A0A5K4F1U7_SCHMA Loading...

C2H2-type domain-containing protein

AlphaFold DB , UniProt , Accession A0A5K4F1U7, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 918 aa.

						>A0A5K4F1U7_SCHMA|A0A5K4F1U7
MLHRPTLMPPSMGSSSKFNLSTNSQHSSQSIKIENCLDYNGGEKVIIGPTDPDEDRMKQEDITYDIVLKKEQEDYAEEDYNENDEDMNSNESHMKSESHIPVSNIKLDELTGNETAVTVTTDSVKPIGILPLNDAIQNLLTCIPHGAATIQNVPLQPILSSKMNGSESVQMPNVVSNTLPTLWLHSPVVNSTGMSMPNVTSVTDLTSNIVQNTANALNPLVAAVLVNCATVNMISQLAGSMCTPIVNSSVMDGNVNGSNVNNNDNHTSVNGSVSIGNVGVGVNGGVSGINTVTIPTASLLPNLLSAIPLPTYISGLELNTSGGIITSPNNLCDVRVTHTVVSSAKTLNTNNNNGIIVTPLNVENITVSPSSCRNQAERNDVMYSTEISVVNNSSNKIVENTKNNNDNNVTTVSSESFQSYMIIPDSRTMFSTVPAKELRKYHCTYPGCEKSYTRRFQLNQHILTHIITGPISCDAPNCSMKYFSEEDLKRHKLFKHSSANKDSCRQQDCTIPECDESYSEKHSEITTISSNVLPKSTEPVETRNTTSTTLNIQKNRTLPPIAPKSTISLPTNLIFRNVCTYPGCGKSYSSYSKLKLHLRSHKCEKYYVCRKPGCNATFTQLSGVRSHELSHISIHKSSERLDQYPITMIDNIFGTSLDTSQLKLNSQSNAEITNISPDVLLKSIEPMEITSEISIAPNIHENRSLPLVVPNSSVPLPKPFILTASWDSEMKLLYVCPFKECGKAFTKRSKLHEHVCRHMGVRPFVCDKCKASFVQKYELRRHSIIHLRGAQPRSLSRFFTTPQQTNETLESIIANSQIPVSTTPITTTYATYTTNTIPTVTTPVSATSLISDTTNPTISTVPVSISTLKVEEEPVLIKMEGVTEESTNVRPYDTDDQNSTHKLLYTLLQSNCETLQSS
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	41.2	Very low	30.8	Very low	240 Å²	240	152.3 Å²	152.3	100%	1.182	81%	0.812	S	S	*	*				0	123.4	0	-66.7	167.1	170.3	0	0	106.8
2	L	32.2	Very low	30.7	Very low	155 Å²	155	155.2 Å²	155.2	81%	0.812	82%	0.821	S	S	*	*			cis	-131.1	139	-10.7	-84.4	166.8	0	0	0	108.2
3	H	34.2	Very low	30.4	Very low	159 Å²	159	147.6 Å²	147.6	74%	0.736	80%	0.803	S	S	*	*			trans	50.9	121.6	167.2	-74	-111.8	0	0	0	118.9
4	R	28.5	Very low	30.4	Very low	223 Å²	223	145.9 Å²	145.9	84%	0.842	81%	0.807	S	S	*	*				87.2	134.8	52.6	-164.7	176.2	-168.6	-168.6	0.4	110.7
5	P	37.9	Very low	30	Very low	106 Å²	106	143 Å²	143	69%	0.688	80%	0.801	S	S	*	*			trans	-125.4	-147.7	-136.2	44.4	-30.6	0	0	0	113.1
6	T	25.8	Very low	30.1	Very low	115 Å²	115	141.4 Å²	141.4	71%	0.706	80%	0.802	S	S	*	*			trans	83.6	154.1	160.2	-0.4	0	0	0	0	117.9
7	L	24.1	Very low	30	Very low	160 Å²	160	143.4 Å²	143.4	84%	0.838	80%	0.8	S	S	*	*			trans	73.4	141.4	157.9	-64	159.5	0	0	0	118.8
8	M	31.8	Very low	29.9	Very low	179 Å²	179	146.7 Å²	146.7	88%	0.882	81%	0.805	S	S	*	*			trans	-78.9	141.5	162.6	-60.9	172.4	67.3	0	0	110
9	P	30.3	Very low	29.6	Very low	116 Å²	116	146.2 Å²	146.2	75%	0.753	80%	0.801	S	S	*	*			trans	-92.1	158.1	152.5	-9.1	28.4	0	0	0	111.4
10	P	25.5	Very low	29.5	Very low	121 Å²	121	147.1 Å²	147.1	79%	0.786	80%	0.804	S	S	*	*			trans	-95	176	-168.8	38.1	-37.8	0	0	0	115
11	S	27.6	Very low	29.3	Very low	101 Å²	101	145.3 Å²	145.3	71%	0.706	80%	0.803	S	S	*	*			trans	-52.7	150.8	162.8	55.7	0	0	0	0	114.5
12	M	29	Very low	28.8	Very low	187 Å²	187	140.3 Å²	140.3	92%	0.921	79%	0.786	S	S	*	*				-164.4	151.6	124.6	-80.3	-128.7	135.9	0	0	109.6
13	G	26.5	Very low	28.4	Very low	57 Å²	57	140.4 Å²	140.4	59%	0.588	79%	0.787	S	S	*	*			cis	150.2	69.8	-8.7	0	0	0	0	0	115.8
14	S	30.8	Very low	28.1	Very low	123 Å²	123	137.4 Å²	137.4	86%	0.86	78%	0.784	S	S	*	*			trans	-152.4	103.6	171.3	55.4	0	0	0	0	110.5
15	S	25.1	Very low	28.1	Very low	103 Å²	103	134.8 Å²	134.8	72%	0.72	78%	0.781	S	S	*	*			cis	98.9	70.9	20.8	-50.6	0	0	0	0	116
16	S	31.7	Very low	27.7	Very low	117 Å²	117	138.5 Å²	138.5	82%	0.818	79%	0.789	S	S	*	*			trans	-158.9	94	151.5	47.7	0	0	0	0	107.9
17	K	28.6	Very low	27.8	Very low	175 Å²	175	138.1 Å²	138.1	76%	0.761	79%	0.791	S	S	*	*			cis	62	80.7	34	-129.3	-166.9	-168.6	-171.5	0	112.5
18	F	27	Very low	27.9	Very low	203 Å²	203	136 Å²	136	89%	0.89	79%	0.789	S	S	*	*			trans	-128.8	127.4	134.3	-95.5	-82.1	0	0	0	108.5
19	N	25.2	Very low	27.8	Very low	138 Å²	138	136.2 Å²	136.2	74%	0.738	79%	0.788	S	S	*	*			trans	-106.4	145.9	167.5	-78.8	-17.4	0	0	0	106.8
20	L	27.9	Very low	27.7	Very low	163 Å²	163	136.5 Å²	136.5	85%	0.853	79%	0.793	S	S	*	*			trans	-144.2	142.4	144.6	-105.3	146.8	0	0	0	108.4
21	S	24.1	Very low	27.8	Very low	111 Å²	111	138.2 Å²	138.2	78%	0.776	79%	0.794	S	S	*	*			trans	-158.3	119.3	-169.1	174.5	0	0	0	0	109.7
22	T	30	Very low	27.8	Very low	134 Å²	134	141.3 Å²	141.3	82%	0.822	80%	0.795	S	S	*	*			trans	-155.9	149.3	163	34.2	0	0	0	0	111.2
23	N	24.8	Very low	27.8	Very low	158 Å²	158	138.9 Å²	138.9	85%	0.845	78%	0.784	S	S	*	*			trans	-44.2	164.3	164.5	-49	-43.2	0	0	0	113.4
24	S	27	Very low	27.9	Very low	96 Å²	96	141.6 Å²	141.6	67%	0.671	78%	0.782	S	S	*	*			cis	-158.7	159.6	22.8	54.6	0	0	0	0	113.8
25	Q	28.3	Very low	27.8	Very low	168 Å²	168	142.2 Å²	142.2	79%	0.785	78%	0.775	S	S	*	*			trans	35.2	108.8	144.3	-64.2	175.3	-16.7	0	0	118.8
26	H	30	Very low	28	Very low	184 Å²	184	140 Å²	140	85%	0.852	76%	0.759	S	S	*	*				177.9	157.8	111.3	-107.9	-91.1	0	0	0	112.9
27	S	28.4	Very low	28	Very low	107 Å²	107	141 Å²	141	75%	0.748	75%	0.754	S	S	*	*			trans	65.4	135	166.3	-152.8	0	0	0	0	118.6
28	S	25.7	Very low	28.2	Very low	114 Å²	114	139.3 Å²	139.3	80%	0.797	75%	0.754	S	S	*	*			trans	-111.3	123.6	177.4	-60	0	0	0	0	110.5
29	Q	29.9	Very low	28.4	Very low	184 Å²	184	135.9 Å²	135.9	86%	0.86	74%	0.736	S	S	*	*			trans	-132.3	127.6	165	-78.4	-175.2	-25.7	0	0	110	I31	Q29-I31 PolarHBondContact O-N 2.64Å
30	S	28.9	Very low	28.9	Very low	122 Å²	122	136.6 Å²	136.6	85%	0.853	74%	0.74	S	S	*	*			trans	-95.1	98.2	-166.7	-57.8	0	0	0	0	111.9	K32	S30-K32 PolarHBondContact O-N 3.21Å
31	I	27	Very low	28.8	Very low	157 Å²	157	133 Å²	133	81%	0.805	74%	0.742	S	S	*	*			trans	-70.6	114.8	175.2	-57.9	177.3	0	0	0	109.7	Q29 I33	Q29-I31 PolarHBondContact O-N 2.64Å; I31-I33 HydrophobicContact CG2-CG1 4.16Å
32	K	27.6	Very low	29	Very low	166 Å²	166	130.8 Å²	130.8	72%	0.722	74%	0.737	S	S	*	*			trans	-96.5	100.4	-178	-160.9	-166.9	-169.4	-156.3	0	111.1	S30 E34	S30-K32 PolarHBondContact O-N 3.21Å; K32-E34 WeakPolarHBondContact CE-OE1 3.39Å; K32-E34 IonicContact NZ-OE1 3.92Å; K32-E34 PolarHBondContact NZ-OE1 3.03Å
33	I	28.4	Very low	28.9	Very low	136 Å²	136	133.4 Å²	133.4	70%	0.697	74%	0.74	S	S	*	*			trans	-89	109.7	-179.8	-54.7	176.5	0	0	0	110.1	I31	I31-I33 HydrophobicContact CG2-CG1 4.16Å
34	E	29.6	Very low	29.1	Very low	115 Å²	115	134 Å²	134	54%	0.537	74%	0.735	S	S	.	*			trans	-107	98	176.4	-70.7	-166.8	-170.6	0	0	112.6	K32 C36	K32-E34 WeakPolarHBondContact CE-OE1 3.39Å; K32-E34 IonicContact NZ-OE1 3.92Å; K32-E34 PolarHBondContact NZ-OE1 3.03Å; E34-C36 PolarHBondContact O-N 3.33Å
35	N	28.9	Very low	29.3	Very low	136 Å²	136	135.2 Å²	135.2	73%	0.727	74%	0.738	S	S	*	*			trans	-76.1	82.8	178.7	-75.7	-9.8	0	0	0	112.3	L37	N35-L37 VanDerWaalsContact C-N 3.29Å; N35-L37 PolarHBondContact O-N 3.39Å
36	C	28.5	Very low	29.4	Very low	57 Å²	57	133 Å²	133	39%	0.385	73%	0.73	S	S	.	*			trans	-73.7	79.4	171.5	-67.4	0	0	0	0	112.1	E34 D38 C603	E34-C36 PolarHBondContact O-N 3.33Å; C36-D38 PolarHBondContact O-N 3.49Å; C36-C603 WeakPolarHBondContact CB-SG 3.24Å; C36-C603 WeakPolarHBondContact SG-CB 3.21Å; C36-C603 CovalentContact SG-SG 2.05Å; C36-C603 PolarHBondContact SG-SG 2.99Å
37	L	31.9	Very low	29.4	Very low	137 Å²	137	131.6 Å²	131.6	72%	0.717	73%	0.727	S	S	*	*			trans	-53.8	124.5	171.8	-73.7	173	0	0	0	111.8	N35	N35-L37 VanDerWaalsContact C-N 3.29Å; N35-L37 PolarHBondContact O-N 3.39Å
38	D	32.1	Very low	29.5	Very low	140 Å²	140	128.8 Å²	128.8	75%	0.749	72%	0.715	S	S	*	*			trans	-107.2	149.2	-179.5	-148.2	-4	0	0	0	111.4	C36 N40	C36-D38 PolarHBondContact O-N 3.49Å; D38-N40 PolarHBondContact O-N 3.09Å
39	Y	32.8	Very low	29.9	Very low	130 Å²	130	129.1 Å²	129.1	51%	0.51	72%	0.715	S	S	.	*	T	Hydrogen-bonded Turn	trans	-79.9	40.7	-167.5	-94.6	-83.5	0	0	0	114.8	F618	Y39-F618 HydrophobicContact CD2-CE1 4.29Å; Y39-F618 AromaticContact CE2-CD1 3.98Å; Y39-F618 HydrophobicContact CE2-CD1 3.98Å; Y39-F618 AromaticContact CE2-CE1 3.35Å; Y39-F618 HydrophobicContact CE2-CE1 3.35Å; Y39-F618 HydrophobicContact CE2-CZ 4.1Å; Y39-F618 AromaticContact CZ-CE1 3.51Å; Y39-F618 AromaticContact CZ-CZ 3.89Å; Y39-F618 WeakPolarHBondContact OH-CE1 3.5Å; Y39-F618 WeakPolarHBondContact OH-CZ 3.39Å
40	N	34.7	Very low	29.8	Very low	153 Å²	153	127.1 Å²	127.1	82%	0.818	72%	0.715	S	S	*	*	T	Hydrogen-bonded Turn	trans	-138.4	21.9	-179.6	-86.8	-45.1	0	0	0	115.3	D38 G42	D38-N40 PolarHBondContact O-N 3.09Å; N40-G42 VanDerWaalsContact C-N 3.35Å; N40-G42 PolarHBondContact O-N 3.31Å; N40-G42 VanDerWaalsContact O-N 3.16Å
41	G	26.5	Very low	30	Very low	87 Å²	87	127.4 Å²	127.4	90%	0.897	71%	0.707	S	S	*	*	S	Bend	trans	63	30.8	155.6	0	0	0	0	0	116.8
