.6	Very low	31.7	Very low	246 Å²	246	135.5 Å²	135.5	93%	0.928	75%	0.749	S	S	*	*			trans	-117.1	102.4	173.6	-80.4	-167	176	-160	2.2	112.5
781	T	35.6	Very low	31.4	Very low	141 Å²	141	132.7 Å²	132.7	87%	0.865	73%	0.725	S	S	*	*	P	Polyproline II helix	trans	-85.9	130.5	164.7	-61.4	0	0	0	0	110.1
782	S	29.2	Very low	31.4	Very low	80 Å²	80	131.7 Å²	131.7	56%	0.559	72%	0.724	S	S	*	*	P	Polyproline II helix	trans	-86.1	134.6	-173	-31	0	0	0	0	113.2
783	P	35.7	Very low	31.1	Very low	123 Å²	123	128.9 Å²	128.9	80%	0.799	71%	0.71	S	S	*	*	P	Polyproline II helix	trans	-84.2	154.3	170.5	33.9	-33.7	0	0	0	112.6
784	K	31.7	Very low	31.1	Very low	202 Å²	202	133.4 Å²	133.4	88%	0.878	71%	0.714	S	S	*	*	P	Polyproline II helix	trans	-79.6	147.7	174.7	-70.4	-171.7	175.3	-170.9	0	112
785	P	29.5	Very low	31.2	Very low	115 Å²	115	132.7 Å²	132.7	75%	0.747	71%	0.712	S	S	*	*	P	Polyproline II helix	trans	-70.5	158.7	179	30.1	-36.2	0	0	0	113
786	S	32.4	Very low	31.4	Very low	105 Å²	105	130.8 Å²	130.8	73%	0.734	72%	0.717	S	S	*	*			trans	-144.6	114.1	176	63	0	0	0	0	112.3
787	W	30.7	Very low	31.3	Very low	238 Å²	238	130.6 Å²	130.6	90%	0.902	72%	0.718	S	S	*	*			trans	-66.8	137.6	177	-50.9	97.6	0	0	0	112
788	N	30.7	Very low	31.4	Very low	100 Å²	100	130.8 Å²	130.8	54%	0.535	72%	0.716	S	S	.	*			trans	-154.1	58.6	-176.2	-157.6	-3.2	0	0	0	111.7	K790	N788-K790 WeakPolarHBondContact OD1-CE 3.13Å
789	M	32	Very low	31.5	Very low	85 Å²	85	132.3 Å²	132.3	42%	0.419	73%	0.725	S	S	.	*			trans	-76.6	119.8	-177.6	-162.9	170.1	-176.9	0	0	110.7	F791	M789-F791 HydrophobicContact CE-CE2 4.43Å; M789-F791 HydrophobicContact CE-CZ 4.1Å
790	K	34.8	Very low	31.7	Very low	143 Å²	143	129.5 Å²	129.5	62%	0.622	72%	0.724	S	S	*	*			trans	-115.6	89.5	-170.7	-75.3	176.6	179.8	168.5	0	112	E392 N788 A792	E392-K790 IonicContact OE1-NZ 2.67Å; E392-K790 PolarHBondContact OE1-NZ 2.6Å; N788-K790 WeakPolarHBondContact OD1-CE 3.13Å; K790-A792 PolarHBondContact O-N 2.67Å
791	F	32.3	Very low	31.7	Very low	56 Å²	56	127.1 Å²	127.1	25%	0.246	72%	0.721	C	S	.	*			trans	-62.9	116.3	163.5	-70.5	-77.3	0	0	0	110.1	L659 W667 M789 F793	L659-F791 HydrophobicContact CD2-CE2 4.07Å; L659-F791 HydrophobicContact CD2-CZ 3.61Å; W667-F791 HydrophobicContact CZ2-CD1 4.34Å; W667-F791 HydrophobicContact CZ2-CE1 4.28Å; W667-F791 HydrophobicContact CZ2-CZ 4.47Å; W667-F791 AromaticContact NE1-CD1 3.97Å; M789-F791 HydrophobicContact CE-CE2 4.43Å; M789-F791 HydrophobicContact CE-CZ 4.1Å; F791-F793 HydrophobicContact CB-CD2 4.19Å; F791-F793 HydrophobicContact CB-CE2 3.97Å; F791-F793 PolarHBondContact O-N 3.21Å; F791-F793 VanDerWaalsContact O-N 3.12Å
792	A	28.9	Very low	31.7	Very low	83 Å²	83	128 Å²	128	69%	0.686	72%	0.719	S	S	*	*			trans	-77.8	93.9	176.9	0	0	0	0	0	110.5	K790 H794	K790-A792 PolarHBondContact O-N 2.67Å; A792-H794 VanDerWaalsContact C-N 3.32Å; A792-H794 PolarHBondContact O-N 3.49Å
793	F	28.4	Very low	31.9	Very low	122 Å²	122	131 Å²	131	54%	0.535	73%	0.725	S	S	.	*			trans	-71.3	83.2	175.9	-83.6	-103.2	0	0	0	111.7	F791	F791-F793 HydrophobicContact CB-CD2 4.19Å; F791-F793 HydrophobicContact CB-CE2 3.97Å; F791-F793 PolarHBondContact O-N 3.21Å; F791-F793 VanDerWaalsContact O-N 3.12Å
794	H	29.3	Very low	31.5	Very low	157 Å²	157	134.4 Å²	134.4	73%	0.727	73%	0.729	S	S	*	*	P	Polyproline II helix	trans	-74.3	125.2	159.4	-78.5	-105.4	0	0	0	109.5	A792	A792-H794 VanDerWaalsContact C-N 3.32Å; A792-H794 PolarHBondContact O-N 3.49Å
795	P	32.6	Very low	31.6	Very low	119 Å²	119	132.2 Å²	132.2	77%	0.773	72%	0.723	S	S	*	*	P	Polyproline II helix	trans	-71.3	132.9	163	30.6	-31.6	0	0	0	108.8	S797	P795-S797 PolarHBondContact O-N 3.16Å
796	S	31.8	Very low	31.9	Very low	124 Å²	124	131.8 Å²	131.8	87%	0.867	73%	0.729	S	S	*	*	P	Polyproline II helix	trans	-79.3	116.9	-173.3	48.6	0	0	0	0	112.4
797	S	32.6	Very low	31.8	Very low	108 Å²	108	135.7 Å²	135.7	76%	0.755	74%	0.738	S	S	*	*			trans	-142.6	115.8	162.7	58	0	0	0	0	108.5	P795	P795-S797 PolarHBondContact O-N 3.16Å
798	P	30.7	Very low	31.8	Very low	135 Å²	135	128.7 Å²	128.7	88%	0.877	73%	0.73	S	S	*	*			trans	-81.2	142.1	-172.8	32	-34.6	0	0	0	112.6
799	C	31.6	Very low	31.8	Very low	136 Å²	136	131.4 Å²	131.4	92%	0.919	75%	0.745	S	S	*	*			trans	-149	154.6	154.9	-154.6	0	0	0	0	108.4
800	A	34.3	Very low	31.8	Very low	101 Å²	101	133.7 Å²	133.7	84%	0.835	76%	0.764	S	S	*	*			trans	-81.2	165.6	-154.6	0	0	0	0	0	116.3
801	K	29.8	Very low	31.6	Very low	197 Å²	197	131.9 Å²	131.9	86%	0.857	77%	0.769	S	S	*	*			trans	-79	162.8	174.7	-59.2	177.7	178.4	-179.7	0	112.3
802	L	36	Very low	31.4	Very low	158 Å²	158	133.8 Å²	133.8	83%	0.827	80%	0.795	S	S	*	*			trans	152.7	134.8	145.9	-84.3	168.4	0	0	0	106.9
803	Q	33.6	Very low	31.6	Very low	145 Å²	145	134.2 Å²	134.2	68%	0.678	80%	0.799	S	S	*	*			cis	-156	145.9	-13.8	-175.3	167.4	-13.5	0	0	106.1	E805	Q803-E805 PolarHBondContact NE2-OE2 3.1Å
804	E	28.2	Very low	31.7	Very low	193 Å²	193	133.6 Å²	133.6	90%	0.902	81%	0.805	S	S	*	*			trans	-128.3	80.1	-172.4	-172.7	173.6	-159.8	0	0	111
805	E	33.3	Very low	31.9	Very low	157 Å²	157	133.9 Å²	133.9	73%	0.734	80%	0.804	S	S	*	*			trans	-141	93.7	-178.2	-71.1	178.7	123.4	0	0	111.4	Q803	Q803-E805 PolarHBondContact NE2-OE2 3.1Å
806	A	35.2	Very low	31.9	Very low	106 Å²	106	137.6 Å²	137.6	88%	0.876	80%	0.803	S	S	*	*			trans	-174.7	100.3	155.7	0	0	0	0	0	109.7
807	M	30.5	Very low	31.8	Very low	187 Å²	187	137.4 Å²	137.4	92%	0.921	79%	0.792	S	S	*	*			trans	-100.6	151.9	170.2	-71.3	-169.2	-179.2	0	0	111.4
808	A	30.6	Very low	31.8	Very low	91 Å²	91	136.7 Å²	136.7	75%	0.752	78%	0.784	S	S	*	*			trans	69.3	158.5	159.3	0	0	0	0	0	118.7
809	N	30.8	Very low	31.7	Very low	156 Å²	156	136.6 Å²	136.6	83%	0.834	78%	0.775	S	S	*	*			trans	66.6	150	-173	-59	-22	0	0	0	114.6
810	T	32.8	Very low	31.7	Very low	134 Å²	134	133.8 Å²	133.8	82%	0.822	76%	0.757	S	S	*	*			cis	-145.5	163.5	-15.5	-109.5	0	0	0	0	109.9
811	S	30	Very low	31.8	Very low	104 Å²	104	138.7 Å²	138.7	73%	0.727	75%	0.754	S	S	*	*			trans	-105.8	161.9	-169.7	61.8	0	0	0	0	116
812	A	29	Very low	31.8	Very low	97 Å²	97	139.4 Å²	139.4	80%	0.802	75%	0.752	S	S	*	*			trans	72.6	160.2	168.8	0	0	0	0	0	115.6
813	A	33.2	Very low	31.6	Very low	92 Å²	92	136.7 Å²	136.7	76%	0.76	75%	0.746	S	S	*	*			cis	-130	140	5.6	0	0	0	0	0	110
814	T	30.4	Very low	31.5	Very low	108 Å²	108	134.7 Å²	134.7	66%	0.663	74%	0.744	S	S	*	*				84.2	128.9	51.6	-66.6	0	0	0	0	113.3
815	K	32.9	Very low	31.5	Very low	164 Å²	164	131.9 Å²	131.9	71%	0.713	74%	0.735	S	S	*	*			trans	71.7	158.5	178.4	-67.9	154.6	-173.1	166	0	112.9
816	R	32	Very low	31.4	Very low	196 Å²	196	130.5 Å²	130.5	74%	0.74	74%	0.737	S	S	*	*			cis	-166.1	168.2	-2	-114.3	166	-170.7	164.4	-3.8	106.5
817	N	30.6	Very low	31.1	Very low	120 Å²	120	129.9 Å²	129.9	64%	0.642	73%	0.727	S	S	*	*			cis	-154.7	141.7	-7.8	-144.6	26.3	0	0	0	110
818	T	31.8	Very low	30.8	Very low	94 Å²	94	130.1 Å²	130.1	58%	0.577	72%	0.723	S	S	*	*			trans	53.1	151.9	131.6	56.4	0	0	0	0	125.5
819	D	29.6	Very low	30.9	Very low	132 Å²	132	132.3 Å²	132.3	71%	0.706	73%	0.727	S	S	*	*			trans	71.6	154.2	140.3	-85.2	-48.2	0	0	0	118.1
820	S	31.6	Very low	31.3	Very low	77 Å²	77	130 Å²	130	54%	0.538	72%	0.723	S	S	.	*			cis	-159.8	166.4	-17.8	-127.2	0	0	0	0	105.3
821	R	35.2	Very low	31.6	Very low	204 Å²	204	128.5 Å²	128.5	77%	0.77	72%	0.716	S	S	*	*			cis	-149.4	144.3	14.2	-117.6	129.2	-148.6	-138.4	3.4	106.5
822	R	31.3	Very low	31.6	Very low	212 Å²	212	131.1 Å²	131.1	80%	0.8	71%	0.714	S	S	*	*				62	91.3	86.9	-149.9	178.6	-153.5	-92.5	2.3	112
823	S	31.4	Very low	31.6	Very low	101 Å²	101	132.2 Å²	132.2	71%	0.706	71%	0.707	S	S	*	*				83.7	169.6	103.9	-51.9	0	0	0	0	112.2
824	T	30.8	Very low	31.6	Very low	104 Å²	104	134.9 Å²	134.9	64%	0.638	71%	0.713	S	S	*	*			cis	-148.2	173.2	6.5	-20.9	0	0	0	0	109.2
825	D	28.7	Very low	31.8	Very low	134 Å²	134	132.8 Å²	132.8	72%	0.717	71%	0.713	S	S	*	*			trans	3.4	144.2	141.6	-46.1	-19	0	0	0	117.6
826	T	30.7	Very low	31.8	Very low	127 Å²	127	130.9 Å²	130.9	78%	0.779	72%	0.72	S	S	*	*				-167.6	154.3	70.9	31.9	0	0	0	0	115.3
827	S	28.3	Very low	31.5	Very low	94 Å²	94	127.2 Å²	127.2	66%	0.657	73%	0.725	S	S	*	*			trans	57.6	141.4	142.6	63	0	0	0	0	123.8
828	F	25.7	Very low	31.5	Very low	191 Å²	191	124.5 Å²	124.5	84%	0.838	73%	0.725	S	S	*	*				4.7	137.8	128.7	-54.7	-101	0	0	0	116.6