42	G	28	Very low	30.2	Very low	65 Å²	65	126 Å²	126	67%	0.67	71%	0.708	S	S	*	*			trans	-144.4	126.4	171.5	0	0	0	0	0	109.5	N40 K44	N40-G42 VanDerWaalsContact C-N 3.35Å; N40-G42 PolarHBondContact O-N 3.31Å; N40-G42 VanDerWaalsContact O-N 3.16Å; G42-K44 PolarHBondContact O-N 3.05Å
43	E	27.9	Very low	30.6	Very low	189 Å²	189	122.1 Å²	122.1	88%	0.883	70%	0.695	S	S	*	*			trans	-67	131.2	174.9	-66.2	177.7	123.6	0	0	109.5
44	K	28.9	Very low	31	Very low	172 Å²	172	121.7 Å²	121.7	75%	0.748	69%	0.691	S	S	*	*			trans	-124	82.3	169.7	-165.1	-172.5	177.4	-163.5	0	108.7	G42 I46	G42-K44 PolarHBondContact O-N 3.05Å; K44-I46 HydrophobicContact CD-CD1 4.01Å; K44-I46 HydrophobicContact CD-CG1 4.13Å; K44-I46 HydrophobicContact CG-CD1 4.42Å; K44-I46 HydrophobicContact CG-CG1 4.02Å; K44-I46 PolarHBondContact O-N 2.67Å
45	V	30.8	Very low	31.2	Very low	120 Å²	120	122.2 Å²	122.2	73%	0.727	70%	0.697	S	S	*	*			trans	-62.2	117.3	167.3	-176.5	0	0	0	0	107.3	I47	V45-I47 HydrophobicContact CG1-CG1 4.04Å
46	I	30.5	Very low	31.5	Very low	121 Å²	121	122.8 Å²	122.8	62%	0.621	69%	0.689	S	S	*	*			trans	-112.3	100.1	172.4	-57.7	179.7	0	0	0	106.7	K44 G48	K44-I46 HydrophobicContact CD-CD1 4.01Å; K44-I46 HydrophobicContact CD-CG1 4.13Å; K44-I46 HydrophobicContact CG-CD1 4.42Å; K44-I46 HydrophobicContact CG-CG1 4.02Å; K44-I46 PolarHBondContact O-N 2.67Å; I46-G48 PolarHBondContact O-N 3.02Å
47	I	29.6	Very low	31.9	Very low	155 Å²	155	125.4 Å²	125.4	80%	0.795	70%	0.697	S	S	*	*			trans	-82.2	104	164.9	-53.9	179.1	0	0	0	105.8	V45	V45-I47 HydrophobicContact CG1-CG1 4.04Å
48	G	32.1	Very low	32.3	Very low	49 Å²	49	123.2 Å²	123.2	51%	0.505	68%	0.681	S	S	.	*			trans	-77.6	139.6	167.5	0	0	0	0	0	109.7	I46	I46-G48 PolarHBondContact O-N 3.02Å
49	P	32.4	Very low	32.5	Very low	121 Å²	121	123.1 Å²	123.1	79%	0.786	68%	0.676	S	S	*	*			trans	-66.1	139.1	172.1	29.2	-33.8	0	0	0	110.1	D51	P49-D51 PolarHBondContact O-N 3.23Å
50	T	29.9	Very low	32.6	Very low	141 Å²	141	122.7 Å²	122.7	87%	0.865	68%	0.679	S	S	*	*			trans	-81.2	98.3	172.8	-44.8	0	0	0	0	108.6
51	D	31.1	Very low	32.6	Very low	129 Å²	129	120.9 Å²	120.9	69%	0.69	67%	0.67	S	S	*	*			trans	-82.5	126.4	-178.8	-142.7	-29.7	0	0	0	110.2	P49 D53	P49-D51 PolarHBondContact O-N 3.23Å; D51-D53 PolarHBondContact O-N 2.81Å
52	P	32.1	Very low	33.1	Very low	126 Å²	126	121.5 Å²	121.5	82%	0.818	65%	0.651	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.9	6.6	-167	-21.7	35.1	0	0	0	117.4
53	D	35.2	Very low	33.6	Very low	85 Å²	85	122.1 Å²	122.1	46%	0.455	64%	0.642	S	S	.	*	T	Hydrogen-bonded Turn	trans	-101.5	11.5	-162.3	-135.1	13.4	0	0	0	114.5	D51 D55 R56	D51-D53 PolarHBondContact O-N 2.81Å; D53-D55 PolarHBondContact O-N 3Å; D53-D55 VanDerWaalsContact O-N 3.17Å; D53-R56 PolarHBondContact O-N 2.86Å; D53-R56 IonicContact OD1-CZ 2.7Å; D53-R56 IonicContact OD1-NH1 2.69Å; D53-R56 PolarHBondContact OD1-NH1 3.08Å; D53-R56 IonicContact OD1-NH2 3.09Å; D53-R56 IonicContact OD2-CZ 2.71Å; D53-R56 IonicContact OD2-NH1 3.18Å; D53-R56 PolarHBondContact OD2-NH1 3.25Å; D53-R56 IonicContact OD2-NH2 2.81Å; D53-R56 PolarHBondContact OD2-NH2 2.93Å
54	E	37.1	Very low	33.8	Very low	128 Å²	128	121.2 Å²	121.2	60%	0.598	63%	0.632	S	S	*	*	H	α-helix	trans	-63.6	-22.6	-171.7	-153.4	-163.3	-119.7	0	0	114.1	K58	E54-K58 WeakPolarHBondContact O-CE 3.28Å; E54-K58 WeakPolarHBondContact O-CG 3.49Å; E54-K58 WeakPolarHBondContact OE2-CE 3.41Å; E54-K58 IonicContact OE2-NZ 3.91Å; E54-K58 PolarHBondContact OE2-NZ 3.26Å
55	D	34.2	Very low	34	Very low	125 Å²	125	117.7 Å²	117.7	67%	0.668	62%	0.621	S	S	*	*	H	α-helix	trans	-81.3	-14.5	-178.5	-73.5	-23.4	0	0	0	114.3	D53 K58	D53-D55 PolarHBondContact O-N 3Å; D53-D55 VanDerWaalsContact O-N 3.17Å; D55-K58 IonicContact OD1-NZ 2.86Å; D55-K58 PolarHBondContact OD1-NZ 2.85Å
56	R	36.2	Very low	34.4	Very low	149 Å²	149	116.3 Å²	116.3	56%	0.562	61%	0.609	S	S	*	*	H	α-helix	trans	-81.6	-36	173.8	-164.2	170.9	64.8	-102.8	-8.3	112.4	D53 K58 Q59	D53-R56 PolarHBondContact O-N 2.86Å; D53-R56 IonicContact OD1-CZ 2.7Å; D53-R56 IonicContact OD1-NH1 2.69Å; D53-R56 PolarHBondContact OD1-NH1 3.08Å; D53-R56 IonicContact OD1-NH2 3.09Å; D53-R56 IonicContact OD2-CZ 2.71Å; D53-R56 IonicContact OD2-NH1 3.18Å; D53-R56 PolarHBondContact OD2-NH1 3.25Å; D53-R56 IonicContact OD2-NH2 2.81Å; D53-R56 PolarHBondContact OD2-NH2 2.93Å; R56-K58 VanDerWaalsContact C-N 3.31Å; R56-K58 PolarHBondContact O-N 3.38Å; R56-Q59 WeakPolarHBondContact O-CB 3.41Å; R56-Q59 PolarHBondContact O-N 3.47Å
57	M	36.5	Very low	34.8	Very low	111 Å²	111	113.2 Å²	113.2	55%	0.547	60%	0.595	S	S	.	*	H	α-helix	trans	-69.3	-27.2	-178.1	-165.4	168.1	66.5	0	0	113	Q59 E60 D61	M57-Q59 PolarHBondContact O-N 2.75Å; M57-E60 PolarHBondContact O-N 3.2Å; M57-D61 PolarHBondContact O-N 3.07Å
58	K	40	Very low	35.1	Very low	91 Å²	91	110.5 Å²	110.5	40%	0.396	58%	0.582	S	S	.	*	H	α-helix	trans	-62.5	-23.6	176.3	-67.6	165	-163.7	162.7	0	113.1	E54 D55 R56 I62	E54-K58 WeakPolarHBondContact O-CE 3.28Å; E54-K58 WeakPolarHBondContact O-CG 3.49Å; E54-K58 WeakPolarHBondContact OE2-CE 3.41Å; E54-K58 IonicContact OE2-NZ 3.91Å; E54-K58 PolarHBondContact OE2-NZ 3.26Å; D55-K58 IonicContact OD1-NZ 2.86Å; D55-K58 PolarHBondContact OD1-NZ 2.85Å; R56-K58 VanDerWaalsContact C-N 3.31Å; R56-K58 PolarHBondContact O-N 3.38Å; K58-I62 VanDerWaalsContact O-CD1 3.31Å; K58-I62 WeakPolarHBondContact O-CD1 3.21Å; K58-I62 VanDerWaalsContact O-CG1 3.31Å; K58-I62 WeakPolarHBondContact O-CG1 3.28Å
59	Q	35.5	Very low	35.5	Very low	138 Å²	138	113.2 Å²	113.2	65%	0.645	58%	0.58	S	S	*	*	H	α-helix	trans	-77.2	-26.8	175.9	-151.7	71.1	15.3	0	0	112.6	R56 M57 T63	R56-Q59 WeakPolarHBondContact O-CB 3.41Å; R56-Q59 PolarHBondContact O-N 3.47Å; M57-Q59 PolarHBondContact O-N 2.75Å; Q59-T63 PolarHBondContact O-OG1 3Å
60	E	34.9	Very low	35.7	Very low	121 Å²	121	112.5 Å²	112.5	57%	0.565	57%	0.565	S	S	*	*	H	α-helix	trans	-89.4	-36.9	-174.3	-64	179.9	171.4	0	0	111.8	M57 I62 T63 Y64	M57-E60 PolarHBondContact O-N 3.2Å; E60-I62 VanDerWaalsContact C-N 3.34Å; E60-I62 PolarHBondContact O-N 3.07Å; E60-T63 WeakPolarHBondContact O-CA 3.43Å; E60-T63 WeakPolarHBondContact O-CB 3.23Å; E60-T63 PolarHBondContact O-N 3.44Å; E60-Y64 PolarHBondContact O-N 3.41Å; E60-Y64 VanDerWaalsContact O-N 3.1Å
61	D	35.6	Very low	36	Very low	116 Å²	116	111.7 Å²	111.7	62%	0.62	55%	0.551	S	S	*	*	H	α-helix	trans	-61.5	-40.2	171.4	-99.3	-19.2	0	0	0	112	M57 T63 Y64 D65	M57-D61 PolarHBondContact O-N 3.07Å; D61-T63 PolarHBondContact O-N 3.26Å; D61-Y64 PolarHBondContact O-N 3.12Å; D61-D65 PolarHBondContact O-N 2.94Å; D61-D65 VanDerWaalsContact O-N 3.15Å
62	I	36.5	Very low	36.3	Very low	99 Å²	99	113.2 Å²	113.2	51%	0.508	55%	0.554	S	S	.	*	H	α-helix	trans	-61.6	-33.2	173.3	-67.2	171	0	0	0	110.9	K58 E60 I66	K58-I62 VanDerWaalsContact O-CD1 3.31Å; K58-I62 WeakPolarHBondContact O-CD1 3.21Å; K58-I62 VanDerWaalsContact O-CG1 3.31Å; K58-I62 WeakPolarHBondContact O-CG1 3.28Å; E60-I62 VanDerWaalsContact C-N 3.34Å; E60-I62 PolarHBondContact O-N 3.07Å; I62-I66 HydrophobicContact CG2-CD1 3.77Å; I62-I66 WeakPolarHBondContact O-CB 3.47Å; I62-I66 VanDerWaalsContact O-CG1 3.26Å; I62-I66 WeakPolarHBondContact O-CG1 3.44Å; I62-I66 PolarHBondContact O-N 3.15Å; I62-I66 VanDerWaalsContact O-N 3.11Å
63	T	37.8	Very low	36.5	Very low	79 Å²	79	113.5 Å²	113.5	49%	0.485	54%	0.544	S	S	.	.	H	α-helix	trans	-71.2	-41.8	179.5	-57.8	0	0	0	0	111.3	Q59 E60 D61 D65 I66 V67	Q59-T63 PolarHBondContact O-OG1 3Å; E60-T63 WeakPolarHBondContact O-CA 3.43Å; E60-T63 WeakPolarHBondContact O-CB 3.23Å; E60-T63 PolarHBondContact O-N 3.44Å; D61-T63 PolarHBondContact O-N 3.26Å; T63-D65 PolarHBondContact O-N 3.23Å; T63-I66 PolarHBondContact O-N 3.33Å; T63-V67 HydrophobicContact CG2-CG2 4.42Å; T63-V67 WeakPolarHBondContact O-CG2 3.47Å; T63-V67 PolarHBondContact O-N 3.04Å
64	Y	32.8	Very low	36.4	Very low	169 Å²	169	114.8 Å²	114.8	66%	0.663	55%	0.551	S	S	*	*	H	α-helix	trans	-63.1	-41.1	174.8	-102.4	-84	0	0	0	112.8	E60 D61 I66 V67 L68	E60-Y64 PolarHBondContact O-N 3.41Å; E60-Y64 VanDerWaalsContact O-N 3.1Å; D61-Y64 PolarHBondContact O-N 3.12Å; Y64-I66 VanDerWaalsContact C-N 3.25Å; Y64-I66 PolarHBondContact O-N 3.2Å; Y64-V67 PolarHBondContact O-N 3.03Å; Y64-L68 HydrophobicContact CD1-CD1 4.43Å; Y64-L68 PolarHBondContact O-N 3.38Å
65	D	34	Very low	36.2	Very low	99 Å²	99	119 Å²	119	53%	0.529	56%	0.563	S	S	.	*	H	α-helix	trans	-76.3	-12.1	-179.6	-140.1	55.9	0	0	0	113	D61 T63 K69	D61-D65 PolarHBondContact O-N 2.94Å; D61-D65 VanDerWaalsContact O-N 3.15Å; T63-D65 PolarHBondContact O-N 3.23Å; D65-K69 WeakPolarHBondContact O-CD 3.45Å; D65-K69 WeakPolarHBondContact O-CG 3.21Å; D65-K69 PolarHBondContact O-NZ 3.15Å; D65-K69 IonicContact OD2-NZ 2.73Å; D65-K69 PolarHBondContact OD2-NZ 3.41Å
66	I	37.8	Very low	36.1	Very low	90 Å²	90	117 Å²	117	46%	0.462	56%	0.564	S	S	.	*	H	α-helix	trans	-89	-41.2	167.4	-72.5	170.2	0	0	0	111	I62 T63 Y64 K69 K70	I62-I66 HydrophobicContact CG2-CD1 3.77Å; I62-I66 WeakPolarHBondContact O-CB 3.47Å; I62-I66 VanDerWaalsContact O-CG1 3.26Å; I62-I66 WeakPolarHBondContact O-CG1 3.44Å; I62-I66 PolarHBondContact O-N 3.15Å; I62-I66 VanDerWaalsContact O-N 3.11Å; T63-I66 PolarHBondContact O-N 3.33Å; Y64-I66 VanDerWaalsContact C-N 3.25Å; Y64-I66 PolarHBondContact O-N 3.2Å; I66-K69 PolarHBondContact O-N 3.2Å; I66-K69 VanDerWaalsContact O-N 3.09Å; I66-K70 HydrophobicContact CG2-CD 4.4Å; I66-K70 PolarHBondContact O-N 3.3Å
67	V	38.7	Very low	35.7	Very low	56 Å²	56	119.1 Å²	119.1	34%	0.339	58%	0.58	S	S	.	*	H	α-helix	trans	-62	-43.7	176.8	169.3	0	0	0	0	110.9	T63 Y64 K69 K70 E71	T63-V67 HydrophobicContact CG2-CG2 4.42Å; T63-V67 WeakPolarHBondContact O-CG2 3.47Å; T63-V67 PolarHBondContact O-N 3.04Å; Y64-V67 PolarHBondContact O-N 3.03Å; V67-K69 PolarHBondContact O-N 3.3Å; V67-K69 VanDerWaalsContact O-N 3.15Å; V67-K70 PolarHBondContact O-N 3.45Å; V67-E71 HydrophobicContact CG1-CG 4.08Å; V67-E71 WeakPolarHBondContact O-CB 3.22Å; V67-E71 WeakPolarHBondContact O-CG 3.18Å; V67-E71 PolarHBondContact O-N 3.35Å
68	L	36.3	Very low	35.4	Very low	99 Å²	99	123 Å²	123	52%	0.518	60%	0.597	S	S	.	*	H	α-helix	trans	-66.5	-13	175	-103.9	101.4	0	0	0	114.9	Y64 Q72	Y64-L68 HydrophobicContact CD1-CD1 4.43Å; Y64-L68 PolarHBondContact O-N 3.38Å; L68-Q72 WeakPolarHBondContact O-CG 3.29Å
69	K	41.1	Very low	35.2	Very low	106 Å²	106	125.2 Å²	125.2	46%	0.461	61%	0.613	S	S	.	*	H	α-helix	trans	-91.7	-44.2	172.4	-66.6	-178.3	-172.5	93	0	110.6	D65 I66 V67 E71 Q72 E73	D65-K69 WeakPolarHBondContact O-CD 3.45Å; D65-K69 WeakPolarHBondContact O-CG 3.21Å; D65-K69 PolarHBondContact O-NZ 3.15Å; D65-K69 IonicContact OD2-NZ 2.73Å; D65-K69 PolarHBondContact OD2-NZ 3.41Å; I66-K69 PolarHBondContact O-N 3.2Å; I66-K69 VanDerWaalsContact O-N 3.09Å; V67-K69 PolarHBondContact O-N 3.3Å; V67-K69 VanDerWaalsContact O-N 3.15Å; K69-E71 PolarHBondContact O-N 3.48Å; K69-Q72 CarbonylContact O-C 3.17Å; K69-Q72 WeakPolarHBondContact O-CA 3.49Å; K69-Q72 WeakPolarHBondContact O-CB 3.47Å; K69-Q72 PolarHBondContact O-N 3.28Å; K69-E73 WeakPolarHBondContact O-CG 3.19Å; K69-E73 PolarHBondContact O-N 3.03Å; K69-E73 VanDerWaalsContact O-N 3.16Å
70	K	36.7	Very low	34.9	Very low	106 Å²	106	127.9 Å²	127.9	46%	0.461	62%	0.619	S	S	.	*	H	α-helix	trans	-59.8	-43.3	171.8	-85.2	-179.1	153	-78.6	0	113.2	I66 V67 Q72 E73 D74	I66-K70 HydrophobicContact CG2-CD 4.4Å; I66-K70 PolarHBondContact O-N 3.3Å; V67-K70 PolarHBondContact O-N 3.45Å; K70-Q72 PolarHBondContact O-N 3.29Å; K70-E73 PolarHBondContact O-N 3.44Å; K70-D74 WeakPolarHBondContact O-CB 3.35Å; K70-D74 PolarHBondContact O-N 3.29Å
71	E	36.6	Very low	34.6	Very low	123 Å²	123	128 Å²	128	58%	0.575	62%	0.624	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.5	-3.6	173.4	-68.9	-178.7	167.2	0	0	113.9	V67 K69	V67-E71 HydrophobicContact CG1-CG 4.08Å; V67-E71 WeakPolarHBondContact O-CB 3.22Å; V67-E71 WeakPolarHBondContact O-CG 3.18Å; V67-E71 PolarHBondContact O-N 3.35Å; K69-E71 PolarHBondContact O-N 3.48Å
72	Q	36.8	Very low	34.3	Very low	162 Å²	162	129.2 Å²	129.2	76%	0.757	63%	0.625	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.7	-4.9	168.9	-65.1	-166.5	-41.5	0	0	113.7	L68 K69 K70	L68-Q72 WeakPolarHBondContact O-CG 3.29Å; K69-Q72 CarbonylContact O-C 3.17Å; K69-Q72 WeakPolarHBondContact O-CA 3.49Å; K69-Q72 WeakPolarHBondContact O-CB 3.47Å; K69-Q72 PolarHBondContact O-N 3.28Å; K70-Q72 PolarHBondContact O-N 3.29Å
73	E	36.2	Very low	34.1	Very low	131 Å²	131	130.7 Å²	130.7	61%	0.612	64%	0.635	S	S	*	*	T	Hydrogen-bonded Turn	trans	-109.2	-41	178.9	-69.6	166.9	168.3	0	0	110.6	K69 K70 Y75 A76	K69-E73 WeakPolarHBondContact O-CG 3.19Å; K69-E73 PolarHBondContact O-N 3.03Å; K69-E73 VanDerWaalsContact O-N 3.16Å; K70-E73 PolarHBondContact O-N 3.44Å; E73-Y75 PolarHBondContact O-N 3.44Å; E73-A76 PolarHBondContact O-N 2.77Å
74	D	34	Very low	33.6	Very low	112 Å²	112	134.1 Å²	134.1	60%	0.599	65%	0.65	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.1	17.9	-179.5	-63.4	-32.2	0	0	0	114.2	K70	K70-D74 WeakPolarHBondContact O-CB 3.35Å; K70-D74 PolarHBondContact O-N 3.29Å
75	Y	31.4	Very low	33.7	Very low	216 Å²	216	135.3 Å²	135.3	85%	0.847	66%	0.661	S	S	*	*	T	Hydrogen-bonded Turn	trans	-117.2	18	174.7	-91.7	-63.4	0	0	0	113.3	E73	E73-Y75 PolarHBondContact O-N 3.44Å
76	A	31.9	Very low	33.5	Very low	85 Å²	85	137.2 Å²	137.2	70%	0.702	67%	0.672	S	S	*	*	S	Bend	trans	-133	16.4	-171.1	0	0	0	0	0	115.6	E73	E73-A76 PolarHBondContact O-N 2.77Å
77	E	28.7	Very low	33.2	Very low	192 Å²	192	140.5 Å²	140.5	90%	0.897	69%	0.687	S	S	*	*			trans	-151.5	90.8	-176.3	-126.2	170.3	-128.6	0	0	113.5
78	E	29.5	Very low	32.7	Very low	193 Å²	193	144.6 Å²	144.6	90%	0.902	71%	0.707	S	S	*	*			trans	-140.9	148.5	161.8	-73.5	-164.5	145.6	0	0	110.9
79	D	35.9	Very low	32.5	Very low	137 Å²	137	144.4 Å²	144.4	73%	0.733	71%	0.714	S	S	*	*			trans	71.2	64.1	169	-68.5	-3.6	0	0	0	121.5
80	Y	29.3	Very low	31.8	Very low	194 Å²	194	146.1 Å²	146.1	76%	0.761	73%	0.728	S	S	*	*				46.3	125.4	115.8	-65.7	-69.9	0	0	0	122.8
81	N	29.3	Very low	31.4	Very low	125 Å²	125	148.6 Å²	148.6	67%	0.668	74%	0.741	S	S	*	*			trans	68.7	149.4	133.1	-67.9	25.7	0	0	0	119.2
82	E	30.1	Very low	30.9	Very low	140 Å²	140	147 Å²	147	65%	0.654	74%	0.744	S	S	*	*			cis	-157.3	157.5	6.1	-131.4	168.8	-114.6	0	0	112.2
83	N	30.4	Very low	30.5	Very low	131 Å²	131	146.4 Å²	146.4	70%	0.701	74%	0.741	S	S	*	*			trans	62.5	120.6	155.1	-52.8	-38.8	0	0	0	121.3
84	D	28.2	Very low	30	Very low	151 Å²	151	146.6 Å²	146.6	81%	0.807	74%	0.743	S	S	*	*			trans	-47.7	153.7	157.2	-41.9	-79.2	0	0	0	114.9
85	E	34.1	Very low	29.8	Very low	193 Å²	193	149.2 Å²	149.2	90%	0.902	75%	0.75	S	S	*	*				-174.6	169	105.2	-100.4	-173.3	-163	0	0	112.8
86	D	29.7	Very low	29.5	Very low	140 Å²	140	142.9 Å²	142.9	75%	0.749	74%	0.737	S	S	*	*			trans	-76.4	180	-160.6	-77	-54.2	0	0	0	118.2
87	M	32.9	Very low	29.4	Very low	159 Å²	159	147.6 Å²	147.6	78%	0.783	74%	0.744	S	S	*	*			trans	92	101.5	158.9	-50.9	-60.5	167.1	0	0	116.4
88	N	28.1	Very low	29.5	Very low	141 Å²	141	143.6 Å²	143.6	75%	0.754	74%	0.737	S	S	*	*				78	153.7	59.9	-164.2	17.4	0	0	0	113.7
89	S	31.5	Very low	29.4	Very low	96 Å²	96	142.5 Å²	142.5	67%	0.671	73%	0.732	S	S	*	*			trans	74.6	118.1	-169.6	81.6	0	0	0	0	113.3
90	N	26.4	Very low	29.2	Very low	142 Å²	142	143.8 Å²	143.8	76%	0.759	74%	0.737	S	S	*	*				78	146.4	71.2	-68.7	14.6	0	0	0	112.3
91	E	27.8	Very low	29.2	Very low	157 Å²	157	139.7 Å²	139.7	73%	0.734	73%	0.734	S	S	*	*			cis	-176	145.3	-10.5	164.5	177.3	-168	0	0	107.6
92	S	26	Very low	29.4	Very low	91 Å²	91	140.7 Å²	140.7	64%	0.636	75%	0.745	S	S	*	*			trans	62	159.4	172.9	75.4	0	0	0	0	115.7
93	H	29	Very low	29.3	Very low	148 Å²	148	138.6 Å²	138.6	69%	0.685	75%	0.745	S	S	*	*			cis	-167.3	148.2	39.2	-107.9	-57.1	0	0	0	110.1
94	M	26.3	Very low	29.1	Very low	135 Å²	135	139.6 Å²	139.6	67%	0.665	75%	0.751	S	S	*	*			trans	62.4	147.2	136.8	-56.1	-71.5	169.4	0	0	119.3
95	K	29	Very low	29.3	Very low	168 Å²	168	141 Å²	141	73%	0.73	76%	0.756	S	S	*	*			cis	-168.5	177	-7.7	-128.9	172.7	-177.9	169.7	0	109.7
96	S	25.4	Very low	28.9	Very low	83 Å²	83	139.6 Å²	139.6	58%	0.58	75%	0.747	S	S	*	*			trans	39	118.5	145.9	62.4	0	0	0	0	118.8
97	E	29.7	Very low	28.7	Very low	184 Å²	184	138.8 Å²	138.8	86%	0.86	74%	0.742	S	S	*	*				136.9	162.5	69.4	-105.4	160.9	-133.9	0	0	106.2
98	S	31.6	Very low	28.7	Very low	107 Å²	107	138 Å²	138	75%	0.748	74%	0.741	S	S	*	*			cis	-150.8	-176.9	1.8	49.8	0	0	0	0	110.6
99	H	27.4	Very low	28.6	Very low	171 Å²	171	139.6 Å²	139.6	79%	0.792	74%	0.744	S	S	*	*			trans	-82.1	151	-172.4	-51.5	-107.7	0	0	0	115.1
100	I	30.7	Very low	28.7	Very low	164 Å²	164	142.5 Å²	142.5	84%	0.841	75%	0.751	S	S	*	*			trans	-143	119.1	132.6	-53.8	-177.6	0	0	0	110.1
101	P	29.7	Very low	28.8	Very low	108 Å²	108	141.6 Å²	141.6	70%	0.701	75%	0.751	S	S	*	*			trans	-111.5	153.7	163.6	37.6	-27.7	0	0	0	112.1
102	V	32.9	Very low	28.9	Very low	146 Å²	146	137.9 Å²	137.9	89%	0.885	76%	0.755	S	S	*	*			trans	-135	145	165.9	-177.1	0	0	0	0	108.7
103	S	28.7	Very low	29.1	Very low	95 Å²	95	140.8 Å²	140.8	66%	0.664	76%	0.763	S	S	*	*			trans	-140.2	159.1	-158.1	53.7	0	0	0	0	114.8
104	N	26.2	Very low	29	Very low	152 Å²	152	142.6 Å²	142.6	81%	0.813	77%	0.772	S	S	*	*			trans	36.4	107.2	148.4	-55.2	-6.5	0	0	0	119.8