829	T	32.6	Very low	31.3	Very low	137 Å²	137	127.2 Å²	127.2	84%	0.84	74%	0.741	S	S	*	*				-161.8	172	62.4	39.4	0	0	0	0	113.8
830	S	39	Very low	31.2	Very low	108 Å²	108	124.3 Å²	124.3	76%	0.755	74%	0.736	S	S	*	*			trans	-125.4	175.6	156.9	-142.1	0	0	0	0	106.3
831	P	38.7	Very low	31.1	Very low	102 Å²	102	126.4 Å²	126.4	66%	0.662	75%	0.745	S	S	*	*			cis	-144.2	-155.1	2.1	36.1	-11.4	0	0	0	114
832	K	30.5	Very low	30.7	Very low	159 Å²	159	123.9 Å²	123.9	69%	0.691	75%	0.746	S	S	*	*			trans	88.9	141.6	135.2	-96.9	176.9	148.1	-90.5	0	123.7
833	D	29.1	Very low	30.6	Very low	121 Å²	121	120 Å²	120	65%	0.647	74%	0.741	S	S	*	*			trans	62.4	152.3	151.7	-49.9	-26.2	0	0	0	117.3
834	V	33.5	Very low	30.4	Very low	147 Å²	147	122 Å²	122	89%	0.891	74%	0.739	S	S	*	*			cis	-149.2	155.7	44.3	170.2	0	0	0	0	112.6
835	G	34.5	Very low	30.6	Very low	64 Å²	64	124.4 Å²	124.4	66%	0.66	75%	0.748	S	S	*	*			trans	104.7	113	168.7	0	0	0	0	0	113.7
836	S	31.2	Very low	30.7	Very low	125 Å²	125	122 Å²	122	87%	0.874	75%	0.746	S	S	*	*			cis	60.6	131.7	32.3	-78.3	0	0	0	0	114.6
837	S	27.5	Very low	30.7	Very low	119 Å²	119	121 Å²	121	83%	0.832	75%	0.745	S	S	*	*			cis	-161.4	-175.8	-7.1	66.4	0	0	0	0	110.5
838	G	29.9	Very low	31.1	Very low	62 Å²	62	123.3 Å²	123.3	64%	0.639	75%	0.754	S	S	*	*			trans	112.5	120.3	173.4	0	0	0	0	0	112.4
839	V	28.1	Very low	31.3	Very low	151 Å²	151	117.1 Å²	117.1	92%	0.915	74%	0.744	S	S	*	*			cis	70.8	123.4	49.4	179.8	0	0	0	0	111.6
840	A	27.7	Very low	31.3	Very low	72 Å²	72	121.7 Å²	121.7	60%	0.595	75%	0.746	S	S	*	*			cis	-166.5	-166	-15.6	0	0	0	0	0	108.4
841	T	28.5	Very low	31.1	Very low	120 Å²	120	126.1 Å²	126.1	74%	0.736	76%	0.755	S	S	*	*			trans	69.7	128.1	156.3	42.1	0	0	0	0	116.2
842	L	27.5	Very low	30.8	Very low	151 Å²	151	126.1 Å²	126.1	79%	0.791	76%	0.758	S	S	*	*				59.4	139.9	74.6	-56.4	-178.8	0	0	0	111.7
843	L	28.5	Very low	30.8	Very low	132 Å²	132	122.1 Å²	122.1	69%	0.691	75%	0.754	S	S	*	*			cis	-144.1	178.3	22.5	-162.9	57.3	0	0	0	112.9
844	E	27.9	Very low	31.1	Very low	143 Å²	143	121.3 Å²	121.3	67%	0.668	75%	0.753	S	S	*	*			trans	-48	154	171.7	-57.2	146.3	130	0	0	114.6
845	N	34.7	Very low	30.9	Very low	154 Å²	154	120.5 Å²	120.5	82%	0.824	74%	0.741	S	S	*	*				-179.4	114	119.2	-90.7	-36	0	0	0	107.3
846	A	29.5	Very low	30.6	Very low	82 Å²	82	121.6 Å²	121.6	68%	0.678	74%	0.738	S	S	*	*				50.1	120.7	57.7	0	0	0	0	0	110.3
847	S	31.9	Very low	30.8	Very low	108 Å²	108	120.9 Å²	120.9	76%	0.755	73%	0.729	S	S	*	*			cis	-166.4	171.2	49.1	48.6	0	0	0	0	112
848	V	35.5	Very low	31	Very low	141 Å²	141	120.3 Å²	120.3	86%	0.855	73%	0.725	S	S	*	*			trans	38.3	128.7	145.5	178.6	0	0	0	0	118.6
849	G	31.3	Very low	31.5	Very low	61 Å²	61	122.3 Å²	122.3	63%	0.629	73%	0.727	S	S	*	*			cis	120.9	100	11.3	0	0	0	0	0	112.4
850	R	31.6	Very low	31.7	Very low	234 Å²	234	119.6 Å²	119.6	88%	0.883	71%	0.714	S	S	*	*			trans	46.8	102.5	163.6	-64.7	-177.4	176.9	-174.7	-0.4	118.4
851	Q	35.3	Very low	31.9	Very low	200 Å²	200	124.4 Å²	124.4	94%	0.935	73%	0.725	S	S	*	*				172.9	163.2	127.7	-93.1	151.4	109.1	0	0	107.1
852	S	31.6	Very low	32.1	Very low	103 Å²	103	122.6 Å²	122.6	72%	0.72	71%	0.713	S	S	*	*			cis	175.5	133.6	-28.7	178.1	0	0	0	0	105.3
853	A	32.1	Very low	32.3	Very low	74 Å²	74	122 Å²	122	61%	0.612	71%	0.706	S	S	*	*			trans	66.9	160.1	-178.6	0	0	0	0	0	114.2
854	V	33.8	Very low	32.6	Very low	104 Å²	104	117.5 Å²	117.5	63%	0.63	69%	0.686	S	S	*	*			cis	-159.4	141	-15.4	116.8	0	0	0	0	110.1	A1025	V854-A1025 VanDerWaalsContact O-CB 3.25Å; V854-A1025 WeakPolarHBondContact O-CB 3.23Å
855	M	30	Very low	32.8	Very low	131 Å²	131	113.3 Å²	113.3	65%	0.645	67%	0.672	S	S	*	*			trans	52.4	147.4	159.4	-66.8	177	62.9	0	0	122.8	A1025	M855-A1025 WeakPolarHBondContact O-CB 3.33Å
856	S	29.6	Very low	32.8	Very low	86 Å²	86	109.8 Å²	109.8	60%	0.601	66%	0.66	S	S	*	*			trans	24.3	136.7	141.9	-43	0	0	0	0	120.4
857	T	33.4	Very low	32.9	Very low	110 Å²	110	112.4 Å²	112.4	68%	0.675	66%	0.656	S	S	*	*			cis	-157.3	175.2	44.3	42.8	0	0	0	0	113.5
858	S	33.3	Very low	32.8	Very low	107 Å²	107	111.3 Å²	111.3	75%	0.748	64%	0.642	S	S	*	*			trans	-104.1	-170.6	167.2	61.5	0	0	0	0	110.5
859	P	40	Very low	32.7	Very low	105 Å²	105	107.7 Å²	107.7	68%	0.682	63%	0.627	S	S	*	*			cis	-135.4	-148.5	-5.1	41.1	-20.3	0	0	0	113.3
860	S	31.8	Very low	32.7	Very low	93 Å²	93	116 Å²	116	65%	0.65	64%	0.639	S	S	*	*			trans	69.3	144.1	151.8	51	0	0	0	0	119.2
861	E	31.4	Very low	33.1	Very low	173 Å²	173	110.1 Å²	110.1	81%	0.808	63%	0.631	S	S	*	*			cis	-168.3	-179.2	1.6	-124.6	166.3	-156.1	0	0	113.3
862	V	34.2	Very low	33	Very low	82 Å²	82	108.2 Å²	108.2	50%	0.497	63%	0.626	S	S	.	*			trans	63.9	99.9	149.8	163.6	0	0	0	0	116.6
863	E	31.6	Very low	33.1	Very low	139 Å²	139	108.8 Å²	108.8	65%	0.65	63%	0.629	S	S	*	*				109.9	174.6	81.5	-97.5	-166.5	-150.2	0	0	110.9	N1034	E863-N1034 PolarHBondContact O-OD1 2.91Å; E863-N1034 VanDerWaalsContact O-OD1 3.13Å
864	S	33.5	Very low	33.3	Very low	38 Å²	38	109 Å²	109	27%	0.266	64%	0.639	S	S	.	*			cis	-157.2	139.2	-10.3	-126.2	0	0	0	0	113	N1034 L1035	S864-N1034 PolarHBondContact N-OD1 2.93Å; S864-L1035 PolarHBondContact O-N 3.23Å
865	S	33.4	Very low	33.3	Very low	54 Å²	54	107.5 Å²	107.5	38%	0.378	64%	0.644	S	S	.	*			trans	58.2	151.3	132.9	155.2	0	0	0	0	122.5	S1036	S865-S1036 PolarHBondContact O-N 3.3Å; S865-S1036 WeakPolarHBondContact OG-CA 3.19Å; S865-S1036 PolarHBondContact OG-N 3.4Å; S865-S1036 VanDerWaalsContact OG-N 3.07Å; S865-S1036 PolarHBondContact OG-OG 2.71Å
866	S	34.6	Very low	33.5	Very low	81 Å²	81	107.5 Å²	107.5	57%	0.566	66%	0.656	S	S	*	*			cis	-174.2	-158.5	-14.7	-77.6	0	0	0	0	107.7
867	F	30.5	Very low	33.7	Very low	137 Å²	137	107.4 Å²	107.4	60%	0.601	66%	0.656	S	S	*	*			cis	-169.6	155.4	1.4	-130	-29.9	0	0	0	112.3	A1037	F867-A1037 HydrophobicContact CB-CB 4.39Å; F867-A1037 HydrophobicContact CD2-CB 3.95Å
868	N	31	Very low	33.8	Very low	85 Å²	85	106.1 Å²	106.1	46%	0.455	65%	0.651	S	S	.	*			trans	73.8	152.3	143.3	-71.9	-16.5	0	0	0	124.4	P1038	N868-P1038 HydrophobicContact CB-CB 4.26Å; N868-P1038 VanDerWaalsContact ND2-CB 3.34Å; N868-P1038 WeakPolarHBondContact ND2-CB 3.27Å
869	A	31.9	Very low	33.8	Very low	64 Å²	64	105.9 Å²	105.9	53%	0.529	64%	0.64	S	S	.	*			cis	-162.6	-179.3	-8.3	0	0	0	0	0	115.9
870	R	32.6	Very low	33.6	Very low	237 Å²	237	103.8 Å²	103.8	89%	0.894	63%	0.628	S	S	*	*			trans	-149.4	-160.7	-176.9	-60.7	-172.8	177.4	-176.8	-1.1	111.4
871	P	38.8	Very low	33.8	Very low	110 Å²	110	103.2 Å²	103.2	71%	0.714	62%	0.624	S	S	*	*			cis	-144.8	-146.9	0.1	36.9	-9	0	0	0	116.8
872	I	33.8	Very low	33.9	Very low	160 Å²	160	99.5 Å²	99.5	82%	0.821	61%	0.607	S	S	*	*			trans	83.5	149.9	164.6	-63.7	161.6	0	0	0	117
873	S	34.7	Very low	34	Very low	114 Å²	114	101.7 Å²	101.7	80%	0.797	62%	0.62	S	S	*	*			cis	-147.5	-169.3	-4.3	45.6	0	0	0	0	110.1
874	G	34.7	Very low	34.1	Very low	79 Å²	79	98.8 Å²	98.8	81%	0.814	63%	0.628	S	S	*	*			cis	120.6	132.6	-6.3	0	0	0	0	0	115.1
875	G	35.5	Very low	34.1	Very low	72 Å²	72	103.3 Å²	103.3	74%	0.742	66%	0.659	S	S	*	*			cis	175.4	-175.2	-4	0	0	0	0	0	114.7
876	C	32.7	Very low	34	Very low	131 Å²	131	104 Å²	104	89%	0.885	68%	0.675	S	S	*	*			trans	77.1	165.6	167	-60	0	0	0	0	121.5
877	S	35.2	Very low	33.8	Very low	85 Å²	85	106.6 Å²	106.6	59%	0.594	69%	0.687	S	S	*	*			cis	-174.6	153.7	-33.5	-81.3	0	0	0	0	115.6	F1052	S877-F1052 WeakPolarHBondContact O-CZ 3.47Å
878	S	35	Very low	33.8	Very low	82 Å²	82	107.3 Å²	107.3	57%	0.573	69%	0.692	S	S	*	*			trans	66.2	147.3	154.9	-60.3	0	0	0	0	124.8	F1052	S878-F1052 VanDerWaalsContact N-CE1 3.28Å; S878-F1052 VanDerWaalsContact O-CD1 3.25Å; S878-F1052 WeakPolarHBondContact O-CD1 3.41Å; S878-F1052 VanDerWaalsContact O-CD2 3.24Å; S878-F1052 WeakPolarHBondContact O-CD2 3.48Å; S878-F1052 WeakPolarHBondContact O-CE1 3.17Å; S878-F1052 WeakPolarHBondContact O-CE2 3.27Å; S878-F1052 WeakPolarHBondContact O-CG 3.2Å; S878-F1052 WeakPolarHBondContact O-CZ 3.48Å
879	I	33.7	Very low	33.8	Very low	103 Å²	103	109.8 Å²	109.8	53%	0.528	70%	0.704	S	S	.	*			cis	-172.9	-171.7	-17.7	-151.9	164.6	0	0	0	112.6	N1053	I879-N1053 CarbonylContact C-O 3.49Å; I879-N1053 WeakPolarHBondContact CA-O 3.23Å
880	S	35	Very low	33.6	Very low	60 Å²	60	112.6 Å²	112.6	42%	0.42	71%	0.71	S	S	.	*			trans	78.7	164.4	164.4	-84.1	0	0	0	0	121.4	N1053 P1054	S880-N1053 CarbonylContact O-C 3.51Å; S880-N1053 WeakPolarHBondContact O-CA 3.33Å; S880-P1054 WeakPolarHBondContact CA-O 3.35Å; S880-P1054 PolarHBondContact N-O 3.14Å
881	S	36	Very low	33.4	Very low	82 Å²	82	108.7 Å²	108.7	57%	0.573	70%	0.702	S	S	*	*			cis	175.7	168.9	-27.7	-76.3	0	0	0	0	110.9	S1055	S881-S1055 VanDerWaalsContact CA-O 3.32Å; S881-S1055 WeakPolarHBondContact CA-O 3.49Å; S881-S1055 VanDerWaalsContact CB-O 3.28Å; S881-S1055 WeakPolarHBondContact CB-O 3.46Å; S881-S1055 PolarHBondContact OG-O 3.4Å
882	E	34.6	Very low	32.7	Very low	95 Å²	95	108 Å²	108	44%	0.444	70%	0.7	S	S	.	*			cis	-166.8	165.7	-47.5	-147.4	-149.2	-38.2	0	0	115.8	S1055 S1056 H1057	E882-S1055 WeakPolarHBondContact CB-O 3.46Å; E882-S1055 WeakPolarHBondContact CG-O 3.47Å; E882-S1056 WeakPolarHBondContact OE1-CA 3.46Å; E882-S1056 PolarHBondContact OE1-N 2.9Å; E882-S1056 VanDerWaalsContact OE2-CA 3.28Å; E882-S1056 WeakPolarHBondContact OE2-CA 3.25Å; E882-H1057 PolarHBondContact OE1-N 3.38Å; E882-H1057 PolarHBondContact OE2-N 3.49Å
883	T	34.8	Very low	32.5	Very low	127 Å²	127	107.7 Å²	107.7	78%	0.779	70%	0.7	S	S	*	*			trans	65.7	154.7	168.9	69.5	0	0	0	0	120.6
884	G	33.2	Very low	32	Very low	78 Å²	78	112.9 Å²	112.9	80%	0.804	70%	0.703	S	S	*	*			cis	-168	172	-0.8	0	0	0	0	0	115.4
885	S	34	Very low	32	Very low	133 Å²	133	113.6 Å²	113.6	93%	0.93	69%	0.694	S	S	*	*			trans	-70	173.1	-166.7	-48.8	0	0	0	0	119.1
886	G	31.6	Very low	31.6	Very low	68 Å²	68	116.2 Å²	116.2	70%	0.701	69%	0.691	S	S	*	*			cis	153.7	-175.8	-6.1	0	0	0	0	0	114.7
887	V	31.3	Very low	31.4	Very low	136 Å²	136	115.8 Å²	115.8	82%	0.824	68%	0.68	S	S	*	*			trans	75	138.5	156.4	170.2	0	0	0	0	118
888	H	30.6	Very low	31	Very low	153 Å²	153	120.5 Å²	120.5	71%	0.708	69%	0.69	S	S	*	*			cis	-162.1	157.7	-1.8	-127.3	-156.3	0	0	0	114.6
889	L	29.1	Very low	30.7	Very low	136 Å²	136	120.9 Å²	120.9	71%	0.712	70%	0.698	S	S	*	*			trans	63.8	157.7	153.6	-61.9	170.5	0	0	0	118.7
890	N	28.7	Very low	30.5	Very low	123 Å²	123	122.3 Å²	122.3	66%	0.658	71%	0.712	S	S	*	*			cis	-153.5	167.3	15.6	-145.9	-7.3	0	0	0	114.3
891	H	27.6	Very low	30.3	Very low	155 Å²	155	126.9 Å²	126.9	72%	0.718	73%	0.73	S	S	*	*			trans	62.7	127.9	160.7	-85.9	-85.8	0	0	0	124.5
892	S	25.9	Very low	30.1	Very low	95 Å²	95	128.1 Å²	128.1	66%	0.664	74%	0.737	S	S	*	*			trans	80	142.8	136	67.1	0	0	0	0	124
893	N	27.8	Very low	29.6	Very low	154 Å²	154	130.8 Å²	130.8	82%	0.824	75%	0.752	S	S	*	*			trans	88.4	141.8	152.3	-64.2	-11.6	0	0	0	123.6
894	Y	25.2	Very low	29.3	Very low	223 Å²	223	133 Å²	133	88%	0.875	76%	0.756	S	S	*	*			trans	-68.6	176.8	165.4	-86.8	-122.3	0	0	0	111.5
895	P	34.2	Very low	29.1	Very low	94 Å²	94	134.4 Å²	134.4	61%	0.61	75%	0.751	S	S	*	*			cis	-136.9	-153.2	-19.1	29.9	-5.4	0	0	0	113.2
896	N	28.1	Very low	28.7	Very low	127 Å²	127	134.8 Å²	134.8	68%	0.679	74%	0.742	S	S	*	*			trans	85.5	135.4	158.8	-62.4	-26.4	0	0	0	117.1
897	N	27.7	Very low	28.5	Very low	123 Å²	123	136.3 Å²	136.3	66%	0.658	74%	0.742	S	S	*	*			cis	72	135.6	46.3	-66	-29.9	0	0	0	112.1
898	F	27.7	Very low	28.3	Very low	184 Å²	184	134.3 Å²	134.3	81%	0.807	72%	0.722	S	S	*	*			cis	-151.5	161.4	12.4	-115.4	-60.5	0	0	0	111.9
899	A	28.5	Very low	28.4	Very low	90 Å²	90	129.2 Å²	129.2	74%	0.744	71%	0.711	S	S	*	*			trans	64.6	164.2	159.7	0	0	0	0	0	117.3
900	T	29.1	Very low	28.9	Very low	132 Å²	132	128.4 Å²	128.4	81%	0.81	71%	0.714	S	S	*	*			cis	-138.1	171.6	9.3	-54.4	0	0	0	0	111.8
901	L	30.2	Very low	28.8	Very low	156 Å²	156	125.6 Å²	125.6	82%	0.817	71%	0.714	S	S	*	*			trans	-58.8	171.3	174.5	-54.7	171.3	0	0	0	113.5
902	P	31.3	Very low	29.1	Very low	109 Å²	109	126.5 Å²	126.5	71%	0.708	72%	0.718	S	S	*	*			cis	-146.3	171.9	17.6	44	-23.8	0	0	0	119.9
903	I	26.1	Very low	29.2	Very low	150 Å²	150	127.1 Å²	127.1	77%	0.769	72%	0.722	S	S	*	*			trans	44.7	110.7	138.8	-60.3	166.6	0	0	0	121.6
904	M	26.4	Very low	29.4	Very low	174 Å²	174	127.7 Å²	127.7	86%	0.857	72%	0.722	S	S	*	*			trans	62	164.6	146.4	-63.5	-72.1	-172.6	0	0	120.3
905	P	29.8	Very low	29.5	Very low	108 Å²	108	124.5 Å²	124.5	70%	0.701	72%	0.72	S	S	*	*			cis	-128.6	177.4	-19.6	35	-16.2	0	0	0	115.4
906	L	25.5	Very low	29.3	Very low	141 Å²	141	124.4 Å²	124.4	74%	0.738	71%	0.714	S	S	*	*			trans	5.7	121.8	151.7	-56.3	167.2	0	0	0	121
907	S	27	Very low	29.5	Very low	99 Å²	99	131.1 Å²	131.1	69%	0.692	73%	0.731	S	S	*	*				161.1	131.3	111.9	-75.4	0	0	0	0	117.7
908	F	27.9	Very low	29.6	Very low	94 Å²	94	134.4 Å²	134.4	41%	0.412	74%	0.735	S	S	.	*			trans	58.4	155.3	144.5	-77.1	-90.4	0	0	0	124.5	T483 S484 G485	T483-F908 HydrophobicContact CG2-CD1 4.31Å; T483-F908 HydrophobicContact CG2-CG 4.5Å; S484-F908 VanDerWaalsContact CA-CE2 3.43Å; S484-F908 WeakPolarHBondContact O-CZ 3.31Å; G485-F908 WeakPolarHBondContact O-CE2 3.33Å
909	G	33.6	Very low	29.8	Very low	46 Å²	46	130.4 Å²	130.4	47%	0.474	74%	0.736	S	S	.	*			trans	-101.5	-154	172.6	0	0	0	0	0	111.7
910	P	38	Very low	29.9	Very low	120 Å²	120	130 Å²	130	78%	0.779	74%	0.74	S	S	*	*				-135.5	-151.8	52.4	41.9	-26	0	0	0	112.9
911	G	27.8	Very low	29.8	Very low	64 Å²	64	126.6 Å²	126.6	66%	0.66	73%	0.732	S	S	*	*			trans	-155.2	154.5	172.4	0	0	0	0	0	113.2
912	H	32.6	Very low	29.9	Very low	174 Å²	174	127.1 Å²	127.1	81%	0.806	73%	0.734	S	S	*	*			trans	-130.2	138.7	171.5	-63.1	-104.2	0	0	0	106.7
913	S	29.3	Very low	29.6	Very low	107 Å²	107	126.8 Å²	126.8	75%	0.748	73%	0.734	S	S	*	*			cis	77.2	94.2	27.1	-168.4	0	0	0	0	114.8
914	M	30.4	Very low	29.9	Very low	166 Å²	166	125.8 Å²	125.8	82%	0.818	74%	0.74	S	S	*	*			trans	-144.2	107.8	152	-144.6	168.5	-167.6	0	0	109.8
915	N	28.1	Very low	29.9	Very low	156 Å²	156	123.2 Å²	123.2	83%	0.834	73%	0.734	S	S	*	*			trans	-120.2	98.6	165.5	-81.2	-60.3	0	0	0	105.7
916	D	31.2	Very low	29.8	Very low	92 Å²	92	123.9 Å²	123.9	49%	0.492	74%	0.737	S	S	.	*			trans	-142.1	97.9	177.5	-82.7	-58.8	0	0	0	111.2	Y918	D916-Y918 VanDerWaalsContact OD1-CD2 3.27Å; D916-Y918 WeakPolarHBondContact OD1-CD2 3.39Å; D916-Y918 WeakPolarHBondContact OD1-CE2 3.28Å
917	W	30.4	Very low	30	Very low	269 Å²	269	125.8 Å²	125.8	100%	1.019	75%	0.748	S	S	*	*			trans	-129.1	87	148.2	-100	72.7	0	0	0	107.2
918	Y	31	Very low	30	Very low	191 Å²	191	124.8 Å²	124.8	75%	0.749	75%	0.753	S	S	*	*			trans	-75.6	154.4	179.4	-108.7	-100.4	0	0	0	112	D916	D916-Y918 VanDerWaalsContact OD1-CD2 3.27Å; D916-Y918 WeakPolarHBondContact OD1-CD2 3.39Å; D916-Y918 WeakPolarHBondContact OD1-CE2 3.28Å
919	A	31.7	Very low	30.1	Very low	100 Å²	100	124.7 Å²	124.7	83%	0.826	77%	0.77	S	S	*	*			trans	-152.7	134.8	151.9	0	0	0	0	0	110.3
920	G	31.1	Very low	29.8	Very low	81 Å²	81	132.8 Å²	132.8	84%	0.835	79%	0.792	S	S	*	*			trans	89.3	19.6	160.2	0	0	0	0	0	118.8
921	G	26.5	Very low	29.5	Very low	61 Å²	61	130.9 Å²	130.9	63%	0.629	80%	0.795	S	S	*	*			trans	-90	117.6	165.1	0	0	0	0	0	111.1
922	I	31.4	Very low	29.6	Very low	167 Å²	167	131.4 Å²	131.4	86%	0.856	80%	0.8	S	S	*	*			trans	-117.1	114.4	169.4	-47.8	179.7	0	0	0	108.5
923	S	26.2	Very low	29.5	Very low	102 Å²	102	131.3 Å²	131.3	71%	0.713	80%	0.8	S	S	*	*			trans	-81.5	157.2	179.8	-58.7	0	0	0	0	112.3
924	S	31.1	Very low	29.5	Very low	129 Å²	129	132.1 Å²	132.1	90%	0.902	80%	0.802	S	S	*	*			trans	-153.8	96.7	153.2	-79.8	0	0	0	0	109.6
925	T	27.1	Very low	29.6	Very low	120 Å²	120	130.7 Å²	130.7	74%	0.736	80%	0.797	S	S	*	*			trans	-98.7	135.5	172.2	44.3	0	0	0	0	110.3
926	T	27	Very low	29.6	Very low	123 Å²	123	130 Å²	130	76%	0.755	79%	0.793	S	S	*	*			trans	47.1	104.4	149.6	57.8	0	0	0	0	118.4
927	N	30.5	Very low	29.6	Very low	180 Å²	180	133 Å²	133	96%	0.963	81%	0.808	S	S	*	*				-153.9	155.9	128.7	-100	-30.4	0	0	0	109.6
928	G	26.3	Very low	29.7	Very low	78 Å²	78	123.5 Å²	123.5	80%	0.804	79%	0.794	S	S	*	*			trans	-120.2	140.9	-172	0	0	0	0	0	114
929	A	30.5	Very low	29.5	Very low	93 Å²	93	126.4 Å²	126.4	77%	0.769	80%	0.803	S	S	*	*			trans	-141	124.6	154	0	0	0	0	0	105.6
930	F	27.1	Very low	29.4	Very low	216 Å²	216	126.9 Å²	126.9	95%	0.947	80%	0.798	S	S	*	*				59.2	111.6	78.7	-93.9	-80.6	0	0	0	114.4
931	G	31.2	Very low	29.2	Very low	80 Å²	80	133.4 Å²	133.4	83%	0.825	80%	0.797	S	S	*	*			trans	109.6	139.9	155.7	0	0	0	0	0	117
932	G	31.7	Very low	29.7	Very low	75 Å²	75	136.1 Å²	136.1	77%	0.773	80%	0.804	S	S	*	*			trans	102.4	77.5	143.2	0	0	0	0	0	119.3
933	Q	30.5	Very low	29.5	Very low	172 Å²	172	132.5 Å²	132.5	80%	0.804	79%	0.789	S	S	*	*			trans	50.8	129	130.2	-67.6	-95.5	-58.7	0	0	121.2
934	P	29.3	Very low	29.9	Very low	123 Å²	123	133.1 Å²	133.1	80%	0.799	79%	0.791	S	S	*	*			trans	-93.3	127.6	167	35.3	-29.6	0	0	0	113