105	I	31.1	Very low	29.2	Very low	180 Å²	180	142.4 Å²	142.4	92%	0.923	78%	0.779	S	S	*	*			trans	-127.2	157.6	138.6	-61.7	-174.7	0	0	0	107.9
106	K	27.6	Very low	28.9	Very low	165 Å²	165	139.3 Å²	139.3	72%	0.717	78%	0.784	S	S	*	*			trans	-149.2	149.9	-150.1	-178.2	-150.5	178.9	-162.3	0	111.1
107	L	25.5	Very low	29	Very low	123 Å²	123	141.4 Å²	141.4	64%	0.644	79%	0.794	S	S	*	*			trans	68.6	163.4	167	-108.4	46.8	0	0	0	113.9
108	D	32.1	Very low	28.8	Very low	143 Å²	143	138.2 Å²	138.2	77%	0.765	79%	0.787	S	S	*	*			cis	-127.7	171.5	14	-85.5	-65.1	0	0	0	114.6
109	E	26.9	Very low	28.4	Very low	173 Å²	173	139.2 Å²	139.2	81%	0.808	79%	0.788	S	S	*	*			trans	-79.2	171.7	170.7	-58.8	170.5	104.5	0	0	112.4
110	L	32.3	Very low	28.5	Very low	158 Å²	158	137.6 Å²	137.6	83%	0.827	79%	0.79	S	S	*	*			trans	166.9	92.8	145	-89.3	162.3	0	0	0	108.8
111	T	28.9	Very low	28.2	Very low	122 Å²	122	135.4 Å²	135.4	75%	0.748	79%	0.785	S	S	*	*				72	122.2	93.2	61	0	0	0	0	117
112	G	30	Very low	28.1	Very low	80 Å²	80	136 Å²	136	83%	0.825	78%	0.782	S	S	*	*			trans	86.5	152.1	163.2	0	0	0	0	0	114.9
113	N	30.7	Very low	27.7	Very low	151 Å²	151	134.4 Å²	134.4	81%	0.807	78%	0.777	S	S	*	*			cis	-150.7	156.3	-4.7	54.7	-7.8	0	0	0	111.7
114	E	25.8	Very low	27.8	Very low	187 Å²	187	136.1 Å²	136.1	87%	0.874	78%	0.783	S	S	*	*			trans	-80.6	141.7	176.8	-57.8	171.6	135.1	0	0	110.8
115	T	30.5	Very low	28.1	Very low	131 Å²	131	138.2 Å²	138.2	80%	0.804	79%	0.785	S	S	*	*			trans	-162.9	126.3	148	-7.1	0	0	0	0	110.8
116	A	23.7	Very low	27.8	Very low	102 Å²	102	134.2 Å²	134.2	84%	0.843	77%	0.771	S	S	*	*			trans	-113.3	122.6	176.2	0	0	0	0	0	110.1
117	V	27.2	Very low	27.6	Very low	128 Å²	128	133.9 Å²	133.9	78%	0.776	78%	0.775	S	S	*	*			trans	-136	103.4	174.1	-176.5	0	0	0	0	111.1
118	T	25.3	Very low	27.6	Very low	117 Å²	117	131.5 Å²	131.5	72%	0.718	78%	0.781	S	S	*	*			trans	4.6	125.2	153.4	55.8	0	0	0	0	121.3
119	V	23.7	Very low	27.3	Very low	128 Å²	128	132.1 Å²	132.1	78%	0.776	78%	0.782	S	S	*	*				46.9	119.5	116.3	-177.2	0	0	0	0	119
120	T	28.1	Very low	27.4	Very low	137 Å²	137	131.4 Å²	131.4	84%	0.84	78%	0.783	S	S	*	*				-159.2	158.1	121.2	6.2	0	0	0	0	111.2
121	T	25.4	Very low	27.5	Very low	117 Å²	117	128.9 Å²	128.9	72%	0.718	78%	0.777	S	S	*	*			trans	-74.4	153.3	173	55.7	0	0	0	0	109.2
122	D	26.4	Very low	27.4	Very low	122 Å²	122	130.5 Å²	130.5	65%	0.652	78%	0.78	S	S	*	*				-175.9	158.8	69.7	-121.9	-69.5	0	0	0	115.1	V124	D122-V124 PolarHBondContact O-N 3.23Å
123	S	25.7	Very low	27.5	Very low	112 Å²	112	133.6 Å²	133.6	78%	0.783	78%	0.778	S	S	*	*			trans	36.3	76.8	143.1	-61.9	0	0	0	0	120.4
124	V	30.7	Very low	27.2	Very low	130 Å²	130	133.1 Å²	133.1	79%	0.788	78%	0.775	S	S	*	*			trans	-132.1	138.2	159	-173.9	0	0	0	0	111.2	D122 P126	D122-V124 PolarHBondContact O-N 3.23Å; V124-P126 HydrophobicContact CG1-CG 4.33Å
125	K	31.9	Very low	27.4	Very low	196 Å²	196	128.9 Å²	128.9	85%	0.852	77%	0.772	S	S	*	*			trans	-122.1	93.4	178.3	-177.6	-172.1	-179.9	-178.7	0	111.7
126	P	24.5	Very low	27.2	Very low	96 Å²	96	129.2 Å²	129.2	62%	0.623	77%	0.767	S	S	*	*			trans	-82.7	137.6	159.9	-6.1	26.7	0	0	0	108.9	V124	V124-P126 HydrophobicContact CG1-CG 4.33Å
127	I	25	Very low	27.3	Very low	158 Å²	158	132 Å²	132	81%	0.81	76%	0.763	S	S	*	*				64.8	113.6	62.4	-57.3	166.8	0	0	0	110
128	G	24.1	Very low	27.4	Very low	74 Å²	74	132.5 Å²	132.5	76%	0.763	76%	0.761	S	S	*	*			trans	-77.4	155.4	-174.8	0	0	0	0	0	113.2
129	I	27.2	Very low	27.6	Very low	155 Å²	155	133.8 Å²	133.8	80%	0.795	76%	0.763	S	S	*	*			trans	-121.1	110.3	167.8	-58.6	178.6	0	0	0	107.5	P131	I129-P131 WeakPolarHBondContact O-CD 3.36Å
130	L	28.8	Very low	27.8	Very low	158 Å²	158	134 Å²	134	83%	0.827	76%	0.759	S	S	*	*			trans	-87.9	111.1	153.3	-86.6	163.2	0	0	0	106.7	L132	L130-L132 WeakPolarHBondContact O-CD1 3.41Å; L130-L132 PolarHBondContact O-N 2.95Å
131	P	33.3	Very low	27.8	Very low	106 Å²	106	132.9 Å²	132.9	69%	0.688	75%	0.752	S	S	*	*			trans	-81.2	94.9	157.1	31.2	-24.6	0	0	0	106.7	I129	I129-P131 WeakPolarHBondContact O-CD 3.36Å
132	L	27.1	Very low	28.2	Very low	156 Å²	156	133.3 Å²	133.3	82%	0.817	76%	0.758	S	S	*	*				69.3	121.3	98.2	-99	73.8	0	0	0	113.8	L130	L130-L132 WeakPolarHBondContact O-CD1 3.41Å; L130-L132 PolarHBondContact O-N 2.95Å
133	N	32	Very low	28.5	Very low	145 Å²	145	133.6 Å²	133.6	78%	0.775	76%	0.759	S	S	*	*			trans	-65.2	144.1	153.7	-59	-12.6	0	0	0	108.9
134	D	24.3	Very low	29	Very low	141 Å²	141	134 Å²	134	75%	0.754	76%	0.759	S	S	*	*				167.5	113.2	118.1	-86.6	-13.3	0	0	0	112.3
135	A	31.3	Very low	29.1	Very low	98 Å²	98	136.4 Å²	136.4	81%	0.81	76%	0.761	S	S	*	*			trans	-177.9	69.8	163.2	0	0	0	0	0	107.9
136	I	25.4	Very low	29.2	Very low	137 Å²	137	130.3 Å²	130.3	70%	0.703	75%	0.754	S	S	*	*				54.3	101	82.1	-55.9	-178.9	0	0	0	112.6
137	Q	26.6	Very low	29.5	Very low	161 Å²	161	131 Å²	131	75%	0.752	77%	0.767	S	S	*	*			trans	49.9	126.9	150.5	-56.8	-68.8	-1.3	0	0	119.6
138	N	28.7	Very low	29.8	Very low	138 Å²	138	127.4 Å²	127.4	74%	0.738	76%	0.761	S	S	*	*				178	136.6	111.5	-97.1	-52.2	0	0	0	114.7
139	L	29.2	Very low	29.9	Very low	144 Å²	144	129.7 Å²	129.7	75%	0.754	76%	0.76	S	S	*	*			trans	66	137.8	144.8	-59.2	171.6	0	0	0	119.8
140	L	29	Very low	30.1	Very low	134 Å²	134	129.2 Å²	129.2	70%	0.702	76%	0.758	S	S	*	*			cis	-166	139.7	-9.5	-175.8	64.1	0	0	0	112.4
141	T	28.2	Very low	30.1	Very low	113 Å²	113	129 Å²	129	69%	0.693	75%	0.753	S	S	*	*			trans	62.7	152.4	162	45.9	0	0	0	0	119.7
142	C	31.9	Very low	29.7	Very low	125 Å²	125	130.5 Å²	130.5	85%	0.845	76%	0.755	S	S	*	*			cis	-121.3	159.5	18.5	-68.4	0	0	0	0	115.8
143	I	34	Very low	29.7	Very low	129 Å²	129	129.6 Å²	129.6	66%	0.662	76%	0.756	S	S	*	*			trans	-140.9	126.1	-172	-70.4	166.8	0	0	0	109.2
144	P	35	Very low	30	Very low	120 Å²	120	127.7 Å²	127.7	78%	0.779	75%	0.751	S	S	*	*				-152.8	-175.9	102	33.4	-12	0	0	0	114.1
145	H	33.4	Very low	30.1	Very low	181 Å²	181	128.6 Å²	128.6	84%	0.838	76%	0.755	S	S	*	*			cis	-164.9	165.6	-46.6	-99.1	-32.2	0	0	0	110.5
146	G	35	Very low	30.3	Very low	68 Å²	68	131.9 Å²	131.9	70%	0.701	75%	0.754	S	S	*	*			trans	112.9	99.5	169.6	0	0	0	0	0	113
147	A	29	Very low	30.7	Very low	109 Å²	109	129.9 Å²	129.9	90%	0.901	75%	0.75	S	S	*	*				71.5	131.8	58	0	0	0	0	0	113
148	A	33.3	Very low	30.6	Very low	84 Å²	84	128.8 Å²	128.8	69%	0.694	75%	0.747	S	S	*	*			cis	-138.7	150.9	9.5	0	0	0	0	0	110.7
149	T	26.1	Very low	30.4	Very low	121 Å²	121	129.4 Å²	129.4	74%	0.742	75%	0.75	S	S	*	*				53.7	123.8	84.6	-22.3	0	0	0	0	111.8
150	I	30.2	Very low	30.2	Very low	146 Å²	146	126.8 Å²	126.8	75%	0.749	74%	0.744	S	S	*	*				-158.4	128.6	62.6	-75.2	164.4	0	0	0	113.2
151	Q	28.5	Very low	30.1	Very low	154 Å²	154	125.3 Å²	125.3	72%	0.72	75%	0.745	S	S	*	*			trans	30.2	129.5	136.4	-52.8	-174.4	-14.8	0	0	125.1
152	N	25.3	Very low	30.1	Very low	137 Å²	137	128 Å²	128	73%	0.733	75%	0.746	S	S	*	*				79.5	139	119.5	-70.1	-9.5	0	0	0	125.9
153	V	27.9	Very low	30	Very low	136 Å²	136	128.6 Å²	128.6	82%	0.824	74%	0.739	S	S	*	*			trans	87	143.3	140.5	157.1	0	0	0	0	118.5
154	P	38.2	Very low	29.9	Very low	105 Å²	105	129.5 Å²	129.5	68%	0.682	75%	0.745	S	S	*	*			trans	-121.5	-178.3	-153.2	41.6	-26.2	0	0	0	114
155	L	26	Very low	29.7	Very low	161 Å²	161	126.6 Å²	126.6	84%	0.843	74%	0.736	S	S	*	*			trans	159.2	134	138.1	-84.3	161.1	0	0	0	111.4
156	Q	34.7	Very low	29.5	Very low	167 Å²	167	123.4 Å²	123.4	78%	0.78	74%	0.735	S	S	*	*			trans	-12.8	164	140	-64.7	-93.8	-8.1	0	0	117.7
157	P	34.3	Very low	29.3	Very low	94 Å²	94	129 Å²	129	61%	0.61	74%	0.742	S	S	*	*			cis	-143.5	-149.7	-8.4	28.8	-1.7	0	0	0	113.4
158	I	24.3	Very low	29.1	Very low	138 Å²	138	128.4 Å²	128.4	71%	0.708	73%	0.732	S	S	*	*			trans	84.8	115	142.3	-83.5	171.3	0	0	0	119.3
159	L	24.1	Very low	28.9	Very low	152 Å²	152	130.7 Å²	130.7	80%	0.796	74%	0.737	S	S	*	*			trans	48.6	156.3	134.4	-61.8	165.8	0	0	0	120.1
160	S	25.5	Very low	29	Very low	88 Å²	88	132.3 Å²	132.3	62%	0.615	74%	0.736	S	S	*	*			cis	-165.5	152.3	15.9	-143.2	0	0	0	0	113.3
161	S	26.2	Very low	28.8	Very low	103 Å²	103	132.6 Å²	132.6	72%	0.72	74%	0.736	S	S	*	*			trans	71	166	138	84.4	0	0	0	0	118.8
162	K	29.2	Very low	29	Very low	169 Å²	169	130.6 Å²	130.6	74%	0.735	74%	0.737	S	S	*	*			cis	-163.8	163.2	5	-143.5	172.9	170.7	-175.3	0	111.8
163	M	30.5	Very low	29.1	Very low	139 Å²	139	130.1 Å²	130.1	69%	0.685	73%	0.734	S	S	*	*			trans	66.2	146.5	156.4	-71.4	149.7	125	0	0	117.9
164	N	30.8	Very low	29	Very low	148 Å²	148	130.3 Å²	130.3	79%	0.791	74%	0.735	S	S	*	*			cis	-160.8	156.6	-14.9	-99	-7.9	0	0	0	106.3
165	G	31.6	Very low	28.7	Very low	58 Å²	58	130.9 Å²	130.9	60%	0.598	74%	0.737	S	S	*	*			cis	161.8	164.8	-1.9	0	0	0	0	0	109.7
166	S	27.9	Very low	28.7	Very low	115 Å²	115	126.8 Å²	126.8	80%	0.804	72%	0.721	S	S	*	*			trans	58.2	139.5	169.4	45.1	0	0	0	0	118.6
167	E	30.7	Very low	28.4	Very low	184 Å²	184	125.2 Å²	125.2	86%	0.86	72%	0.718	S	S	*	*			cis	-155.4	164.4	0.4	-124.2	160.6	-164.4	0	0	113.2
168	S	25.8	Very low	28.2	Very low	98 Å²	98	126.1 Å²	126.1	69%	0.685	72%	0.722	S	S	*	*			trans	-58.1	155	174.7	43.5	0	0	0	0	114.3
169	V	29.5	Very low	28.4	Very low	131 Å²	131	127.2 Å²	127.2	79%	0.794	73%	0.729	S	S	*	*				179.5	151.5	87.8	147.2	0	0	0	0	109.8
170	Q	27.6	Very low	28.9	Very low	156 Å²	156	125.5 Å²	125.5	73%	0.729	73%	0.726	S	S	*	*			cis	-172.5	116.6	-27.3	-176.9	174.5	-97.3	0	0	111.3
171	M	26.9	Very low	29.1	Very low	152 Å²	152	127.4 Å²	127.4	75%	0.749	73%	0.734	S	S	*	*			trans	66.7	170	154.7	-63.8	-67.3	169.8	0	0	120
172	P	31.4	Very low	29.1	Very low	112 Å²	112	130.2 Å²	130.2	73%	0.727	74%	0.741	S	S	*	*			cis	-129.3	179.6	-35.4	30.9	-12.3	0	0	0	111.8
173	N	28.1	Very low	29.1	Very low	127 Å²	127	132.6 Å²	132.6	68%	0.679	75%	0.745	S	S	*	*			cis	-154.1	136.7	-24.2	-110.9	-15.7	0	0	0	107.2
174	V	25.7	Very low	28.8	Very low	140 Å²	140	133 Å²	133	85%	0.848	75%	0.749	S	S	*	*			trans	-106.7	104.7	161.7	175.7	0	0	0	0	107.8
175	V	31.8	Very low	28.7	Very low	117 Å²	117	134 Å²	134	71%	0.709	75%	0.749	S	S	*	*			trans	-82.3	103.7	164.4	-178.5	0	0	0	0	105.2
176	S	25.9	Very low	28.5	Very low	75 Å²	75	136.4 Å²	136.4	52%	0.524	76%	0.757	S	S	.	*			cis	75.8	151.6	48.8	96.8	0	0	0	0	113.7
177	N	29.4	Very low	28.7	Very low	133 Å²	133	136.9 Å²	136.9	71%	0.711	76%	0.757	S	S	*	*			trans	83.5	138.5	171.2	-49.9	-5.9	0	0	0	117.4
178	T	30	Very low	28.4	Very low	113 Å²	113	134.3 Å²	134.3	69%	0.693	75%	0.754	S	S	*	*			cis	-170.3	135.2	-29.5	26.8	0	0	0	0	109.4
179	L	27.6	Very low	28.4	Very low	162 Å²	162	135.1 Å²	135.1	85%	0.848	75%	0.754	S	S	*	*			trans	57.6	160.1	150.2	-90	67.7	0	0	0	120.4
180	P	35.3	Very low	28.4	Very low	115 Å²	115	136.7 Å²	136.7	75%	0.747	76%	0.758	S	S	*	*			trans	-99.1	154.2	175.7	38.2	-32.5	0	0	0	112.9
181	T	28.6	Very low	28.3	Very low	128 Å²	128	133.9 Å²	133.9	79%	0.785	76%	0.756	S	S	*	*			trans	-147.6	140.7	162.9	-17.1	0	0	0	0	112.4
182	L	26	Very low	28.5	Very low	163 Å²	163	133.7 Å²	133.7	85%	0.853	76%	0.763	S	S	*	*			trans	-65.6	125.7	169.9	-72.6	142.8	0	0	0	110.8
183	W	29.5	Very low	28.5	Very low	218 Å²	218	131.5 Å²	131.5	83%	0.826	76%	0.761	S	S	*	*			trans	-140.4	113.6	156.1	-82.7	89.8	0	0	0	110.1
184	L	25.6	Very low	28.5	Very low	147 Å²	147	134.4 Å²	134.4	77%	0.77	77%	0.773	S	S	*	*			trans	-70.9	139.5	150.6	-71.3	76.8	0	0	0	106.8
185	H	27.6	Very low	28.8	Very low	169 Å²	169	133.1 Å²	133.1	78%	0.782	77%	0.77	S	S	*	*			trans	179.5	133.6	137.1	-101.1	-70.4	0	0	0	110.5
186	S	27.9	Very low	28.6	Very low	109 Å²	109	136 Å²	136	76%	0.762	78%	0.778	S	S	*	*			trans	-76.9	143.3	162	-46.4	0	0	0	0	110
187	P	31.3	Very low	29.1	Very low	126 Å²	126	138.1 Å²	138.1	82%	0.818	79%	0.79	S	S	*	*			trans	-100.1	145.1	160.5	33.9	-28	0	0	0	111.9
188	V	25.3	Very low	29.2	Very low	130 Å²	130	139.2 Å²	139.2	79%	0.788	80%	0.796	S	S	*	*			trans	-121.4	131.8	177.4	157.9	0	0	0	0	107.9
189	V	26	Very low	29	Very low	115 Å²	115	139.6 Å²	139.6	70%	0.697	80%	0.798	S	S	*	*			trans	45.2	119	158.1	178.2	0	0	0	0	118.6
190	N	29.7	Very low	29.3	Very low	164 Å²	164	138.8 Å²	138.8	88%	0.877	80%	0.799	S	S	*	*				-160.7	160.3	123.5	-109.6	-34.3	0	0	0	113.1
191	S	25.3	Very low	29.1	Very low	97 Å²	97	137.9 Å²	137.9	68%	0.678	80%	0.796	S	S	*	*			trans	-117.8	-176.6	-168.9	-52.2	0	0	0	0	113.3
192	T	30.9	Very low	29.3	Very low	148 Å²	148	137.6 Å²	137.6	91%	0.908	79%	0.794	S	S	*	*			trans	101.3	147.1	165.4	73.2	0	0	0	0	118.5
193	G	31.7	Very low	29.7	Very low	65 Å²	65	134.8 Å²	134.8	67%	0.67	78%	0.784	S	S	*	*			trans	94	81.1	-176.9	0	0	0	0	0	113.8
194	M	27.5	Very low	29.7	Very low	188 Å²	188	130.7 Å²	130.7	93%	0.926	78%	0.778	S	S	*	*				52.6	128.7	80.6	-49.5	-159.6	91	0	0	113.2
195	S	31.4	Very low	29.9	Very low	114 Å²	114	131.1 Å²	131.1	80%	0.797	78%	0.78	S	S	*	*			cis	-154	166.1	33.8	-172.4	0	0	0	0	113.6
196	M	29	Very low	30	Very low	177 Å²	177	130.1 Å²	130.1	87%	0.872	79%	0.786	S	S	*	*			trans	-151.7	148.4	175.8	-125.6	-170.7	-177.3	0	0	112.3
197	P	34.9	Very low	30	Very low	119 Å²	119	129.4 Å²	129.4	77%	0.773	78%	0.781	S	S	*	*			trans	-135.5	167.3	137.7	40	-29	0	0	0	111.1
198	N	31.4	Very low	29.8	Very low	156 Å²	156	130.7 Å²	130.7	83%	0.834	78%	0.781	S	S	*	*			cis	-144.7	163.7	7.5	-163.4	4.4	0	0	0	109.9
199	V	27.5	Very low	30	Very low	122 Å²	122	132.4 Å²	132.4	74%	0.739	78%	0.784	S	S	*	*			trans	-135.5	130	-168.4	-177.8	0	0	0	0	114.7
200	T	32.2	Very low	30.2	Very low	144 Å²	144	133.2 Å²	133.2	88%	0.883	79%	0.789	S	S	*	*			trans	-151.5	133	148.9	42.4	0	0	0	0	108.1
201	S	32.8	Very low	30.3	Very low	97 Å²	97	133.3 Å²	133.3	68%	0.678	78%	0.784	S	S	*	*			cis	-150.6	136	-0.8	59	0	0	0	0	111.7
202	V	31.5	Very low	30.4	Very low	121 Å²	121	135.5 Å²	135.5	73%	0.733	79%	0.788	S	S	*	*				46.4	125.7	122.5	175.5	0	0	0	0	118
203	T	34.2	Very low	30.3	Very low	105 Å²	105	134.8 Å²	134.8	64%	0.644	78%	0.784	S	S	*	*			cis	-174.3	157.3	-9.7	34.8	0	0	0	0	106.1
204	D	30.8	Very low	30.2	Very low	131 Å²	131	136.1 Å²	136.1	70%	0.701	79%	0.789	S	S	*	*			cis	-159.6	156.5	-18.9	-92.2	-16.4	0	0	0	106.5
205	L	28.2	Very low	30.3	Very low	156 Å²	156	135 Å²	135	82%	0.817	79%	0.786	S	S	*	*			cis	94.5	55.7	19.8	-161.9	59.4	0	0	0	116
206	T	30.8	Very low	30.2	Very low	149 Å²	149	134.1 Å²	134.1	91%	0.914	79%	0.786	S	S	*	*			trans	-127.3	110.2	155.1	18.6	0	0	0	0	112.8
207	S	26.7	Very low	30.3	Very low	93 Å²	93	133.9 Å²	133.9	65%	0.65	79%	0.787	S	S	*	*			trans	-146.8	148.2	171.9	179.9	0	0	0	0	109.2
208	N	28.5	Very low	30.1	Very low	154 Å²	154	134.6 Å²	134.6	82%	0.824	79%	0.785	S	S	*	*			trans	58.5	56.2	166.9	-62.3	-23.4	0	0	0	118.4
209	I	28.4	Very low	30.1	Very low	166 Å²	166	133.5 Å²	133.5	85%	0.851	79%	0.786	S	S	*	*			trans	-135.7	77.4	154.1	-47.5	178.9	0	0	0	111.7
210	V	31.5	Very low	30.2	Very low	132 Å²	132	134.8 Å²	134.8	80%	0.8	79%	0.788	S	S	*	*			trans	-159.1	122.1	132.5	169.7	0	0	0	0	106.3
211	Q	31.1	Very low	30.1	Very low	165 Å²	165	134.7 Å²	134.7	77%	0.771	79%	0.787	S	S	*	*			trans	-107.9	150.8	169.1	-80.6	178.1	-66.8	0	0	110.5
212	N	27.3	Very low	30	Very low	143 Å²	143	135 Å²	135	77%	0.765	80%	0.796	S	S	*	*			trans	59.7	79	151.6	-55	-16.1	0	0	0	118.4
213	T	29.5	Very low	29.9	Very low	133 Å²	133	134 Å²	134	82%	0.816	80%	0.8	S	S	*	*			trans	-156.9	148.5	149	14	0	0	0	0	110.1
214	A	29.4	Very low	29.8	Very low	94 Å²	94	135.1 Å²	135.1	78%	0.777	81%	0.806	S	S	*	*			trans	48.7	116.1	172.4	0	0	0	0	0	117.1
215	N	29.8	Very low	29.9	Very low	163 Å²	163	136.5 Å²	136.5	87%	0.872	81%	0.813	S	S	*	*			cis	52.4	114.2	23.9	-88.3	1.2	0	0	0	115.6
216	A	27.8	Very low	30.1	Very low	96 Å²	96	134.5 Å²	134.5	79%	0.793	81%	0.807	S	S	*	*			trans	86.2	144.9	177.7	0	0	0	0	0	117.9
217	L	31.9	Very low	30.2	Very low	172 Å²	172	134.7 Å²	134.7	90%	0.901	80%	0.803	S	S	*	*			trans	93.5	129.7	173.1	-58.4	168.1	0	0	0	118.4
218	N	31.3	Very low	30.4	Very low	134 Å²	134	136 Å²	136	72%	0.717	81%	0.81	S	S	*	*			trans	-62.3	141.2	-162.8	-64.3	-28.8	0	0	0	116.9	L220	N218-L220 HydrophobicContact CB-CB 4.02Å; N218-L220 PolarHBondContact O-N 3.43Å; N218-L220 VanDerWaalsContact O-N 3.07Å
219	P	31.4	Very low	30.7	Very low	133 Å²	133	133.1 Å²	133.1	86%	0.864	81%	0.808	S	S	*	*	S	Bend	trans	-80.6	63.6	154.4	36.1	-33.7	0	0	0	110.8
220	L	28.6	Very low	31	Very low	149 Å²	149	131.5 Å²	131.5	78%	0.78	81%	0.806	S	S	*	*			trans	-118.7	13.1	174.7	-151.8	92.2	0	0	0	113.3	N218	N218-L220 HydrophobicContact CB-CB 4.02Å; N218-L220 PolarHBondContact O-N 3.43Å; N218-L220 VanDerWaalsContact O-N 3.07Å
221	V	31.5	Very low	30.9	Very low	142 Å²	142	130.7 Å²	130.7	86%	0.861	80%	0.801	S	S	*	*			trans	-142.6	89.2	175.8	-173.7	0	0	0	0	109.6
222	A	30.4	Very low	31	Very low	104 Å²	104	128.8 Å²	128.8	86%	0.86	80%	0.796	S	S	*	*			trans	-155.5	23.5	177.4	0	0	0	0	0	114.4
223	A	28.7	Very low	31.1	Very low	100 Å²	100	128.2 Å²	128.2	83%	0.826	79%	0.791	S	S	*	*			trans	-140	45.9	-170.7	0	0	0	0	0	113.9
224	V	31.7	Very low	31.2	Very low	128 Å²	128	126.2 Å²	126.2	78%	0.776	77%	0.774	S	S	*	*			trans	-141.7	150	171.8	-172.8	0	0	0	0	108.6
225	L	34.2	Very low	31.4	Very low	161 Å²	161	124.3 Å²	124.3	84%	0.843	76%	0.755	S	S	*	*			trans	77.4	130.6	-174.9	-48.6	177.9	0	0	0	115.3