935	I	32.6	Very low	29.8	Very low	137 Å²	137	134.8 Å²	134.8	70%	0.703	79%	0.788	S	S	*	*			trans	-141.3	103.1	165.7	-59.2	-178.3	0	0	0	104.4
936	D	27.8	Very low	29.8	Very low	140 Å²	140	132.5 Å²	132.5	75%	0.749	78%	0.782	S	S	*	*				77.3	155.7	79.2	-164.1	23.7	0	0	0	112.9
937	L	30.3	Very low	29.9	Very low	156 Å²	156	133 Å²	133	82%	0.817	78%	0.775	S	S	*	*			trans	70.3	128	-173.7	-43.2	177	0	0	0	115.1
938	G	32.7	Very low	29.9	Very low	69 Å²	69	132.6 Å²	132.6	71%	0.711	76%	0.76	S	S	*	*			cis	156	114.6	-13.3	0	0	0	0	0	113.9
939	R	27.4	Very low	29.9	Very low	252 Å²	252	137 Å²	137	95%	0.951	77%	0.765	S	S	*	*			trans	60.2	179.4	169.4	-77.5	-177.9	173.1	-163.8	-0.4	115.6
940	P	29.1	Very low	29.7	Very low	110 Å²	110	142.1 Å²	142.1	71%	0.714	77%	0.766	S	S	*	*			cis	-120.8	-175.4	-44.6	34.5	-20.9	0	0	0	111.9	P942	P940-P942 WeakPolarHBondContact O-CD 3.21Å
941	R	28.2	Very low	29.8	Very low	219 Å²	219	135.8 Å²	135.8	83%	0.826	75%	0.748	S	S	*	*			trans	-61	141.4	155.9	-80.1	-177.4	172.4	-173.6	-1.5	110.5
942	P	36.4	Very low	29.6	Very low	118 Å²	118	139.9 Å²	139.9	77%	0.766	75%	0.751	S	S	*	*			trans	-103.6	114.2	140.9	32.6	-25.4	0	0	0	109.7	P940 P944	P940-P942 WeakPolarHBondContact O-CD 3.21Å; P942-P944 WeakPolarHBondContact O-CD 3.38Å
943	T	27.1	Very low	29.4	Very low	90 Å²	90	143.4 Å²	143.4	55%	0.552	75%	0.751	S	S	*	*			trans	-80.3	121	157.1	40	0	0	0	0	108.3	I945	T943-I945 PolarHBondContact O-N 3.22Å
944	P	35.2	Very low	29.2	Very low	115 Å²	115	140.7 Å²	140.7	75%	0.747	75%	0.75	S	S	*	*			trans	-71.4	94.8	165.7	29.4	-31.5	0	0	0	108.8	P942 A946	P942-P944 WeakPolarHBondContact O-CD 3.38Å; P944-A946 PolarHBondContact O-N 3.17Å
945	I	28.6	Very low	29	Very low	164 Å²	164	140.4 Å²	140.4	84%	0.841	75%	0.751	S	S	*	*			trans	-81	80.5	156.6	-61.2	178.8	0	0	0	105.9	T943	T943-I945 PolarHBondContact O-N 3.22Å
946	A	26.5	Very low	29	Very low	73 Å²	73	139.4 Å²	139.4	60%	0.603	75%	0.753	S	S	*	*			trans	-166.5	140.2	177.2	0	0	0	0	0	107.8	P944	P944-A946 PolarHBondContact O-N 3.17Å
947	E	28.8	Very low	29	Very low	133 Å²	133	136.2 Å²	136.2	62%	0.621	75%	0.753	S	S	*	*			cis	-160.6	159.2	-2.3	-120	-172.7	153.4	0	0	110.7
948	R	30.1	Very low	29.1	Very low	171 Å²	171	135.5 Å²	135.5	65%	0.645	76%	0.755	S	S	*	*			trans	58.9	120.2	153	-63.2	161.2	-163.6	-174.3	11.5	116.7	Y950	R948-Y950 HydrophobicContact CB-CD2 4.13Å; R948-Y950 HydrophobicContact CG-CD2 4.33Å; R948-Y950 HydrophobicContact CG-CE2 4.36Å
949	L	26.7	Very low	28.8	Very low	171 Å²	171	140.1 Å²	140.1	90%	0.895	76%	0.764	S	S	*	*			cis	54	65.7	34.6	-61.5	176.4	0	0	0	114.5
950	Y	27.1	Very low	29.1	Very low	201 Å²	201	131.4 Å²	131.4	79%	0.788	75%	0.752	S	S	*	*			trans	-158.4	132.2	151.9	-83.5	-82.1	0	0	0	105.5	R948	R948-Y950 HydrophobicContact CB-CD2 4.13Å; R948-Y950 HydrophobicContact CG-CD2 4.33Å; R948-Y950 HydrophobicContact CG-CE2 4.36Å
951	S	29.1	Very low	29	Very low	82 Å²	82	131.1 Å²	131.1	57%	0.573	75%	0.753	S	S	*	*			cis	-149.6	151.4	-11.2	-65.3	0	0	0	0	106.1
952	N	26.6	Very low	29.3	Very low	167 Å²	167	126.3 Å²	126.3	89%	0.893	75%	0.748	S	S	*	*			cis	57.4	56.7	24.2	-84.5	15.8	0	0	0	115
953	L	27.2	Very low	28.9	Very low	149 Å²	149	129.1 Å²	129.1	78%	0.78	75%	0.75	S	S	*	*			trans	-130.5	122.5	155.7	-78.4	178.7	0	0	0	111.5
954	C	27.4	Very low	29	Very low	115 Å²	115	135.4 Å²	135.4	78%	0.777	77%	0.766	S	S	*	*			trans	66.4	86.4	150	-54	0	0	0	0	120.5
955	S	25.1	Very low	28.6	Very low	116 Å²	116	134.9 Å²	134.9	81%	0.811	77%	0.765	S	S	*	*				-53.6	153.9	119	-36.8	0	0	0	0	109.7
956	P	31.2	Very low	28.7	Very low	117 Å²	117	134.7 Å²	134.7	76%	0.76	76%	0.764	S	S	*	*				-129.7	175.4	51.2	40	-24.7	0	0	0	113.3
957	G	27.2	Very low	28.8	Very low	72 Å²	72	137.3 Å²	137.3	74%	0.742	77%	0.767	S	S	*	*			cis	101.3	58.2	7.6	0	0	0	0	0	113.5
958	V	33.3	Very low	28.8	Very low	141 Å²	141	134.7 Å²	134.7	86%	0.855	76%	0.764	S	S	*	*			trans	-135.8	140.8	165.2	-101.2	0	0	0	0	110.2
959	N	27.1	Very low	28.9	Very low	167 Å²	167	132.5 Å²	132.5	89%	0.893	77%	0.77	S	S	*	*			trans	-82.8	144.1	-178.8	-55.6	-54.5	0	0	0	110.9
960	G	32.9	Very low	29	Very low	68 Å²	68	131.9 Å²	131.9	70%	0.701	76%	0.76	S	S	*	*			trans	-176.9	90.3	174.1	0	0	0	0	0	107.2
961	S	27.6	Very low	29.2	Very low	105 Å²	105	127.5 Å²	127.5	73%	0.734	76%	0.758	S	S	*	*				70.8	135.1	63.3	-54.4	0	0	0	0	112.1
962	T	33.5	Very low	29.4	Very low	118 Å²	118	131.5 Å²	131.5	72%	0.724	76%	0.76	S	S	*	*			trans	59.4	109.9	-171.8	56.3	0	0	0	0	113.8
963	Q	27.6	Very low	29.7	Very low	176 Å²	176	132.9 Å²	132.9	82%	0.822	76%	0.761	S	S	*	*				51.1	96.9	71.5	-66.4	-174.3	-54.1	0	0	113.2
964	Y	29.4	Very low	30	Very low	223 Å²	223	131.5 Å²	131.5	88%	0.875	75%	0.751	S	S	*	*			trans	-150.1	121.4	137.1	-88.6	-67.3	0	0	0	109.2
965	S	26.8	Very low	30.4	Very low	103 Å²	103	133.5 Å²	133.5	72%	0.72	75%	0.748	S	S	*	*			trans	-87	138.1	164.4	-64.1	0	0	0	0	109.4
966	I	31.1	Very low	30.8	Very low	160 Å²	160	134.2 Å²	134.2	82%	0.821	74%	0.742	S	S	*	*			trans	-143.7	95.6	162.8	-53.5	177	0	0	0	103.6
967	D	29	Very low	31	Very low	128 Å²	128	136.5 Å²	136.5	68%	0.684	74%	0.743	S	S	*	*			cis	74.1	136.1	21	-153	6.6	0	0	0	115.6
968	S	28.9	Very low	31.5	Very low	78 Å²	78	138.7 Å²	138.7	55%	0.545	74%	0.744	S	S	.	*			trans	60	133.1	-176.2	71.9	0	0	0	0	116
969	T	32.2	Very low	31.5	Very low	126 Å²	126	135 Å²	135	77%	0.773	74%	0.735	S	S	*	*			cis	65.9	113.9	32.4	80.3	0	0	0	0	115.6
970	F	29.1	Very low	31.8	Very low	158 Å²	158	133.5 Å²	133.5	69%	0.693	73%	0.732	S	S	*	*			trans	-172	164.3	152.8	-89.1	-55	0	0	0	107.3	R972	F970-R972 HydrophobicContact CB-CG 4.42Å; F970-R972 HydrophobicContact CD1-CB 4.1Å; F970-R972 HydrophobicContact CD1-CG 3.41Å; F970-R972 VanDerWaalsContact CD1-CG 3.41Å; F970-R972 HydrophobicContact CE1-CG 3.9Å; F970-R972 HydrophobicContact CG-CG 4.05Å
971	C	30.3	Very low	31.8	Very low	109 Å²	109	135.1 Å²	135.1	74%	0.736	73%	0.733	S	S	*	*			cis	-76.2	137.3	3.3	-80.7	0	0	0	0	113.5
972	R	33.3	Very low	32.2	Very low	166 Å²	166	134.5 Å²	134.5	63%	0.626	73%	0.734	S	S	*	*				89.2	111.7	50.5	-82.7	-173.2	167	-175.2	-4.5	111.6	F970	F970-R972 HydrophobicContact CB-CG 4.42Å; F970-R972 HydrophobicContact CD1-CB 4.1Å; F970-R972 HydrophobicContact CD1-CG 3.41Å; F970-R972 VanDerWaalsContact CD1-CG 3.41Å; F970-R972 HydrophobicContact CE1-CG 3.9Å; F970-R972 HydrophobicContact CG-CG 4.05Å
973	Q	34.3	Very low	32.2	Very low	195 Å²	195	134.3 Å²	134.3	91%	0.911	74%	0.737	S	S	*	*				-145.7	166.5	93.3	-103.2	170	-11.5	0	0	110
974	Q	33.7	Very low	32.6	Very low	121 Å²	121	129.9 Å²	129.9	57%	0.565	73%	0.731	S	S	*	*			trans	-123.4	142.6	-161.1	-58.5	154	-88.5	0	0	110.5
975	H	34.9	Very low	32.8	Very low	156 Å²	156	127.2 Å²	127.2	72%	0.722	73%	0.731	S	S	*	*				179.6	121.2	108.9	-112.7	-98.4	0	0	0	114.6
976	L	34.5	Very low	33	Very low	131 Å²	131	125.8 Å²	125.8	69%	0.686	72%	0.721	S	S	*	*			trans	36	121.4	139.2	-81.6	61.1	0	0	0	122.7
977	E	34.6	Very low	33.2	Very low	166 Å²	166	125.1 Å²	125.1	78%	0.776	72%	0.719	S	S	*	*				79.3	152.3	125.5	-63	-44.5	93.6	0	0	122.8
978	P	37.9	Very low	33.5	Very low	117 Å²	117	125.3 Å²	125.3	76%	0.76	72%	0.724	S	S	*	*			trans	-132.2	178.8	-132	44.7	-31	0	0	0	116.5
979	G	32.3	Very low	33.9	Very low	64 Å²	64	127.9 Å²	127.9	66%	0.66	74%	0.736	S	S	*	*			trans	-178.4	139.4	163.6	0	0	0	0	0	117.8
980	T	33.5	Very low	34.2	Very low	135 Å²	135	127.2 Å²	127.2	83%	0.828	73%	0.734	S	S	*	*			trans	60	94.3	148.9	37.1	0	0	0	0	122.4
981	S	34.1	Very low	34.5	Very low	103 Å²	103	124 Å²	124	72%	0.72	74%	0.736	S	S	*	*				64.5	141.8	110.9	69.1	0	0	0	0	124.4
982	A	34.9	Very low	34.8	Very low	92 Å²	92	123.2 Å²	123.2	76%	0.76	74%	0.738	S	S	*	*			trans	78.2	149.4	149.6	0	0	0	0	0	118.3
983	S	33.9	Very low	34.9	Very low	114 Å²	114	123.2 Å²	123.2	80%	0.797	75%	0.745	S	S	*	*			cis	-172	176.3	-16.1	-98.7	0	0	0	0	111
984	A	35.9	Very low	34.9	Very low	83 Å²	83	119.4 Å²	119.4	69%	0.686	73%	0.731	S	S	*	*			trans	96.2	112.6	141.6	0	0	0	0	0	122.3
985	L	34.3	Very low	35	Very low	166 Å²	166	124.4 Å²	124.4	87%	0.869	75%	0.745	S	S	*	*			trans	75.7	154.8	138.3	-56	165.9	0	0	0	120.9
986	S	30.3	Very low	35	Very low	73 Å²	73	126 Å²	126	51%	0.51	75%	0.75	S	S	.	*				168.8	153.9	-63.1	56.7	0	0	0	0	112.3
987	N	35.2	Very low	35	Very low	146 Å²	146	130.9 Å²	130.9	78%	0.781	76%	0.759	S	S	*	*			trans	76.4	157.7	166	-40.8	-45.1	0	0	0	115.4