226	V	32.6	Very low	31.6	Very low	113 Å²	113	124 Å²	124	69%	0.685	75%	0.748	S	S	*	*			cis	167.6	114.1	-48.9	157.5	0	0	0	0	107.8
227	N	31.6	Very low	31.7	Very low	154 Å²	154	126.6 Å²	126.6	82%	0.824	75%	0.748	S	S	*	*			trans	58.7	167.9	156.6	-57.5	-11.6	0	0	0	118.7
228	C	30.5	Very low	31.7	Very low	120 Å²	120	123.1 Å²	123.1	81%	0.811	74%	0.744	S	S	*	*			cis	-154.8	157.5	2.7	-150.9	0	0	0	0	112
229	A	34.5	Very low	31.7	Very low	94 Å²	94	120.3 Å²	120.3	78%	0.777	75%	0.746	S	S	*	*			trans	-163.7	179.5	160.3	0	0	0	0	0	111.8
230	T	35.2	Very low	31.6	Very low	132 Å²	132	118.8 Å²	118.8	81%	0.81	74%	0.739	S	S	*	*			trans	-157.3	166.5	-166.2	42.9	0	0	0	0	112
231	V	30.7	Very low	31.7	Very low	115 Å²	115	116.5 Å²	116.5	70%	0.697	73%	0.726	S	S	*	*			cis	-179.1	-173.1	-18.1	66.4	0	0	0	0	108.6
232	N	31.8	Very low	31.5	Very low	125 Å²	125	114.7 Å²	114.7	67%	0.668	72%	0.718	S	S	*	*			trans	72.3	161.1	170.8	-69.5	-12.6	0	0	0	117.4
233	M	30.1	Very low	31.6	Very low	131 Å²	131	116.1 Å²	116.1	65%	0.645	72%	0.717	S	S	*	*			cis	-177.6	168.2	-28.2	-101	-154	-72.2	0	0	108.3
234	I	31.3	Very low	31.6	Very low	90 Å²	90	116.5 Å²	116.5	46%	0.462	71%	0.711	S	S	.	*			cis	-167.4	158.9	-34.5	-125.8	178.7	0	0	0	108.7	T673 N674	I234-T673 WeakPolarHBondContact CA-OG1 3.33Å; I234-T673 PolarHBondContact N-OG1 2.9Å; I234-T673 PolarHBondContact O-OG1 2.8Å; I234-N674 HydrophobicContact CG1-CB 3.94Å; I234-N674 VanDerWaalsContact CG1-ND2 3.26Å; I234-N674 WeakPolarHBondContact CG1-ND2 3.42Å
235	S	32.8	Very low	31.3	Very low	55 Å²	55	117.8 Å²	117.8	39%	0.385	71%	0.711	S	S	.	*			trans	73	153.4	173.1	-67.7	0	0	0	0	118.4	T673	S235-T673 CarbonylContact C-O 2.95Å; S235-T673 PolarHBondContact N-OG1 3.45Å; S235-T673 CarbonylContact O-C 3.55Å; S235-T673 PolarHBondContact O-OG1 3.22Å
236	Q	34.8	Very low	30.8	Very low	157 Å²	157	116 Å²	116	73%	0.734	71%	0.707	S	S	*	*			cis	-164.4	-152	-8.8	-108.6	-175	121.7	0	0	110	T673	Q236-T673 PolarHBondContact N-O 3.22Å
237	L	31	Very low	30.5	Very low	150 Å²	150	117.4 Å²	117.4	79%	0.785	71%	0.71	S	S	*	*				-157.3	154.3	-90	-133.8	176.9	0	0	0	111.5
238	A	30.5	Very low	30.2	Very low	98 Å²	98	115.3 Å²	115.3	81%	0.81	71%	0.708	S	S	*	*			trans	84.4	139.8	153.8	0	0	0	0	0	123.9
239	G	32.2	Very low	30.1	Very low	75 Å²	75	115 Å²	115	77%	0.773	71%	0.707	S	S	*	*			trans	110.8	144.3	159.4	0	0	0	0	0	117.4
240	S	29.6	Very low	29.7	Very low	102 Å²	102	115.9 Å²	115.9	71%	0.713	70%	0.703	S	S	*	*			cis	175.6	157.4	-46.1	49.5	0	0	0	0	111
241	M	29.9	Very low	29.6	Very low	100 Å²	100	118.2 Å²	118.2	49%	0.493	71%	0.706	S	S	.	*			trans	80.3	174.9	163.2	-54.3	-53.9	112.2	0	0	119.2	I294 P295	M241-I294 HydrophobicContact CE-CG2 3.54Å; M241-I294 HydrophobicContact SD-CB 4.33Å; M241-I294 HydrophobicContact SD-CG1 4.14Å; M241-I294 HydrophobicContact SD-CG2 3.82Å; M241-P295 HydrophobicContact CE-CG 3.7Å; M241-P295 HydrophobicContact SD-CG 4.39Å
242	C	26.7	Very low	29.3	Very low	105 Å²	105	120.1 Å²	120.1	71%	0.709	71%	0.713	S	S	*	*			trans	-119	-174.4	-152.3	-56.6	0	0	0	0	114.8
243	T	32.1	Very low	29.4	Very low	134 Å²	134	117.8 Å²	117.8	82%	0.822	72%	0.718	S	S	*	*			trans	-59.2	162	177.8	58.9	0	0	0	0	113.8
244	P	30.4	Very low	29.3	Very low	108 Å²	108	119 Å²	119	70%	0.701	73%	0.728	S	S	*	*				-156.4	155.7	98.4	42.6	-24.6	0	0	0	118.5
245	I	24.8	Very low	29.3	Very low	154 Å²	154	119.8 Å²	119.8	79%	0.79	74%	0.736	S	S	*	*				53.3	106.8	128.6	-59.6	174.4	0	0	0	121.7
246	V	24.6	Very low	29.2	Very low	125 Å²	125	124.9 Å²	124.9	76%	0.758	76%	0.759	S	S	*	*				68.1	151.7	125.8	179.9	0	0	0	0	122.2
247	N	25.7	Very low	28.9	Very low	141 Å²	141	120.3 Å²	120.3	75%	0.754	75%	0.754	S	S	*	*			trans	90.5	91.2	164.2	-82.4	-15	0	0	0	120.7
248	S	24.8	Very low	29	Very low	111 Å²	111	119.2 Å²	119.2	78%	0.776	76%	0.759	S	S	*	*				42	108.9	105.6	-49.1	0	0	0	0	120.7
249	S	29.4	Very low	28.9	Very low	112 Å²	112	121.1 Å²	121.1	78%	0.783	76%	0.756	S	S	*	*				-165.5	121.4	127.3	61.2	0	0	0	0	114
250	V	25.8	Very low	28.9	Very low	114 Å²	114	123 Å²	123	69%	0.691	75%	0.752	S	S	*	*				31.7	121.5	128.1	-176.9	0	0	0	0	119.2
251	M	32.1	Very low	28.9	Very low	180 Å²	180	123.7 Å²	123.7	89%	0.887	75%	0.748	S	S	*	*				-162.3	142.8	115.8	-98	-58	170.2	0	0	110.8
252	D	25.1	Very low	28.9	Very low	156 Å²	156	124.8 Å²	124.8	83%	0.834	76%	0.755	S	S	*	*			trans	-89.4	159.1	-171.6	-62.4	-87.2	0	0	0	114.4
253	G	32.7	Very low	29.3	Very low	75 Å²	75	125.5 Å²	125.5	77%	0.773	75%	0.752	S	S	*	*			trans	178.3	96.1	172.1	0	0	0	0	0	116.8
254	N	28.4	Very low	29.3	Very low	158 Å²	158	124.5 Å²	124.5	85%	0.845	74%	0.742	S	S	*	*			trans	9.4	149.6	145.7	-91.5	7	0	0	0	121.6
255	V	31.2	Very low	29.4	Very low	105 Å²	105	125.1 Å²	125.1	64%	0.636	74%	0.739	S	S	*	*			cis	-175.3	164.8	-17.7	96.1	0	0	0	0	108.9
256	N	30.9	Very low	29.7	Very low	162 Å²	162	125.5 Å²	125.5	87%	0.866	74%	0.737	S	S	*	*			trans	66.3	149.6	177.3	-61.8	-29.8	0	0	0	116.7
257	G	29.5	Very low	30	Very low	62 Å²	62	126 Å²	126	64%	0.639	74%	0.741	S	S	*	*			cis	165.3	156.7	-8.6	0	0	0	0	0	113.3
258	S	32.3	Very low	30.2	Very low	127 Å²	127	123.3 Å²	123.3	89%	0.888	73%	0.733	S	S	*	*			trans	78.2	126.6	-177.1	-44.3	0	0	0	0	115.3
259	N	28.1	Very low	30.5	Very low	138 Å²	138	125 Å²	125	74%	0.738	74%	0.738	S	S	*	*			cis	117.7	158.9	13.5	-173.7	29.1	0	0	0	111.3
260	V	32.8	Very low	30.5	Very low	115 Å²	115	126.9 Å²	126.9	70%	0.697	74%	0.74	S	S	*	*			trans	83.7	88	175.4	-168.5	0	0	0	0	114.2
261	N	29.8	Very low	30.8	Very low	116 Å²	116	124.8 Å²	124.8	62%	0.62	74%	0.741	S	S	*	*				82.8	147	75.6	-67.9	6	0	0	0	113.3
262	N	30.5	Very low	30.7	Very low	122 Å²	122	121.3 Å²	121.3	65%	0.652	73%	0.734	S	S	*	*			cis	-167.5	157.8	-8.3	-110.1	7.1	0	0	0	110.7
263	N	33.2	Very low	30.9	Very low	121 Å²	121	120.2 Å²	120.2	65%	0.647	73%	0.733	S	S	*	*			trans	62.5	151.4	142.4	-64.8	37.3	0	0	0	121.2
264	D	33.6	Very low	30.8	Very low	113 Å²	113	121.8 Å²	121.8	60%	0.604	73%	0.732	S	S	*	*			cis	-167.9	157.7	-26.3	-108.7	-24.5	0	0	0	112.2
265	N	31.3	Very low	31	Very low	120 Å²	120	122.4 Å²	122.4	64%	0.642	73%	0.734	S	S	*	*			trans	36.5	120	140.3	-60.5	-40.7	0	0	0	121.2
266	H	31.9	Very low	30.9	Very low	162 Å²	162	120.2 Å²	120.2	75%	0.75	73%	0.732	S	S	*	*				77.9	116.8	71.1	-94.4	-84	0	0	0	116.2
267	T	29.8	Very low	31.1	Very low	137 Å²	137	120.2 Å²	120.2	84%	0.84	73%	0.732	S	S	*	*			trans	172.6	125	132.8	27.5	0	0	0	0	107.2
268	S	31.2	Very low	31.3	Very low	84 Å²	84	123.2 Å²	123.2	59%	0.587	74%	0.738	S	S	*	*			cis	78.6	106.2	23.2	-168.6	0	0	0	0	115.9
269	V	31.2	Very low	31.4	Very low	145 Å²	145	120.8 Å²	120.8	88%	0.879	73%	0.733	S	S	*	*			trans	-138.9	143.7	156.6	-174.3	0	0	0	0	107.9
270	N	29.2	Very low	31.7	Very low	153 Å²	153	121 Å²	121	82%	0.818	74%	0.739	S	S	*	*			trans	-129.9	162.2	-170.3	-85.3	-37.1	0	0	0	112.3
271	G	31.6	Very low	31.5	Very low	69 Å²	69	118.7 Å²	118.7	71%	0.711	74%	0.738	S	S	*	*			trans	151	128.6	155.9	0	0	0	0	0	114.4
272	S	30.9	Very low	31.9	Very low	107 Å²	107	120.3 Å²	120.3	75%	0.748	75%	0.752	S	S	*	*			cis	129	99.6	-15.2	78.6	0	0	0	0	114.8
273	V	29.4	Very low	31.7	Very low	134 Å²	134	123 Å²	123	81%	0.812	77%	0.766	S	S	*	*			trans	-147.3	135.1	160.4	-178.7	0	0	0	0	107.4
274	S	28.9	Very low	31.8	Very low	107 Å²	107	120.9 Å²	120.9	75%	0.748	77%	0.773	S	S	*	*			cis	101.8	63.5	4.1	-45.5	0	0	0	0	118.2
275	I	32.6	Very low	31.8	Very low	172 Å²	172	119.1 Å²	119.1	88%	0.882	78%	0.782	S	S	*	*			trans	-135.2	145.5	155.1	-54.7	179.2	0	0	0	108.7
276	G	29.5	Very low	31.9	Very low	59 Å²	59	120.5 Å²	120.5	61%	0.608	79%	0.794	S	S	*	*			trans	-163.7	176.6	170.6	0	0	0	0	0	111.7
277	N	35.1	Very low	31.8	Very low	161 Å²	161	118.5 Å²	118.5	86%	0.861	80%	0.798	S	S	*	*			trans	-170.4	148.1	163.2	-106.6	-22.6	0	0	0	114.2
278	V	34	Very low	31.8	Very low	126 Å²	126	115.3 Å²	115.3	76%	0.764	79%	0.792	S	S	*	*			trans	36.1	105	149.5	-171.7	0	0	0	0	117	V280	V278-V280 HydrophobicContact CG1-CG2 4.22Å
279	G	34	Very low	31.7	Very low	75 Å²	75	119.1 Å²	119.1	77%	0.773	81%	0.805	S	S	*	*				122.3	-176.5	74.2	0	0	0	0	0	109.1
280	V	34.5	Very low	31.5	Very low	144 Å²	144	120 Å²	120	87%	0.873	80%	0.804	S	S	*	*			cis	-148.2	165.3	-7.8	-174.8	0	0	0	0	106.3	V278	V278-V280 HydrophobicContact CG1-CG2 4.22Å
281	G	30	Very low	31.4	Very low	66 Å²	66	118.5 Å²	118.5	68%	0.68	80%	0.801	S	S	*	*			trans	-141.8	173.5	-175.7	0	0	0	0	0	117.1
282	V	36.8	Very low	31	Very low	150 Å²	150	122.3 Å²	122.3	91%	0.909	81%	0.81	S	S	*	*			trans	-144.2	154.6	173.9	-76.4	0	0	0	0	110.8
283	N	27.4	Very low	30.9	Very low	178 Å²	178	123 Å²	123	95%	0.952	81%	0.81	S	S	*	*			trans	-129.7	154.2	-170	-88.5	-41.2	0	0	0	114.1
284	G	33.9	Very low	30.8	Very low	76 Å²	76	122 Å²	122	78%	0.784	80%	0.799	S	S	*	*			trans	167.7	129.6	169	0	0	0	0	0	107.6
285	G	34.1	Very low	30.8	Very low	77 Å²	77	120.7 Å²	120.7	79%	0.794	79%	0.788	S	S	*	*			cis	100.6	125.7	47.3	0	0	0	0	0	107.4
286	V	33.7	Very low	30.8	Very low	148 Å²	148	118.9 Å²	118.9	90%	0.897	79%	0.785	S	S	*	*			cis	-148.8	160.6	20.5	-165.8	0	0	0	0	110.3
287	S	29.9	Very low	30.7	Very low	120 Å²	120	120.4 Å²	120.4	84%	0.839	79%	0.792	S	S	*	*			trans	-60.6	163.4	163.4	-48.2	0	0	0	0	112.2
288	G	30.5	Very low	30.6	Very low	70 Å²	70	118.2 Å²	118.2	72%	0.722	79%	0.789	S	S	*	*			cis	145.7	144.6	0.2	0	0	0	0	0	110.5
289	I	28.8	Very low	30.6	Very low	164 Å²	164	119.9 Å²	119.9	84%	0.841	79%	0.793	S	S	*	*			trans	-146.1	137.5	178.4	-23.3	174.4	0	0	0	110.3
290	N	27.7	Very low	30.4	Very low	163 Å²	163	122.2 Å²	122.2	87%	0.872	79%	0.787	S	S	*	*			trans	-99.8	129.6	171.4	-74.5	-19.5	0	0	0	110.3
291	T	25.8	Very low	30.2	Very low	122 Å²	122	121.1 Å²	121.1	75%	0.748	78%	0.783	S	S	*	*			trans	-136.2	123.7	164.5	49.8	0	0	0	0	109.8
292	V	24.5	Very low	30.2	Very low	149 Å²	149	121 Å²	121	90%	0.903	77%	0.767	S	S	*	*			trans	-86.7	125.1	173.3	175.4	0	0	0	0	108.5
293	T	27.5	Very low	29.7	Very low	122 Å²	122	118.2 Å²	118.2	75%	0.748	75%	0.746	S	S	*	*			trans	-127.4	133.2	175.3	-49.2	0	0	0	0	110.9
294	I	28.8	Very low	29.9	Very low	113 Å²	113	116.6 Å²	116.6	58%	0.579	74%	0.737	S	S	*	*			trans	-68.7	134.8	-177.8	-74.1	167.9	0	0	0	110.5	M241	M241-I294 HydrophobicContact CE-CG2 3.54Å; M241-I294 HydrophobicContact SD-CB 4.33Å; M241-I294 HydrophobicContact SD-CG1 4.14Å; M241-I294 HydrophobicContact SD-CG2 3.82Å
295	P	28.8	Very low	29.7	Very low	80 Å²	80	116.8 Å²	116.8	52%	0.519	73%	0.726	S	S	.	*			trans	-72.4	131.8	177	27.6	-35.2	0	0	0	113	M241	M241-P295 HydrophobicContact CE-CG 3.7Å; M241-P295 HydrophobicContact SD-CG 4.39Å
296	T	31.3	Very low	29.5	Very low	133 Å²	133	116.1 Å²	116.1	82%	0.816	71%	0.713	S	S	*	*			trans	-139.1	152.2	176.6	50	0	0	0	0	112
297	A	28.8	Very low	29.3	Very low	91 Å²	91	116.9 Å²	116.9	75%	0.752	71%	0.71	S	S	*	*			trans	-83.3	156.3	-164.3	0	0	0	0	0	116.4
298	S	32.2	Very low	29.2	Very low	115 Å²	115	116.2 Å²	116.2	80%	0.804	70%	0.703	S	S	*	*			trans	-140.3	97.8	149.5	-73.6	0	0	0	0	106.4
299	L	33.2	Very low	29.1	Very low	161 Å²	161	119.6 Å²	119.6	84%	0.843	70%	0.704	S	S	*	*				96.8	127.5	73.2	-82.3	165.2	0	0	0	111.8
300	L	29.9	Very low	29.1	Very low	124 Å²	124	117.6 Å²	117.6	65%	0.649	70%	0.702	S	S	*	*			trans	-83.9	168.4	-176	-122.9	76.8	0	0	0	111.4	N302	L300-N302 HydrophobicContact CD2-CB 4.07Å
301	P	30	Very low	29	Very low	121 Å²	121	114.3 Å²	114.3	79%	0.786	69%	0.688	S	S	*	*				-121.5	141.8	55.9	7.5	16.9	0	0	0	114.1
302	N	30.7	Very low	29	Very low	64 Å²	64	118.9 Å²	118.9	34%	0.342	69%	0.693	S	S	.	*				-45.2	135.1	88.1	-48.3	-23.1	0	0	0	117.4	L300 S676 D678	L300-N302 HydrophobicContact CD2-CB 4.07Å; N302-S676 VanDerWaalsContact CB-O 3.3Å; N302-S676 WeakPolarHBondContact CB-O 3.42Å; N302-S676 PolarHBondContact ND2-O 3.31Å; N302-D678 HydrophobicContact CB-CB 4.32Å
303	L	27.5	Very low	29.1	Very low	91 Å²	91	119.9 Å²	119.9	48%	0.476	69%	0.691	S	S	.	*				157.9	100	123.7	-85.4	166.4	0	0	0	111.6	I675 D678	L303-I675 HydrophobicContact CD1-CG2 3.7Å; L303-I675 HydrophobicContact CG-CG2 4.48Å; L303-D678 VanDerWaalsContact CA-OD2 3.24Å; L303-D678 WeakPolarHBondContact CA-OD2 3.29Å; L303-D678 PolarHBondContact N-OD2 3.15Å
304	L	30.4	Very low	29	Very low	144 Å²	144	119.3 Å²	119.3	75%	0.754	69%	0.692	S	S	*	*			trans	-160	91.9	135.3	-134	71.5	0	0	0	113.8	D678	L304-D678 VanDerWaalsContact C-OD1 3.32Å; L304-D678 VanDerWaalsContact N-CG 3.31Å; L304-D678 PolarHBondContact N-OD1 3.32Å; L304-D678 PolarHBondContact N-OD2 2.85Å; L304-D678 VanDerWaalsContact N-OD2 3.13Å
305	S	30.2	Very low	28.8	Very low	81 Å²	81	117.3 Å²	117.3	57%	0.566	70%	0.699	S	S	*	*			trans	17.4	121.1	141.6	59.4	0	0	0	0	118.5
306	A	28.8	Very low	28.7	Very low	62 Å²	62	121.5 Å²	121.5	51%	0.512	72%	0.716	S	S	.	*				55.2	87.4	67.6	0	0	0	0	0	114.6	L680	A306-L680 HydrophobicContact CB-CD1 3.35Å; A306-L680 HydrophobicContact CB-CG 4.47Å
307	I	29.2	Very low	28.3	Very low	165 Å²	165	123.2 Å²	123.2	85%	0.846	72%	0.715	S	S	*	*			trans	-166.1	144.2	151	-101.1	147.4	0	0	0	108.9
308	P	28.3	Very low	28.3	Very low	106 Å²	106	125.9 Å²	125.9	69%	0.688	72%	0.716	S	S	*	*			trans	-103.7	-178.1	-165.7	40.9	-38	0	0	0	116.1
309	L	28	Very low	27.9	Very low	140 Å²	140	126.6 Å²	126.6	73%	0.733	71%	0.711	S	S	*	*			trans	-2.2	140.7	159.6	-74.5	99.3	0	0	0	119	T311	L309-T311 WeakPolarHBondContact CD2-OG1 3.4Å
310	P	28.9	Very low	27.6	Very low	122 Å²	122	125.3 Å²	125.3	79%	0.792	71%	0.71	S	S	*	*				-115.5	153.1	75.4	-3.3	24.5	0	0	0	113.1
311	T	26.6	Very low	27.6	Very low	95 Å²	95	125 Å²	125	58%	0.583	72%	0.718	S	S	*	*			cis	71.7	115.4	44.1	-41.6	0	0	0	0	113.8	L309	L309-T311 WeakPolarHBondContact CD2-OG1 3.4Å
312	Y	24.9	Very low	27.4	Very low	218 Å²	218	123.4 Å²	123.4	86%	0.855	72%	0.724	S	S	*	*			trans	10.1	109.9	162.9	-78.2	-97.7	0	0	0	118.8
313	I	26.8	Very low	27	Very low	169 Å²	169	123.4 Å²	123.4	87%	0.867	74%	0.739	S	S	*	*			trans	-127.7	134.1	142.7	-65.3	-176.5	0	0	0	107.8
314	S	25.4	Very low	27	Very low	110 Å²	110	126.7 Å²	126.7	77%	0.769	76%	0.755	S	S	*	*			trans	-93	140.1	177.8	-58.7	0	0	0	0	111.4
315	G	25.1	Very low	26.7	Very low	71 Å²	71	127.1 Å²	127.1	73%	0.732	76%	0.757	S	S	*	*			trans	94.6	170.4	163.7	0	0	0	0	0	116.1
316	L	27.2	Very low	26.4	Very low	168 Å²	168	129.5 Å²	129.5	88%	0.88	77%	0.768	S	S	*	*			trans	65.2	82.6	-176.9	-57.7	177.3	0	0	0	115.3
317	E	23.1	Very low	26.3	Very low	170 Å²	170	131.8 Å²	131.8	79%	0.794	78%	0.78	S	S	*	*				-0.9	133.1	128.5	-52.6	174.5	146	0	0	116.3
318	L	27.9	Very low	26.2	Very low	147 Å²	147	128.7 Å²	128.7	77%	0.77	77%	0.771	S	S	*	*				178.8	105.5	107.7	-91.8	171.8	0	0	0	112.1
319	N	24.5	Very low	26.2	Very low	130 Å²	130	130.9 Å²	130.9	70%	0.695	78%	0.777	S	S	*	*			trans	31.7	110.6	130.8	-48.2	-13.2	0	0	0	118.8
320	T	27.5	Very low	26.3	Very low	133 Å²	133	131.8 Å²	131.8	82%	0.816	78%	0.782	S	S	*	*				169.3	152.1	104.6	36.1	0	0	0	0	114.3
321	S	27.9	Very low	26.1	Very low	117 Å²	117	133.5 Å²	133.5	82%	0.818	78%	0.784	S	S	*	*			trans	42.7	76.5	158.2	56.3	0	0	0	0	118.8
322	G	26.2	Very low	26.2	Very low	88 Å²	88	135.2 Å²	135.2	91%	0.907	80%	0.799	S	S	*	*			trans	-77.3	118.9	166	0	0	0	0	0	112.8
323	G	23.5	Very low	26.3	Very low	64 Å²	64	131.3 Å²	131.3	66%	0.66	79%	0.792	S	S	*	*			trans	-126.3	108.7	172.7	0	0	0	0	0	111.7
324	I	25.9	Very low	26.4	Very low	161 Å²	161	128.4 Å²	128.4	83%	0.826	78%	0.782	S	S	*	*			trans	-138.6	101.3	176.4	-55.3	-179.7	0	0	0	105.3
325	I	24.7	Very low	26.4	Very low	153 Å²	153	133.6 Å²	133.6	79%	0.785	79%	0.785	S	S	*	*				68.1	124.8	75.3	-59.5	172.2	0	0	0	111.5
326	T	24.4	Very low	26.4	Very low	130 Å²	130	136.2 Å²	136.2	80%	0.798	79%	0.787	S	S	*	*			trans	-74.6	137.9	-167.3	48.6	0	0	0	0	114
327	S	25.8	Very low	26.4	Very low	110 Å²	110	134 Å²	134	77%	0.769	78%	0.78	S	S	*	*			trans	-85	126.2	166.4	-173.8	0	0	0	0	111.2
328	P	27.3	Very low	26.5	Very low	100 Å²	100	133.7 Å²	133.7	65%	0.649	78%	0.779	S	S	*	*			trans	-93.6	106.7	-175.3	34.2	-32.3	0	0	0	113.3	N330	P328-N330 PolarHBondContact O-N 3.32Å
329	N	28.8	Very low	26.6	Very low	153 Å²	153	132.1 Å²	132.1	82%	0.818	78%	0.775	S	S	*	*			trans	-91.3	87.5	162.2	-77.7	-29.5	0	0	0	109.5
330	N	29.2	Very low	26.6	Very low	158 Å²	158	132 Å²	132	85%	0.845	78%	0.779	S	S	*	*			trans	-70.8	136.3	-179.2	-88.7	-10	0	0	0	112.8	P328	P328-N330 PolarHBondContact O-N 3.32Å
331	L	25.3	Very low	26.7	Very low	159 Å²	159	132 Å²	132	83%	0.832	78%	0.778	S	S	*	*			trans	-81.2	150.6	172	-69.8	74.6	0	0	0	111.2
332	C	29.1	Very low	26.6	Very low	131 Å²	131	130.8 Å²	130.8	89%	0.885	77%	0.77	S	S	*	*			trans	-166.7	142.4	144.2	-95.2	0	0	0	0	106.8
333	D	26.4	Very low	26.9	Very low	136 Å²	136	132.1 Å²	132.1	73%	0.727	77%	0.765	S	S	*	*			cis	-160.5	149.2	-21.6	-166.4	7.7	0	0	0	104
334	V	28.7	Very low	27	Very low	108 Å²	108	133.3 Å²	133.3	66%	0.655	77%	0.769	S	S	*	*				176.1	127.5	91.6	159	0	0	0	0	109
335	R	25	Very low	27.3	Very low	218 Å²	218	135 Å²	135	82%	0.823	77%	0.77	S	S	*	*			trans	41.8	109.9	151.8	-58.2	169.2	-169.1	-174.9	0.4	118.8
336	V	25.2	Very low	27.4	Very low	127 Å²	127	133.2 Å²	133.2	77%	0.77	77%	0.766	S	S	*	*				74.4	110.5	62.2	176.7	0	0	0	0	115.1