988	V	35.3	Very low	34.7	Very low	132 Å²	132	130.5 Å²	130.5	80%	0.8	76%	0.761	S	S	*	*			cis	-136	150.1	15.4	177.5	0	0	0	0	111.7
989	V	38	Very low	34.5	Very low	132 Å²	132	131 Å²	131	80%	0.8	76%	0.762	S	S	*	*			trans	-126.9	146.5	166.9	-158.3	0	0	0	0	108.7
990	P	38.9	Very low	34.4	Very low	113 Å²	113	137.1 Å²	137.1	73%	0.734	77%	0.774	S	S	*	*				-143.7	154.3	113.2	34.5	-19	0	0	0	113.1
991	A	34.8	Very low	34.4	Very low	89 Å²	89	134.5 Å²	134.5	74%	0.736	77%	0.773	S	S	*	*			cis	95.4	151.1	21.2	0	0	0	0	0	116.3
992	A	35.9	Very low	34	Very low	94 Å²	94	135.1 Å²	135.1	78%	0.777	78%	0.777	S	S	*	*			trans	78.2	150.4	167	0	0	0	0	0	119.4
993	E	36.2	Very low	34.1	Very low	166 Å²	166	136.1 Å²	136.1	78%	0.776	78%	0.776	S	S	*	*			cis	-169.3	153	-21	-109.8	-157	146.6	0	0	114
994	N	34.6	Very low	33.9	Very low	115 Å²	115	136.6 Å²	136.6	62%	0.615	77%	0.774	S	S	*	*			trans	64	155.8	138.3	-75.9	-34.7	0	0	0	126.9
995	R	35.5	Very low	33.6	Very low	225 Å²	225	142 Å²	142	85%	0.849	79%	0.785	S	S	*	*			trans	91.7	113.7	158.3	-48.5	-166.6	-179.2	-179.1	0.4	116.3
996	K	34.8	Very low	33.6	Very low	190 Å²	190	137.8 Å²	137.8	83%	0.826	78%	0.782	S	S	*	*			cis	84.3	108.6	50	-75.2	178.4	171.7	175.9	0	114.2
997	R	34.5	Very low	33.7	Very low	234 Å²	234	141.2 Å²	141.2	88%	0.883	79%	0.793	S	S	*	*				161.3	127.4	119.1	-90.9	-178.9	177.6	-161	-1.3	117.2
998	L	28.8	Very low	33.7	Very low	157 Å²	157	141.3 Å²	141.3	82%	0.822	79%	0.794	S	S	*	*			trans	62	172.2	134.3	-99.8	73.4	0	0	0	124.2
999	V	33.8	Very low	33.8	Very low	127 Å²	127	139.8 Å²	139.8	77%	0.77	79%	0.787	S	S	*	*			trans	77.7	105.2	173.7	-170	0	0	0	0	114
1000	Q	30	Very low	33.7	Very low	194 Å²	194	142.3 Å²	142.3	91%	0.907	79%	0.787	S	S	*	*				70.7	126	52.5	-71.3	-169.1	-29	0	0	116.1
1001	G	33.7	Very low	33.5	Very low	79 Å²	79	144 Å²	144	81%	0.814	79%	0.787	S	S	*	*			trans	152.7	126.3	166.3	0	0	0	0	0	114.5
1002	S	25.6	Very low	33.4	Very low	116 Å²	116	146.2 Å²	146.2	81%	0.811	79%	0.785	S	S	*	*			trans	-160	122.3	175.6	59.3	0	0	0	0	113.9
1003	P	36.3	Very low	33.3	Very low	113 Å²	113	147.6 Å²	147.6	73%	0.734	79%	0.787	S	S	*	*			trans	-116.5	137.3	153.4	34	-22.5	0	0	0	110.3
1004	T	29.8	Very low	33.2	Very low	124 Å²	124	147.8 Å²	147.8	76%	0.761	79%	0.794	S	S	*	*				73.9	122.9	54.1	65.9	0	0	0	0	116
1005	E	29.4	Very low	33.1	Very low	197 Å²	197	145.9 Å²	145.9	92%	0.921	80%	0.801	S	S	*	*			trans	76.3	147.3	160.2	-60.1	-173.8	156.3	0	0	121.2
1006	G	34.3	Very low	32.9	Very low	78 Å²	78	142 Å²	142	80%	0.804	80%	0.795	S	S	*	*			trans	151.4	92.1	-178.1	0	0	0	0	0	113.4
1007	I	33.1	Very low	32.6	Very low	145 Å²	145	138.5 Å²	138.5	74%	0.744	79%	0.794	S	S	*	*			trans	-119	144.8	-171	-52.7	171.3	0	0	0	111
1008	N	33.9	Very low	32.6	Very low	147 Å²	147	132.2 Å²	132.2	79%	0.786	79%	0.792	S	S	*	*			trans	151.4	157.8	140	-86.6	-64.6	0	0	0	115.2
1009	P	38.8	Very low	32.7	Very low	101 Å²	101	130 Å²	130	66%	0.656	79%	0.79	S	S	*	*			trans	-140.7	-149.9	-132	44.4	-23.4	0	0	0	115.5
1010	K	35.8	Very low	32.8	Very low	185 Å²	185	130.7 Å²	130.7	80%	0.804	79%	0.794	S	S	*	*			trans	100.3	141.2	173.6	-60	174.7	-178.2	176.5	0	114.6
1011	M	33.6	Very low	33.1	Very low	147 Å²	147	127.3 Å²	127.3	72%	0.724	79%	0.789	S	S	*	*			cis	-157	141.6	-4.8	-112.6	169.6	75.5	0	0	112.1
1012	I	33.2	Very low	33.1	Very low	137 Å²	137	128.1 Å²	128.1	70%	0.703	79%	0.788	S	S	*	*			trans	27.5	132.9	132.1	-34.1	171.1	0	0	0	117.2
1013	C	33.7	Very low	33.6	Very low	122 Å²	122	128.9 Å²	128.9	82%	0.824	79%	0.787	S	S	*	*				-145.8	164	51.4	-56.6	0	0	0	0	116.7
1014	N	33.5	Very low	33.5	Very low	171 Å²	171	127.7 Å²	127.7	91%	0.914	78%	0.782	S	S	*	*			trans	-106.8	169.4	-176.6	-70.6	-42.8	0	0	0	114.2
1015	G	33.1	Very low	33.8	Very low	74 Å²	74	124.3 Å²	124.3	76%	0.763	77%	0.766	S	S	*	*			trans	172.3	102.1	162.1	0	0	0	0	0	113.1
1016	I	31.1	Very low	34.1	Very low	143 Å²	143	118.6 Å²	118.6	73%	0.733	75%	0.752	S	S	*	*			trans	-142.1	130.4	-166.1	-97.4	175.8	0	0	0	114
1017	C	30	Very low	34.1	Very low	117 Å²	117	124.2 Å²	124.2	79%	0.791	75%	0.751	S	S	*	*			trans	52.8	155.8	145.2	-61.5	0	0	0	0	125.5
1018	A	34.1	Very low	34.3	Very low	103 Å²	103	122 Å²	122	85%	0.851	76%	0.755	S	S	*	*			trans	90.3	127	137.4	0	0	0	0	0	120.4
1019	S	30.4	Very low	34.5	Very low	111 Å²	111	118.2 Å²	118.2	78%	0.776	75%	0.75	S	S	*	*			trans	-94.5	143.1	163.2	52.6	0	0	0	0	111.3
1020	V	35.1	Very low	34.4	Very low	141 Å²	141	122.3 Å²	122.3	86%	0.855	76%	0.764	S	S	*	*			trans	-174.7	139.7	135.7	141.7	0	0	0	0	108.2
1021	P	36.1	Very low	34.4	Very low	122 Å²	122	116.6 Å²	116.6	79%	0.792	76%	0.758	S	S	*	*			trans	-104.7	161.8	-169.7	39.2	-35.7	0	0	0	115.6
1022	A	34.4	Very low	34.6	Very low	96 Å²	96	117.8 Å²	117.8	79%	0.793	76%	0.762	S	S	*	*			trans	-155.2	105.5	167.1	0	0	0	0	0	115.2
1023	V	35.6	Very low	34.7	Very low	133 Å²	133	115.5 Å²	115.5	81%	0.806	75%	0.751	S	S	*	*			trans	46.8	98.9	135.7	-169.4	0	0	0	0	122.2
1024	S	34.8	Very low	34.8	Very low	88 Å²	88	112.7 Å²	112.7	62%	0.615	73%	0.728	S	S	*	*				71.3	143.1	125.9	-54.3	0	0	0	0	126.8
1025	A	36.5	Very low	34.8	Very low	53 Å²	53	109.7 Å²	109.7	44%	0.438	71%	0.711	S	S	.	*			trans	89.3	143.8	147.7	0	0	0	0	0	120.4	V854 M855	V854-A1025 VanDerWaalsContact O-CB 3.25Å; V854-A1025 WeakPolarHBondContact O-CB 3.23Å; M855-A1025 WeakPolarHBondContact O-CB 3.33Å
1026	A	35.4	Very low	34.8	Very low	76 Å²	76	109.4 Å²	109.4	63%	0.628	70%	0.698	S	S	*	*			cis	-167.3	172.6	-19.6	0	0	0	0	0	113.8
1027	Y	35.2	Very low	34.9	Very low	196 Å²	196	105.3 Å²	105.3	77%	0.769	69%	0.685	S	S	*	*			trans	94.8	131.2	153.7	-97.9	-86.6	0	0	0	125.5
1028	A	35.8	Very low	35.5	Very low	100 Å²	100	103.8 Å²	103.8	83%	0.826	67%	0.674	S	S	*	*			trans	60.7	139.2	158.5	0	0	0	0	0	122.6
1029	G	37.5	Very low	35.4	Very low	67 Å²	67	106.8 Å²	106.8	69%	0.691	67%	0.668	S	S	*	*			cis	170.2	166.6	-11.8	0	0	0	0	0	116.6
1030	I	36.8	Very low	35.6	Very low	186 Å²	186	106.1 Å²	106.1	95%	0.954	67%	0.669	S	S	*	*			trans	75.3	133.6	163.3	-47.9	169.6	0	0	0	118.2
1031	G	35.8	Very low	35.5	Very low	65 Å²	65	103.3 Å²	103.3	67%	0.67	67%	0.669	S	S	*	*			cis	167.5	149.2	-15.7	0	0	0	0	0	117.4
1032	Q	37.9	Very low	35.4	Very low	172 Å²	172	105.3 Å²	105.3	80%	0.804	67%	0.673	S	S	*	*			trans	67.4	167.9	157.9	-67.5	-159.4	-20.4	0	0	121.3
1033	N	36.7	Very low	35.3	Very low	89 Å²	89	105.1 Å²	105.1	48%	0.476	67%	0.671	S	S	.	*			cis	-173.2	179.6	-16.5	-97	11.8	0	0	0	109.6
1034	N	34.8	Very low	35.3	Very low	64 Å²	64	110.4 Å²	110.4	34%	0.342	68%	0.678	S	S	.	*			cis	-172.5	150.4	-31.1	-95.1	13.6	0	0	0	115.3	E863 S864	E863-N1034 PolarHBondContact O-OD1 2.91Å; E863-N1034 VanDerWaalsContact O-OD1 3.13Å; S864-N1034 PolarHBondContact N-OD1 2.93Å
1035	L	33.6	Very low	35.2	Very low	107 Å²	107	114.8 Å²	114.8	56%	0.56	69%	0.689	S	S	*	*			trans	84.4	117.9	142.8	-68.3	159.4	0	0	0	127.3	S864	S864-L1035 PolarHBondContact O-N 3.23Å
1036	S	32.8	Very low	35.6	Very low	69 Å²	69	116.9 Å²	116.9	48%	0.483	70%	0.698	S	S	.	*				82.2	115.8	121.6	-63.4	0	0	0	0	129.8	S865	S865-S1036 PolarHBondContact O-N 3.3Å; S865-S1036 WeakPolarHBondContact OG-CA 3.19Å; S865-S1036 PolarHBondContact OG-N 3.4Å; S865-S1036 VanDerWaalsContact OG-N 3.07Å; S865-S1036 PolarHBondContact OG-OG 2.71Å
1037	A	33.8	Very low	35.6	Very low	57 Å²	57	120.5 Å²	120.5	47%	0.471	71%	0.706	S	S	.	*				70.3	169.3	122.6	0	0	0	0	0	125.1	F867	F867-A1037 HydrophobicContact CB-CB 4.39Å; F867-A1037 HydrophobicContact CD2-CB 3.95Å
1038	P	43	Very low	35.6	Very low	84 Å²	84	118.2 Å²	118.2	55%	0.545	71%	0.707	S	S	.	*				-146	177.1	-58.9	44	-26.7	0	0	0	119.7	N868	N868-P1038 HydrophobicContact CB-CB 4.26Å; N868-P1038 VanDerWaalsContact ND2-CB 3.34Å; N868-P1038 WeakPolarHBondContact ND2-CB 3.27Å
1039	F	31.8	Very low	35.6	Very low	166 Å²	166	116.4 Å²	116.4	73%	0.728	70%	0.699	S	S	*	*			trans	91	134.1	146.5	-93.6	-69.4	0	0	0	127.8
1040	A	33.9	Very low	35.2	Very low	97 Å²	97	122.5 Å²	122.5	80%	0.802	71%	0.706	S	S	*	*			trans	75	144.8	142.4	0	0	0	0	0	126.5
1041	G	33.5	Very low	35	Very low	83 Å²	83	119.9 Å²	119.9	86%	0.856	70%	0.7	S	S	*	*			trans	149.1	95.6	153.9	0	0	0	0	0	123
1042	N	33.4	Very low	34.7	Very low	164 Å²	164	123 Å²	123	88%	0.877	70%	0.695	S	S	*	*			trans	-40.2	141.3	177	-66.2	-9.7	0	0	0	126.4
1043	A	33.8	Very low	34.3	Very low	91 Å²	91	120.2 Å²	120.2	75%	0.752	69%	0.686	S	S	*	*				52.7	144.5	117.8	0	0	0	0	0	127.6
1044	Y	34.7	Very low	34.4	Very low	244 Å²	244	119.4 Å²	119.4	96%	0.957	69%	0.685	S	S	*	*			trans	-157.7	168.1	142.5	-109.7	-77.7	0	0	0	111.2
1045	Q	33.4	Very low	34.3	Very low	181 Å²	181	118.7 Å²	118.7	85%	0.846	69%	0.685	S	S	*	*			trans	-140.7	-155.2	-152.9	-144	-156.5	4.5	0	0	117
1046	P	44.4	Very low	34.1	Very low	97 Å²	97	117.5 Å²	117.5	63%	0.63	69%	0.686	S	S	*	*				-126.5	-160.5	-123.9	46.7	-28	0	0	0	116.3
1047	L	34.2	Very low	34.2	Very low	151 Å²	151	122.2 Å²	122.2	79%	0.791	70%	0.7	S	S	*	*			trans	-168	129.2	148.4	-104.6	166.7	0	0	0	115.3
1048	N	37	Very low	33.9	Very low	148 Å²	148	124.7 Å²	124.7	79%	0.791	71%	0.709	S	S	*	*			trans	26.3	151.3	154	-55.2	-7	0	0	0	124.5
1049	G	34.6	Very low	33.2	Very low	63 Å²	63	129.2 Å²	129.2	65%	0.649	72%	0.72	S	S	*	*			cis	163	153.7	-10.6	0	0	0	0	0	116.8
1050	F	29.7	Very low	33	Very low	194 Å²	194	129.2 Å²	129.2	85%	0.851	72%	0.723	S	S	*	*			trans	69.8	152.4	163	-56.3	-73.4	0	0	0	120.5
1051	T	32.5	Very low	32.9	Very low	132 Å²	132	134.8 Å²	134.8	81%	0.81	72%	0.724	S	S	*	*			cis	-145.1	-164.3	5.2	-16.6	0	0	0	0	113.9
1052	F	28.5	Very low	32.8	Very low	129 Å²	129	136.4 Å²	136.4	57%	0.566	72%	0.72	S	S	*	*			trans	-113	178.6	-154.2	-98.7	-80	0	0	0	120.1	S877 S878	S877-F1052 WeakPolarHBondContact O-CZ 3.47Å; S878-F1052 VanDerWaalsContact N-CE1 3.28Å; S878-F1052 VanDerWaalsContact O-CD1 3.25Å; S878-F1052 WeakPolarHBondContact O-CD1 3.41Å; S878-F1052 VanDerWaalsContact O-CD2 3.24Å; S878-F1052 WeakPolarHBondContact O-CD2 3.48Å; S878-F1052 WeakPolarHBondContact O-CE1 3.17Å; S878-F1052 WeakPolarHBondContact O-CE2 3.27Å; S878-F1052 WeakPolarHBondContact O-CG 3.2Å; S878-F1052 WeakPolarHBondContact O-CZ 3.48Å
1053	N	30.6	Very low	32.7	Very low	115 Å²	115	133.3 Å²	133.3	62%	0.615	71%	0.711	S	S	*	*			trans	-167.6	174.3	-178.5	-152.7	-1.1	0	0	0	107.8	I879 S880	I879-N1053 CarbonylContact C-O 3.49Å; I879-N1053 WeakPolarHBondContact CA-O 3.23Å; S880-N1053 CarbonylContact O-C 3.51Å; S880-N1053 WeakPolarHBondContact O-CA 3.33Å
1054	P	38.8	Very low	32.7	Very low	72 Å²	72	138.7 Å²	138.7	47%	0.468	72%	0.718	S	S	.	*			cis	-131.9	-159.1	-17.5	45.5	-27.9	0	0	0	113.9	S880	S880-P1054 WeakPolarHBondContact CA-O 3.35Å; S880-P1054 PolarHBondContact N-O 3.14Å
1055	S	31.7	Very low	32.4	Very low	48 Å²	48	131.5 Å²	131.5	34%	0.336	71%	0.709	S	S	.	*			trans	109.9	157.3	161.3	74.6	0	0	0	0	118	S881 E882	S881-S1055 VanDerWaalsContact CA-O 3.32Å; S881-S1055 WeakPolarHBondContact CA-O 3.49Å; S881-S1055 VanDerWaalsContact CB-O 3.28Å; S881-S1055 WeakPolarHBondContact CB-O 3.46Å; S881-S1055 PolarHBondContact OG-O 3.4Å; E882-S1055 WeakPolarHBondContact CB-O 3.46Å; E882-S1055 WeakPolarHBondContact CG-O 3.47Å
1056	S	29.8	Very low	32.4	Very low	82 Å²	82	125.8 Å²	125.8	57%	0.573	70%	0.699	S	S	*	*			cis	175.3	112.9	-47.2	55.8	0	0	0	0	111.8	E882	E882-S1056 WeakPolarHBondContact OE1-CA 3.46Å; E882-S1056 PolarHBondContact OE1-N 2.9Å; E882-S1056 VanDerWaalsContact OE2-CA 3.28Å; E882-S1056 WeakPolarHBondContact OE2-CA 3.25Å
1057	H	34.3	Very low	31.7	Very low	168 Å²	168	131.5 Å²	131.5	78%	0.778	71%	0.709	S	S	*	*			trans	-153.4	-174.1	169.6	-109.5	-68.2	0	0	0	116.5	E882	E882-H1057 PolarHBondContact OE1-N 3.38Å; E882-H1057 PolarHBondContact OE2-N 3.49Å
1058	T	28.7	Very low	31.4	Very low	109 Å²	109	131.3 Å²	131.3	67%	0.669	71%	0.705	S	S	*	*			trans	-129.8	178.6	-152.8	-42.2	0	0	0	0	113.2
1059	F	27.1	Very low	31.2	Very low	179 Å²	179	128.7 Å²	128.7	79%	0.785	70%	0.703	S	S	*	*			trans	83.1	151	175.7	-56.4	-76.7	0	0	0	115.4
1060	Q	27.4	Very low	31.2	Very low	166 Å²	166	133.9 Å²	133.9	78%	0.776	71%	0.71	S	S	*	*			cis	-164	153.2	-21.7	173.6	166.8	-14.9	0	0	109.2
1061	Y	31.7	Very low	31.1	Very low	214 Å²	214	129.6 Å²	129.6	84%	0.839	71%	0.705	S	S	*	*			trans	-69.4	156.2	-180	-87.4	-83.9	0	0	0	114
1062	P	33.2	Very low	30.9	Very low	117 Å²	117	126.5 Å²	126.5	76%	0.76	69%	0.692	S	S	*	*				-138.3	170.1	117.1	38.7	-28.3	0	0	0	115
1063	S	31.5	Very low	30.8	Very low	99 Å²	99	127.6 Å²	127.6	69%	0.692	70%	0.704	S	S	*	*			trans	-114.8	145	173.6	-57	0	0	0	0	111.9
1064	F	31.9	Very low	30.5	Very low	204 Å²	204	126.2 Å²	126.2	90%	0.895	70%	0.704	S	S	*	*			trans	-145.8	130	146.9	-83.3	-85.7	0	0	0	106.2
1065	A	30.3	Very low	29.8	Very low	94 Å²	94	129.6 Å²	129.6	78%	0.777	72%	0.717	S	S	*	*			cis	90.3	118.7	31.3	0	0	0	0	0	114
1066	G	32.1	Very low	29.5	Very low	61 Å²	61	134 Å²	134	63%	0.629	74%	0.735	S	S	*	*			trans	170.3	107.1	177.5	0	0	0	0	0	107.8
1067	Y	29.5	Very low	29.3	Very low	216 Å²	216	136.2 Å²	136.2	85%	0.847	74%	0.741	S	S	*	*				66.5	130.4	77.7	-72.6	-58.2	0	0	0	112.3
1068	Q	28	Very low	28.8	Very low	148 Å²	148	135.9 Å²	135.9	69%	0.692	74%	0.739	S	S	*	*			cis	-155.5	137.7	-5.2	-150	157.4	-21.2	0	0	105
1069	A	34.1	Very low	28.7	Very low	92 Å²	92	139.8 Å²	139.8	76%	0.76	75%	0.748	S	S	*	*				62.2	42	53.5	0	0	0	0	0	114.9
1070	E	33	Very low	28.7	Very low	172 Å²	172	136.4 Å²	136.4	80%	0.804	74%	0.738	S	S	*	*			trans	-97.6	125.8	148.4	-61.8	-169.1	156	0	0	106.9
1071	S	28.2	Very low	28.9	Very low	104 Å²	104	137 Å²	137	73%	0.727	75%	0.745	S	S	*	*			cis	68	139	41.3	107	0	0	0	0	111.8
1072	A	28.2	Very low	28.7	Very low	67 Å²	67	133.3 Å²	133.3	55%	0.554	74%	0.74	S	S	*	*			cis	-151	-170.1	4.5	0	0	0	0	0	108.7
1073	N	26.3	Very low	28.5	Very low	152 Å²	152	131 Å²	131	81%	0.813	74%	0.737	S	S	*	*			trans	63.3	143.9	144.2	-63.6	-16.3	0	0	0	119.1
1074	S	25	Very low	28.4	Very low	86 Å²	86	137.9 Å²	137.9	60%	0.601	75%	0.75	S	S	*	*			cis	-176	162.4	-12.2	50.7	0	0	0	0	107.1
1075	L	24.7	Very low	28.6	Very low	144 Å²	144	131.4 Å²	131.4	75%	0.754	74%	0.74	S	S	*	*			trans	64.8	119.7	161.9	-58.6	160.3	0	0	0	114.8
1076	I	24.5	Very low	28.7	Very low	139 Å²	139	131.3 Å²	131.3	71%	0.713	74%	0.74	S	S	*	*				52.7	83.8	75.7	-54.2	177.7	0	0	0	111.4
1077	N	25.3	Very low	28.7	Very low	130 Å²	130	135.7 Å²	135.7	70%	0.695	75%	0.749	S	S	*	*			trans	-165	122.7	134.4	-86.8	-30.4	0	0	0	106.2
1078	Q	25.2	Very low	29	Very low	160 Å²	160	131 Å²	131	75%	0.748	75%	0.745	S	S	*	*				53.6	93.2	71.9	-68	-165.1	-4.3	0	0	113.2
1079	F	25.9	Very low	28.9	Very low	191 Å²	191	132.8 Å²	132.8	84%	0.838	75%	0.751	S	S	*	*			trans	-162.8	100.7	133	-84	-64.8	0	0	0	106.3
1080	N	26.5	Very low	28.5	Very low	108 Å²	108	139.5 Å²	139.5	58%	0.578	76%	0.758	S	S	*	*				77	113.6	83.5	-93.8	-41.4	0	0	0	114.5	N1082	N1080-N1082 PolarHBondContact OD1-ND2 3.24Å
1081	L	32.5	Very low	28.4	Very low	178 Å²	178	135.4 Å²	135.4	93%	0.932	75%	0.754	S	S	*	*			trans	-153.3	109.5	130.9	-107.9	166.4	0	0	0	108
1082	N	27	Very low	28.3	Very low	138 Å²	138	135.7 Å²	135.7	74%	0.738	76%	0.762	S	S	*	*			trans	-88.8	154.9	-177.1	-62.2	-66	0	0	0	111.1	N1080	N1080-N1082 PolarHBondContact OD1-ND2 3.24Å
1083	G	28.3	Very low	28.2	Very low	67 Å²	67	135.7 Å²	135.7	69%	0.691	77%	0.769	S	S	*	*			trans	-157.3	24.1	-168.7	0	0	0	0	0	119.8
1084	Y	30.4	Very low	28.3	Very low	244 Å²	244	133 Å²	133	96%	0.957	76%	0.762	S	S	*	*			trans	63.9	140.7	169	-62.9	-90.4	0	0	0	118.9
1085	G	35.6	Very low	28.5	Very low	68 Å²	68	135.8 Å²	135.8	70%	0.701	77%	0.77	S	S	*	*			cis	176.4	173.5	-8.6	0	0	0	0	0	116.2
1086	A	33.4	Very low	28.7	Very low	93 Å²	93	138.4 Å²	138.4	77%	0.769	77%	0.771	S	S	*	*			trans	65.4	103.3	160.3	0	0	0	0	0	121.4
1087	N	30.7	Very low	28.9	Very low	153 Å²	153	139.3 Å²	139.3	82%	0.818	77%	0.772	S	S	*	*				44.4	153.7	111.8	-72.5	-2.2	0	0	0	122.2
1088	P	37.3	Very low	29.2	Very low	118 Å²	118	138.5 Å²	138.5	77%	0.766	76%	0.764	S	S	*	*			cis	-129.5	172.3	16.1	43.4	-29.6	0	0	0	116.7
1089	F	25	Very low	29.5	Very low	184 Å²	184	134 Å²	134	81%	0.807	75%	0.754	S	S	*	*			trans	-66.5	150	154.2	-77.8	-124.5	0	0	0	110.1
1090	Y	25.6	Very low	29.6	Very low	233 Å²	233	130.7 Å²	130.7	91%	0.914	75%	0.749	S	S	*	*				-162.1	157	108.7	-117.2	-82.4	0	0	0	111.5
1091	A	30.9	Very low	29.7	Very low	87 Å²	87	132.7 Å²	132.7	72%	0.719	76%	0.755	S	S	*	*			trans	-97.4	174.7	177.9	0	0	0	0	0	112
1092	A	26.3	Very low	29.7	Very low	109 Å²	109	129.8 Å²	129.8	90%	0.901	74%	0.741	S	S	*	*			trans	71.7	135.2	-175.5	0	0	0	0	0	115.3
1093	G	26.2	Very low	30	Very low	67 Å²	67	126.7 Å²	126.7	69%	0.691	74%	0.741	S	S	*	*			cis	177.8	177.4	-6.2	0	0	0	0	0	114.8
1094	S	27.8	Very low	30.1	Very low	97 Å²	97	129.9 Å²	129.9	68%	0.678	74%	0.742	S	S	*	*			trans	41.1	114.6	152.8	58.7	0	0	0	0	120.1
1095	D	30	Very low	30.1	Very low	143 Å²	143	125 Å²	125	77%	0.765	73%	0.732	S	S	*	*				44.5	83.2	118.3	-48.2	-47.8	0	0	0	118.5
1096	Y	28.6	Very low	30.1	Very low	199 Å²	199	130.2 Å²	130.2	78%	0.78	74%	0.738	S	S	*	*			trans	-141.7	95.2	151.7	-109.6	-97.6	0	0	0	106.4	Q1098	Y1096-Q1098 VanDerWaalsContact C-N 3.29Å; Y1096-Q1098 HydrophobicContact CD1-CB 3.93Å; Y1096-Q1098 HydrophobicContact CE1-CB 4.08Å
1097	H	28.6	Very low	30	Very low	158 Å²	158	130.5 Å²	130.5	73%	0.731	73%	0.734	S	S	*	*			cis	49.8	40.1	25.8	-151.7	-68.7	0	0	0	114.6
1098	Q	32	Very low	30.2	Very low	114 Å²	114	128.5 Å²	128.5	53%	0.533	74%	0.739	S	S	.	*			trans	-144.4	102.4	136.7	-112	147.6	-44.8	0	0	108.6	Y1096	Y1096-Q1098 VanDerWaalsContact C-N 3.29Å; Y1096-Q1098 HydrophobicContact CD1-CB 3.93Å; Y1096-Q1098 HydrophobicContact CE1-CB 4.08Å
1099	A	31.2	Very low	30	Very low	65 Å²	65	126 Å²	126	54%	0.537	74%	0.735	S	S	.	*			cis	54.8	102.6	18.4	0	0	0	0	0	112.5
1100	V	28.1	Very low	30.1	Very low	121 Å²	121	125.3 Å²	125.3	73%	0.733	74%	0.738	S	S	*	*			trans	62.7	121.6	-157.7	-137.1	0	0	0	0	108.3
1101	Q	28.4	Very low	30.3	Very low	150 Å²	150	119.1 Å²	119.1	70%	0.701	73%	0.726	S	S	*	*				-148	149.8	51.7	-84.4	169.4	5.6	0	0	113.6
1102	N	32.7	Very low	30.1	Very low	117 Å²	117	121.6 Å²	121.6	63%	0.626	73%	0.727	S	S	*	*			trans	58.3	88.2	153	-47.5	-14.2	0	0	0	115.2	L1104	N1102-L1104 HydrophobicContact CB-CD1 3.89Å; N1102-L1104 VanDerWaalsContact OD1-CD1 3.28Å; N1102-L1104 WeakPolarHBondContact OD1-CD1 3.4Å
1103	G	32.4	Very low	30.1	Very low	73 Å²	73	124.8 Å²	124.8	75%	0.753	72%	0.721	S	S	*	*			cis	66.5	-173.8	17.5	0	0	0	0	0	112.4
1104	L	31.6	Very low	30.3	Very low	134 Å²	134	127.3 Å²	127.3	70%	0.702	72%	0.718	S	S	*	*			trans	66.7	142.9	-176	-61.7	124.5	0	0	0	114.9	N1102	N1102-L1104 HydrophobicContact CB-CD1 3.89Å; N1102-L1104 VanDerWaalsContact OD1-CD1 3.28Å; N1102-L1104 WeakPolarHBondContact OD1-CD1 3.4Å
1105	L	30.6	Very low	30.3	Very low	143 Å²	143	131.1 Å²	131.1	75%	0.749	72%	0.719	S	S	*	*			cis	-159.4	-176	-28.5	-139.5	57.4	0	0	0	106.4
1106	Q	33.9	Very low	30.4	Very low	176 Å²	176	126 Å²	126	82%	0.822	70%	0.699	S	S	*	*			trans	79.1	135	178.2	-50.5	176.3	11.7	0	0	115.4
1107	S	31.9	Very low	30.6	Very low	99 Å²	99	120.4 Å²	120.4	69%	0.692	68%	0.679	S	S	*	*			cis	-167.6	131.5	-16.5	47.8	0	0	0	0	110.4
1108	A	35.8	Very low	30.7	Very low	111 Å²	111	114.1 Å²	114.1	92%	0.917	65%	0.651	S	S	*	*			trans	57.9	146.7	169.3	0	0	0	0	0	117.3
1109	G	32.5	Very low	30.9	Very low	67 Å²	67	112.4 Å²	112.4	69%	0.691	65%	0.65	S	S	*	*			cis	-173.4	144.9	-6.9	0	0	0	0	0	112.1
1110	I	27.8	Very low	30.8	Very low	169 Å²	169	113.6 Å²	113.6	87%	0.867	64%	0.641	S	S	*	*			trans	-39.4	149.7	148.3	22.2	173.4	0	0	0	110.9
1111	P	29.6	Very low	30.9	Very low	102 Å²	102	110.8 Å²	110.8	66%	0.662	64%	0.637	S	S	*	*			cis	-148.9	-179.3	38.6	45.8	-26.7	0	0	0	118
1112	L	26.9	Very low	31	Very low	139 Å²	139	115.3 Å²	115.3	73%	0.728	65%	0.649	S	S	*	*			trans	41.5	117.7	133.9	-67.3	169.3	0	0	0	119.5
1113	F	26.1	Very low	31	Very low	177 Å²	177	113.3 Å²	113.3	78%	0.776	66%	0.656	S	S	*	*				83.5	166.1	75.3	-98.8	-127.3	0	0	0	114.2
1114	N	29.5	Very low	30.9	Very low	120 Å²	120	115.6 Å²	115.6	64%	0.642	66%	0.655	S	S	*	*			trans	69.7	116.4	163.2	-67.1	-3.6	0	0	0	116
1115	Y	29.1	Very low	30.9	Very low	177 Å²	177	116.7 Å²	116.7	69%	0.694	66%	0.662	S	S	*	*				58.5	130.4	76.2	-65.9	-143.4	0	0	0	111.3
1116	G	31.1	Very low	31	Very low	34 Å²	34	116.6 Å²	116.6	35%	0.351	66%	0.662	S	S	.	*			cis	173.2	-157.3	5.2	0	0	0	0	0	113.6
1117	F	32.1	Very low	31	Very low	82 Å²	82	115 Å²	115	36%	0.36	66%	0.664	S	S	.	*			trans	73	144.8	164.2	-63.4	-93.3	0	0	0	121.6	E45 R48 T51 G52	E45-F1117 WeakPolarHBondContact OE1-CE1 3.22Å; E45-F1117 WeakPolarHBondContact OE2-CZ 3.36Å; R48-F1117 HydrophobicContact CB-CD1 4.45Å; R48-F1117 VanDerWaalsContact CD-CD1 3.47Å; R48-F1117 HydrophobicContact CG-CD1 4.12Å; R48-F1117 CarbonylContact O-C 3.59Å; R48-F1117 WeakPolarHBondContact O-CA 3.45Å; T51-F1117 CarbonylContact C-O 3.51Å; T51-F1117 PolarHBondContact N-O 3.28Å; G52-F1117 PolarHBondContact N-O 3.34Å; G52-F1117 VanDerWaalsContact N-O 3.14Å
1118	N	32.1	Very low	31.1	Very low	27 Å²	27	115.6 Å²	115.6	14%	0.144	66%	0.664	C	S	.	*			trans	-136.2	166.7	-165.7	-166	5.1	0	0	0	102.6	A47 R48 T51 Y1120	A47-N1118 PolarHBondContact O-ND2 3.49Å; R48-N1118 HydrophobicContact CB-CB 3.88Å; R48-N1118 HydrophobicContact CG-CB 3.11Å; R48-N1118 PolarHBondContact NE-O 2.9Å; R48-N1118 PolarHBondContact NH2-O 3.44Å; R48-N1118 VanDerWaalsContact NH2-O 3.08Å; R48-N1118 VanDerWaalsContact O-CA 3.28Å; R48-N1118 WeakPolarHBondContact O-CA 3.46Å; R48-N1118 WeakPolarHBondContact O-CB 3.47Å; R48-N1118 PolarHBondContact O-N 3.06Å; T51-N1118 CarbonylContact O-C 3.55Å; T51-N1118 VanDerWaalsContact O-CA 3.22Å; T51-N1118 WeakPolarHBondContact O-CA 3.3Å; T51-N1118 WeakPolarHBondContact OG1-CA 3.3Å; T51-N1118 VanDerWaalsContact OG1-CG 3.3Å; T51-N1118 PolarHBondContact OG1-OD1 3.07Å; N1118-Y1120 PolarHBondContact OD1-N 3.16Å
1119	P	34.6	Very low	31	Very low	78 Å²	78	116.8 Å²	116.8	51%	0.506	66%	0.655	S	S	.	*				-146.5	157.8	99.5	33.2	-16.1	0	0	0	116.1
1120	Y	30	Very low	31.2	Very low	90 Å²	90	123 Å²	123	35%	0.353	66%	0.657	S	S	.	*				0	125.6	122.6	-46.1	-83.7	0	0	0	113.8	F44 N1118	F44-Y1120 VanDerWaalsContact CA-OH 3.27Å; F44-Y1120 WeakPolarHBondContact CA-OH 3.48Å; F44-Y1120 HydrophobicContact CB-CE2 4.48Å; F44-Y1120 WeakPolarHBondContact CB-OH 3.49Å; F44-Y1120 HydrophobicContact CD1-CD1 4.45Å; F44-Y1120 HydrophobicContact CD1-CD2 4.42Å; F44-Y1120 AromaticContact CD1-CE1 3.67Å; F44-Y1120 HydrophobicContact CD1-CE1 3.67Å; F44-Y1120 AromaticContact CD1-CE2 3.66Å; F44-Y1120 HydrophobicContact CD1-CE2 3.66Å; F44-Y1120 AromaticContact CD1-CZ 3.23Å; F44-Y1120 VanDerWaalsContact CD1-OH 3.25Å; F44-Y1120 WeakPolarHBondContact CD1-OH 3.25Å; F44-Y1120 AromaticContact CE1-CD1 4Å; F44-Y1120 HydrophobicContact CE1-CD1 4Å; F44-Y1120 AromaticContact CE1-CE1 3.38Å; F44-Y1120 HydrophobicContact CE1-CE1 3.38Å; F44-Y1120 HydrophobicContact CE1-CE2 4.17Å; F44-Y1120 AromaticContact CE1-CZ 3.52Å; F44-Y1120 HydrophobicContact CG-CE1 4.35Å; F44-Y1120 HydrophobicContact CG-CE2 4.31Å; F44-Y1120 AromaticContact CG-CZ 3.71Å; F44-Y1120 WeakPolarHBondContact CG-OH 3.32Å; F44-Y1120 AromaticContact CZ-CE1 3.86Å; F44-Y1120 HydrophobicContact CZ-CE1 3.86Å; F44-Y1120 PolarHBondContact O-OH 3.34Å; N1118-Y1120 PolarHBondContact OD1-N 3.16Å
1121	G	30.2	Very low	31.5	Very low	62 Å²	62	125.4 Å²	125.4	64%	0.639	66%	0.655	S	S	*	*			cis	124.7	-168.8	34	0	0	0	0	0	108.2
1122	Y	30.3	Very low	31.7	Very low	244 Å²	244	126.5 Å²	126.5	96%	0.957	65%	0.654	S	S	*	*			trans	66.6	161.8	-175.6	-61.9	-87.7	0	0	0	115.5
1123	G	33	Very low	32.1	Very low	75 Å²	75	123.5 Å²	123.5	77%	0.773	65%	0.649	S	S	*	*			trans	132.1	101.1	-171.8	0	0	0	0	0	110.9
1124	V	29.7	Very low	32.7	Very low	121 Å²	121	122.4 Å²	122.4	73%	0.733	65%	0.647	S	S	*	*			trans	-136.9	138.8	177.1	-178.1	0	0	0	0	106.6
1125	D	32.4	Very low	32.9	Very low	158 Å²	158	122.6 Å²	122.6	85%	0.845	65%	0.652	S	S	*	*			trans	-172.4	164.3	139.1	-101.3	-27.2	0	0	0	113.8
1126	N	31.6	Very low	33.3	Very low	141 Å²	141	120.1 Å²	120.1	75%	0.754	65%	0.65	S	S	*	*			trans	-126.9	138.5	178	-54.6	-101.4	0	0	0	109.7
1127	V	35.3	Very low	33.5	Very low	143 Å²	143	126 Å²	126	87%	0.867	67%	0.669	S	S	*	*			trans	-134.3	148.3	164.8	-173.6	0	0	0	0	111
1128	T	34.4	Very low	33.6	Very low	110 Å²	110	127.9 Å²	127.9	68%	0.675	69%	0.687	S	S	*	*			trans	-104	179.9	-171.8	53	0	0	0	0	111.6
1129	N	33.4	Very low	33.8	Very low	137 Å²	137	130.3 Å²	130.3	73%	0.733	71%	0.711	S	S	*	*				153.1	172.7	96	-134.6	-38.8	0	0	0	115
1130	R	35.2	Very low	33.8	Very low	196 Å²	196	134.1 Å²	134.1	74%	0.74	73%	0.725	S	S	*	*			trans	75.6	145.7	162.3	-73.6	166.6	179.1	177.9	-1.3	117.2	I1132	R1130-I1132 HydrophobicContact CG-CD1 4.2Å
1131	R	34.2	Very low	34.3	Very low	221 Å²	221	135 Å²	135	83%	0.834	74%	0.742	S	S	*	*			cis	-143.5	160.3	4.5	-113.7	175.2	-100.4	-146.8	-1.6	107.4
1132	I	33.8	Very low	34.5	Very low	125 Å²	125	137.9 Å²	137.9	64%	0.641	75%	0.748	S	S	*	*			cis	175.4	172.6	-30.7	-110.8	167.2	0	0	0	106.5	R1130	R1130-I1132 HydrophobicContact CG-CD1 4.2Å
1133	A	35.2	Very low	34.7	Very low	75 Å²	75	131.1 Å²	131.1	62%	0.62	74%	0.743	S	S	*	*			trans	75.6	136.6	165.5	0	0	0	0	0	117.4
1134	E	38.6	Very low	34.8	Very low	155 Å²	155	131.2 Å²	131.2	72%	0.724	74%	0.744	S	S	*	*			cis	-164.8	135.2	-12.8	-127.6	138.2	-125.7	0	0	112
1135	T	35.4	Very low	35	Very low	123 Å²	123	128.5 Å²	128.5	76%	0.755	74%	0.74	S	S	*	*			trans	54.1	164.3	143.9	57	0	0	0	0	120.7
1136	L	36.3	Very low	35.1	Very low	125 Å²	125	127.6 Å²	127.6	65%	0.654	74%	0.74	S	S	*	*			cis	-150.4	148.2	1.3	-153.4	74.6	0	0	0	109
1137	E	35.8	Very low	35.2	Very low	158 Å²	158	125.9 Å²	125.9	74%	0.738	74%	0.739	S	S	*	*			trans	40.4	165.9	145.2	-71.3	164.3	-147.4	0	0	123.5
1138	T	34.4	Very low	35.1	Very low	121 Å²	121	123.8 Å²	123.8	74%	0.742	73%	0.731	S	S	*	*			cis	-170.8	165.6	-31.2	-85	0	0	0	0	108.6
1139	A	35.6	Very low	35	Very low	79 Å²	79	123.4 Å²	123.4	65%	0.653	73%	0.733	S	S	*	*			trans	70.3	123.2	171.7	0	0	0	0	0	116.9
1140	I	35.9	Very low	35.1	Very low	157 Å²	157	122.7 Å²	122.7	81%	0.805	73%	0.733	S	S	*	*			cis	73.2	124.1	31.3	-42.9	160.2	0	0	0	112.7
1141	P	40.3	Very low	35.1	Very low	108 Å²	108	120.1 Å²	120.1	70%	0.701	74%	0.739	S	S	*	*			cis	-142.2	-153.8	-40.9	38.8	-16.6	0	0	0	112.3
1142	T	34.1	Very low	35.1	Very low	123 Å²	123	113.1 Å²	113.1	76%	0.755	74%	0.735	S	S	*	*			trans	106.9	125.6	146	-32.1	0	0	0	0	119.9
1143	A	33.4	Very low	35.1	Very low	103 Å²	103	112.3 Å²	112.3	85%	0.851	74%	0.741	S	S	*	*			trans	48.3	137.8	153	0	0	0	0	0	122.6
1144	G	35.3	Very low	35.1	Very low	77 Å²	77	114.6 Å²	114.6	79%	0.794	75%	0.753	S	S	*	*			trans	174.8	138.9	165.8	0	0	0	0	0	111.2
1145	G	34.5	Very low	35	Very low	64 Å²	64	112.7 Å²	112.7	66%	0.66	76%	0.756	S	S	*	*			trans	-60.2	153	-177.9	0	0	0	0	0	114.1
1146	T	33.7	Very low	34.8	Very low	139 Å²	139	110 Å²	110	85%	0.853	75%	0.752	S	S	*	*				43.1	118.4	87.8	67.4	0	0	0	0	112.3
1147	S	34.4	Very low	34.6	Very low	104 Å²	104	108 Å²	108	73%	0.727	76%	0.762	S	S	*	*				-170.4	174.7	58.1	48.5	0	0	0	0	112.8
1148	S	33.6	Very low	34.4	Very low	99 Å²	99	106 Å²	106	69%	0.692	77%	0.766	S	S	*	*			trans	46	139.1	145.7	55.9	0	0	0	0	121.5
1149	S	32.5	Very low	34	Very low	102 Å²	102	105.6 Å²	105.6	71%	0.713	77%	0.767	S	S	*	*			cis	176.1	-168	-2.4	49.7	0	0	0	0	107.8
1150	V	35.1	Very low	33.8	Very low	123 Å²	123	107.9 Å²	107.9	75%	0.745	77%	0.773	S	S	*	*			trans	66.3	93.1	168.8	-168	0	0	0	0	115.1
1151	V	36	Very low	33.5	Very low	141 Å²	141	112.7 Å²	112.7	86%	0.855	78%	0.781	S	S	*	*				77.7	117.5	70.2	175.5	0	0	0	0	114.4
1152	G	33.4	Very low	33.1	Very low	74 Å²	74	113.3 Å²	113.3	76%	0.763	78%	0.778	S	S	*	*			trans	179.2	129.3	170.5	0	0	0	0	0	109.7
1153	S	33.8	Very low	32.9	Very low	109 Å²	109	116 Å²	116	76%	0.762	78%	0.779	S	S	*	*			trans	-131.9	155.8	-157.8	-64.6	0	0	0	0	115.5
1154	S	34	Very low	33	Very low	123 Å²	123	120.3 Å²	120.3	86%	0.86	78%	0.779	S	S	*	*			trans	71.3	157.8	169.3	81.3	0	0	0	0	115.5
1155	S	37.3	Very low	32.8	Very low	115 Å²	115	125.9 Å²	125.9	80%	0.804	78%	0.776	S	S	*	*			cis	-145	-171	20.3	57.4	0	0	0	0	113.5
1156	G	32.3	Very low	32.8	Very low	65 Å²	65	128.4 Å²	128.4	67%	0.67	78%	0.778	S	S	*	*			trans	-81.8	160.6	-170.9	0	0	0	0	0	116.3
1157	G	31.1	Very low	32.7	Very low	84 Å²	84	127.6 Å²	127.6	87%	0.866	77%	0.765	S	S	*	*			trans	-155.6	129.3	172.1	0	0	0	0	0	110.6
1158	S	31.1	Very low	32.6	Very low	116 Å²	116	131.1 Å²	131.1	81%	0.811	77%	0.77	S	S	*	*			trans	-104.2	165.5	-174.3	-168.1	0	0	0	0	112.5
1159	C	26.1	Very low	32.5	Very low	112 Å²	112	133.6 Å²	133.6	76%	0.757	77%	0.772	S	S	*	*			trans	71.8	168.2	171.8	-73.2	0	0	0	0	118.4
1160	T	31.2	Very low	32.3	Very low	128 Å²	128	138.9 Å²	138.9	79%	0.785	78%	0.783	S	S	*	*			trans	52.7	65.4	173.9	57.1	0	0	0	0	117.3	D1162	T1160-D1162 PolarHBondContact O-N 3.43Å; T1160-D1162 VanDerWaalsContact O-N 3.1Å
1161	R	31.1	Very low	32.2	Very low	258 Å²	258	138.4 Å²	138.4	97%	0.974	78%	0.78	S	S	*	*			trans	-80.9	70.9	148.9	-164	170	-168.6	151	5.8	110.3
1162	D	31.8	Very low	32	Very low	121 Å²	121	139.9 Å²	139.9	65%	0.647	78%	0.776	S	S	*	*			trans	-71.8	176.9	166.3	-149.6	-32	0	0	0	110.4	T1160	T1160-D1162 PolarHBondContact O-N 3.43Å; T1160-D1162 VanDerWaalsContact O-N 3.1Å
1163	K	30.1	Very low	31.9	Very low	178 Å²	178	144.4 Å²	144.4	77%	0.774	78%	0.782	S	S	*	*			trans	50.5	92.2	163.2	-64.2	178.6	-177.2	175.7	0	117.3
1164	K	34.5	Very low	32	Very low	194 Å²	194	144.9 Å²	144.9	84%	0.843	78%	0.775	S	S	*	*				-169.2	110.9	114	-96.1	166.2	-176.1	-172.1	0	105.1
1165	R	31.7	Very low	31.8	Very low	195 Å²	195	144.7 Å²	144.7	74%	0.736	77%	0.773	S	S	*	*			cis	38.8	67.1	41.9	-122.8	-169.4	-168.9	-162.3	9.7	110.1	E1167	R1165-E1167 WeakPolarHBondContact CD-OE1 3.38Å; R1165-E1167 HydrophobicContact CG-CG 4.08Å; R1165-E1167 IonicContact CZ-OE1 2.71Å; R1165-E1167 VanDerWaalsContact CZ-OE1 3.24Å; R1165-E1167 IonicContact NE-OE1 2.67Å; R1165-E1167 PolarHBondContact NE-OE1 3.49Å; R1165-E1167 IonicContact NH1-OE1 2.76Å; R1165-E1167 PolarHBondContact NH1-OE1 3.47Å; R1165-E1167 PolarHBondContact O-N 2.95Å; R1165-E1167 VanDerWaalsContact O-N 3.13Å
1166	V	33.4	Very low	31.9	Very low	116 Å²	116	144.1 Å²	144.1	70%	0.703	77%	0.769	S	S	*	*			trans	-73	86.3	150.2	177.4	0	0	0	0	105.3	Q1168	V1166-Q1168 VanDerWaalsContact C-N 3.25Å; V1166-Q1168 HydrophobicContact CG1-CB 4.48Å; V1166-Q1168 HydrophobicContact CG1-CG 3.91Å; V1166-Q1168 PolarHBondContact O-N 3.16Å; V1166-Q1168 VanDerWaalsContact O-N 3.13Å
1167	E	31.8	Very low	32	Very low	123 Å²	123	149 Å²	149	58%	0.575	78%	0.78	S	S	*	*			trans	-68.6	94.4	154.1	-76.5	154.2	145.7	0	0	106.1	R1165 M1169	R1165-E1167 WeakPolarHBondContact CD-OE1 3.38Å; R1165-E1167 HydrophobicContact CG-CG 4.08Å; R1165-E1167 IonicContact CZ-OE1 2.71Å; R1165-E1167 VanDerWaalsContact CZ-OE1 3.24Å; R1165-E1167 IonicContact NE-OE1 2.67Å; R1165-E1167 PolarHBondContact NE-OE1 3.49Å; R1165-E1167 IonicContact NH1-OE1 2.76Å; R1165-E1167 PolarHBondContact NH1-OE1 3.47Å; R1165-E1167 PolarHBondContact O-N 2.95Å; R1165-E1167 VanDerWaalsContact O-N 3.13Å; E1167-M1169 PolarHBondContact O-N 3.13Å
1168	Q	33.4	Very low	32.2	Very low	178 Å²	178	151.6 Å²	151.6	83%	0.832	77%	0.773	S	S	*	*			trans	-82.5	99.4	152.5	-89.8	-179.4	-47.8	0	0	106.3	V1166 F1170	V1166-Q1168 VanDerWaalsContact C-N 3.25Å; V1166-Q1168 HydrophobicContact CG1-CB 4.48Å; V1166-Q1168 HydrophobicContact CG1-CG 3.91Å; V1166-Q1168 PolarHBondContact O-N 3.16Å; V1166-Q1168 VanDerWaalsContact O-N 3.13Å; Q1168-F1170 PolarHBondContact O-N 3.2Å
1169	M	30.7	Very low	32.3	Very low	151 Å²	151	155.4 Å²	155.4	74%	0.744	78%	0.778	S	S	*	*			trans	-57.4	131.8	166.7	-58.5	155.7	77	0	0	107.8	E1167	E1167-M1169 PolarHBondContact O-N 3.13Å
1170	F	27.9	Very low	32.8	Very low	212 Å²	212	157 Å²	157	93%	0.93	78%	0.779	S	S	*	*				-134.9	129.2	129.8	-100.7	-74	0	0	0	108.7	Q1168	Q1168-F1170 PolarHBondContact O-N 3.2Å
1171	T	33.9	Very low	33.1	Very low	114 Å²	114	161.2 Å²	161.2	70%	0.699	80%	0.804	S	S	*	*			trans	-62.5	161.3	-163.6	36.9	0	0	0	0	116
1172	F	31.4	Very low	33.2	Very low	172 Å²	172	156.4 Å²	156.4	75%	0.754	80%	0.796	S	S	*	*			trans	-56.3	164.1	159.3	-78.6	-121.5	0	0	0	112.2	D1174	F1172-D1174 WeakPolarHBondContact CD1-OD2 3.39Å
1173	L	32	Very low	33.2	Very low	169 Å²	169	158.2 Å²	158.2	89%	0.885	80%	0.804	S	S	*	*			trans	-144	135.3	131.5	-108.9	170.5	0	0	0	109.3
1174	D	34.3	Very low	33.4	Very low	118 Å²	118	157.1 Å²	157.1	63%	0.631	81%	0.805	S	S	*	*			trans	-109.6	145.3	171.9	-68.6	-72.2	0	0	0	109.3	F1172	F1172-D1174 WeakPolarHBondContact CD1-OD2 3.39Å
1175	C	31.7	Very low	33.4	Very low	120 Å²	120	154.9 Å²	154.9	81%	0.811	80%	0.803	S	S	*	*			trans	-149.6	130.3	148.7	-77.6	0	0	0	0	104.3
1176	S	37.7	Very low	33.5	Very low	102 Å²	102	152.4 Å²	152.4	71%	0.713	81%	0.807	S	S	*	*			cis	64.1	87.8	33.3	-49.2	0	0	0	0	112.7
1177	D	34.4	Very low	33.5	Very low	169 Å²	169	154.9 Å²	154.9	90%	0.904	81%	0.814	S	S	*	*			trans	-96.9	127.7	152.8	-71.6	-50.2	0	0	0	107.7
1178	D	35.2	Very low	33.6	Very low	137 Å²	137	157.1 Å²	157.1	73%	0.733	83%	0.832	S	S	*	*			trans	-77.5	150	167.6	-63.5	-72.5	0	0	0	110.4
1179	E	34.2	Very low	33.6	Very low	196 Å²	196	155.5 Å²	155.5	92%	0.916	83%	0.831	S	S	*	*			trans	-129.5	121.7	147.8	-91.4	-95	98.9	0	0	106.6
1180	N	36.8	Very low	33.8	Very low	146 Å²	146	155.9 Å²	155.9	78%	0.781	84%	0.839	S	S	*	*			trans	-91.8	105	-178.2	-78.3	-94.4	0	0	0	110.7
1181	V	36.6	Very low	34.4	Very low	216 Å²	216	150.8 Å²	150.8	100%	1.309	83%	0.831	S	S	*	*			trans	-144	0	149.1	-174.8	0	0	0	0	109.4

Retrieved 1,181 of 1,181 residues in 303.1 ms (Link to these results)

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