337	T	27.4	Very low	27.5	Very low	122 Å²	122	134.4 Å²	134.4	75%	0.748	77%	0.767	S	S	*	*				-167	119	121.1	43.5	0	0	0	0	111.8
338	H	26.3	Very low	27.7	Very low	163 Å²	163	135.5 Å²	135.5	76%	0.755	76%	0.764	S	S	*	*			trans	45.9	146.8	137.2	-61.8	-73.6	0	0	0	121.8
339	T	28.7	Very low	27.7	Very low	113 Å²	113	135.2 Å²	135.2	69%	0.693	76%	0.761	S	S	*	*			cis	-165.9	153	12.8	-3.4	0	0	0	0	111.5
340	V	25.7	Very low	27.6	Very low	129 Å²	129	134.6 Å²	134.6	78%	0.782	76%	0.757	S	S	*	*			trans	29.6	145.6	158.4	-99.9	0	0	0	0	121.4
341	V	29.1	Very low	27.7	Very low	132 Å²	132	135 Å²	135	80%	0.8	76%	0.759	S	S	*	*			cis	-150	148	46.9	180	0	0	0	0	113.3
342	S	26.3	Very low	27.9	Very low	92 Å²	92	134.4 Å²	134.4	64%	0.643	76%	0.758	S	S	*	*			trans	-41.3	151.2	167.4	-41.8	0	0	0	0	116.6
343	S	31.8	Very low	28	Very low	115 Å²	115	135.9 Å²	135.9	80%	0.804	76%	0.757	S	S	*	*				-169	143.6	70.2	-60	0	0	0	0	110.1
344	A	25.4	Very low	27.9	Very low	89 Å²	89	133.3 Å²	133.3	74%	0.736	76%	0.762	S	S	*	*			cis	107.8	86.6	25.1	0	0	0	0	0	114.2
345	K	32.5	Very low	27.8	Very low	198 Å²	198	135.3 Å²	135.3	86%	0.861	77%	0.767	S	S	*	*			trans	-178.5	101.8	153.7	-102.6	167.9	-177.1	180	0	107.7
346	T	26.4	Very low	27.7	Very low	114 Å²	114	132.8 Å²	132.8	70%	0.699	77%	0.769	S	S	*	*				74.8	126.2	59.4	69.1	0	0	0	0	115.7
347	L	27.7	Very low	27.7	Very low	155 Å²	155	132.2 Å²	132.2	81%	0.812	77%	0.765	S	S	*	*			trans	82.1	139.3	160.2	-63.2	155.9	0	0	0	117.2
348	N	28.5	Very low	27.5	Very low	134 Å²	134	132.2 Å²	132.2	72%	0.717	77%	0.765	S	S	*	*			cis	-148.3	171	-8.9	-158.7	23.6	0	0	0	113.7
349	T	27.3	Very low	27.7	Very low	94 Å²	94	129.8 Å²	129.8	58%	0.577	76%	0.764	S	S	*	*			trans	-49.8	141.7	-177.8	52	0	0	0	0	119.3
350	N	27.1	Very low	27.4	Very low	139 Å²	139	131.8 Å²	131.8	74%	0.743	77%	0.769	S	S	*	*				54.8	124.3	129.1	-48	-1.9	0	0	0	120.7
351	N	31.2	Very low	27.3	Very low	166 Å²	166	133.3 Å²	133.3	89%	0.888	77%	0.773	S	S	*	*				-155.7	150.6	109.7	-108.7	-22.4	0	0	0	112
352	N	30.9	Very low	27.3	Very low	148 Å²	148	133.6 Å²	133.6	79%	0.791	78%	0.775	S	S	*	*			trans	-84.6	141.4	-179.5	-66.8	-24	0	0	0	111.2
353	N	30.7	Very low	27.2	Very low	162 Å²	162	137 Å²	137	87%	0.866	78%	0.781	S	S	*	*				-176.1	120.7	122.7	-91.2	-14.9	0	0	0	109.5
354	G	24.9	Very low	26.9	Very low	81 Å²	81	138.5 Å²	138.5	84%	0.835	78%	0.78	S	S	*	*			trans	-94.5	128	175.2	0	0	0	0	0	111.1
355	I	26.5	Very low	26.9	Very low	151 Å²	151	141.4 Å²	141.4	77%	0.774	78%	0.781	S	S	*	*			trans	-120.6	124.5	161.3	-58.7	-178.4	0	0	0	107	V357	I355-V357 HydrophobicContact CG2-CG2 3.87Å; I355-V357 PolarHBondContact O-N 2.84Å
356	I	22.7	Very low	26.5	Very low	165 Å²	165	137.7 Å²	137.7	85%	0.846	78%	0.775	S	S	*	*			trans	-80.1	116.1	173.9	-62.1	172.1	0	0	0	107.3
357	V	25.5	Very low	26.5	Very low	114 Å²	114	139.6 Å²	139.6	69%	0.691	79%	0.786	S	S	*	*			trans	-123.9	118.7	171.6	-175.4	0	0	0	0	108.9	I355 P359	I355-V357 HydrophobicContact CG2-CG2 3.87Å; I355-V357 PolarHBondContact O-N 2.84Å; V357-P359 WeakPolarHBondContact O-CD 3.38Å
358	T	22.8	Very low	26.3	Very low	123 Å²	123	137.3 Å²	137.3	76%	0.755	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-92.4	120.6	170.1	48.6	0	0	0	0	110.2
359	P	29.3	Very low	26.4	Very low	112 Å²	112	137.1 Å²	137.1	73%	0.727	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-99.9	117.9	168.5	1.9	19.4	0	0	0	110.9	V357	V357-P359 WeakPolarHBondContact O-CD 3.38Å
360	L	23.1	Very low	26.4	Very low	155 Å²	155	138 Å²	138	81%	0.812	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-76.2	156.7	142.6	-85.5	94.8	0	0	0	108.6
361	N	24	Very low	26.4	Very low	161 Å²	161	137 Å²	137	86%	0.861	80%	0.804	S	S	*	*			trans	32.6	91.1	164.9	-75.1	15.1	0	0	0	118.1
362	V	29.3	Very low	26.2	Very low	137 Å²	137	135.4 Å²	135.4	83%	0.83	80%	0.804	S	S	*	*			trans	-138.2	136.3	141.8	-177.4	0	0	0	0	108.3
363	E	24.1	Very low	25.9	Very low	165 Å²	165	139.2 Å²	139.2	77%	0.771	81%	0.807	S	S	*	*			trans	-100.2	159.2	174.2	-59.8	179.7	125.5	0	0	111.5
364	N	24.4	Very low	25.8	Very low	146 Å²	146	137.5 Å²	137.5	78%	0.781	80%	0.798	S	S	*	*			trans	71.6	172	164.1	-58.9	-51.6	0	0	0	118.8
365	I	26.5	Very low	25.9	Very low	149 Å²	149	141.6 Å²	141.6	76%	0.764	80%	0.795	S	S	*	*			trans	69.7	77.5	178.5	-45.2	178.8	0	0	0	114
366	T	23	Very low	25.8	Very low	120 Å²	120	138.4 Å²	138.4	74%	0.736	79%	0.792	S	S	*	*				59.9	107.1	75.3	74.4	0	0	0	0	116.9
367	V	26.3	Very low	26	Very low	154 Å²	154	138.6 Å²	138.6	93%	0.933	79%	0.789	S	S	*	*			trans	-131.5	140.5	144.2	179.9	0	0	0	0	107.3
368	S	24.8	Very low	26	Very low	108 Å²	108	142.9 Å²	142.9	76%	0.755	79%	0.793	S	S	*	*			trans	-96.9	164	-158.7	-71.3	0	0	0	0	115.6
369	P	30.6	Very low	26.2	Very low	130 Å²	130	144.7 Å²	144.7	84%	0.844	80%	0.798	S	S	*	*			trans	-113.9	-176.2	-158.3	43.2	-35.2	0	0	0	114.9
370	S	27.3	Very low	25.9	Very low	111 Å²	111	146.8 Å²	146.8	78%	0.776	80%	0.803	S	S	*	*			trans	-143.7	114.6	167	60.5	0	0	0	0	112.7
371	S	27.5	Very low	26	Very low	120 Å²	120	145.6 Å²	145.6	84%	0.839	80%	0.802	S	S	*	*	S	Bend	trans	56.1	141.1	167.8	-75	0	0	0	0	119.3
372	C	26	Very low	26.2	Very low	132 Å²	132	144.9 Å²	144.9	89%	0.892	80%	0.795	S	S	*	*			cis	-117.9	169.4	-0.9	-78.8	0	0	0	0	111.5
373	R	25.1	Very low	26	Very low	228 Å²	228	147.5 Å²	147.5	86%	0.86	79%	0.791	S	S	*	*			trans	-123.5	157.6	-167.5	-146.7	-172.7	-166.7	162.2	1.7	111.4
374	N	28.4	Very low	26	Very low	126 Å²	126	144.1 Å²	144.1	67%	0.674	79%	0.786	S	S	*	*			trans	98.7	145.3	157.6	-57	-3.8	0	0	0	118.3
375	Q	26	Very low	26	Very low	166 Å²	166	143.6 Å²	143.6	78%	0.776	79%	0.788	S	S	*	*			cis	-168.5	130.4	-28.1	-173.4	158.3	-18.9	0	0	110
376	A	25.3	Very low	26.1	Very low	85 Å²	85	145.3 Å²	145.3	70%	0.702	79%	0.793	S	S	*	*			trans	59.4	170.6	172.6	0	0	0	0	0	115.1
377	E	27.5	Very low	26.4	Very low	168 Å²	168	147.4 Å²	147.4	79%	0.785	80%	0.798	S	S	*	*			cis	-136.5	-164.1	-5.4	-159.7	126.5	-127	0	0	111.1
378	R	26	Very low	26.3	Very low	204 Å²	204	145.2 Å²	145.2	77%	0.77	79%	0.789	S	S	*	*			trans	-77.4	139.5	-176.3	-62.9	169.6	171.5	80.9	-3.3	111.7
379	N	26.5	Very low	26.5	Very low	162 Å²	162	146.1 Å²	146.1	87%	0.866	79%	0.79	S	S	*	*				176.6	175.1	122.8	-86	-20.9	0	0	0	111.7
380	D	23	Very low	26.4	Very low	156 Å²	156	145 Å²	145	83%	0.834	78%	0.781	S	S	*	*			trans	-73.5	178.1	-175.7	-86.2	-67.1	0	0	0	115.2
381	V	25.8	Very low	26.4	Very low	129 Å²	129	148 Å²	148	78%	0.782	79%	0.788	S	S	*	*			trans	92.2	155.1	165.5	-164.6	0	0	0	0	116.1
382	M	26.2	Very low	26.4	Very low	147 Å²	147	148.7 Å²	148.7	72%	0.724	78%	0.783	S	S	*	*			trans	73.4	127.8	178.3	-66.6	-54.2	-174.7	0	0	120.3
383	Y	25.2	Very low	26.5	Very low	191 Å²	191	147.3 Å²	147.3	75%	0.749	77%	0.774	S	S	*	*			trans	-147.9	80.2	151	-116.1	-79.7	0	0	0	107.2	R454	Y383-R454 VanDerWaalsContact CD2-NH1 3.32Å; Y383-R454 VanDerWaalsContact CE2-NH1 3.34Å; Y383-R454 VanDerWaalsContact CG-NH2 3.26Å
384	S	23.8	Very low	26.8	Very low	94 Å²	94	141.9 Å²	141.9	66%	0.657	77%	0.771	S	S	*	*			trans	-138	40.2	-168.2	-61.7	0	0	0	0	113.1
385	T	26.3	Very low	27	Very low	136 Å²	136	144.1 Å²	144.1	83%	0.834	78%	0.783	S	S	*	*			trans	-148.7	118.4	176.4	-3.5	0	0	0	0	111.6
386	E	28.5	Very low	27.3	Very low	184 Å²	184	145 Å²	145	86%	0.86	79%	0.785	S	S	*	*			trans	-178.3	85.4	143.9	-106.8	175.3	-142.5	0	0	109
387	I	27.5	Very low	27.4	Very low	164 Å²	164	147.9 Å²	147.9	84%	0.841	79%	0.787	S	S	*	*			trans	-129.9	93.6	158.4	-59.7	-178.6	0	0	0	106.8	V389	I387-V389 HydrophobicContact CG2-CG2 4.43Å
388	S	25.1	Very low	27.5	Very low	108 Å²	108	146.2 Å²	146.2	76%	0.755	79%	0.787	S	S	*	*			trans	-120.4	71.1	176.6	41.3	0	0	0	0	109.1
389	V	29.4	Very low	27.7	Very low	128 Å²	128	143.9 Å²	143.9	78%	0.776	79%	0.785	S	S	*	*			trans	-104.2	116.9	179.3	-177.4	0	0	0	0	110.6	I387 N391	I387-V389 HydrophobicContact CG2-CG2 4.43Å; V389-N391 PolarHBondContact O-N 3.5Å
390	V	27.4	Very low	27.7	Very low	106 Å²	106	142.2 Å²	142.2	64%	0.642	78%	0.776	S	S	*	*			trans	-50.5	124	174.9	177.2	0	0	0	0	112.1	N392	V390-N392 HydrophobicContact CG1-CB 3.97Å
391	N	27.8	Very low	28.1	Very low	174 Å²	174	140.5 Å²	140.5	93%	0.93	77%	0.771	S	S	*	*			trans	-97.3	108.3	156	-99.5	-17.3	0	0	0	108.4	V389	V389-N391 PolarHBondContact O-N 3.5Å
392	N	28.1	Very low	28.3	Very low	135 Å²	135	143.2 Å²	143.2	72%	0.722	77%	0.773	S	S	*	*			trans	-100.3	134.4	-178.5	-118.2	-9.8	0	0	0	111.3	V390	V390-N392 HydrophobicContact CG1-CB 3.97Å
393	S	27.9	Very low	28.6	Very low	103 Å²	103	142.8 Å²	142.8	72%	0.72	77%	0.774	S	S	*	*			trans	49.3	95.9	149.4	-51.2	0	0	0	0	119.4
394	S	31.7	Very low	28.8	Very low	114 Å²	114	140.8 Å²	140.8	80%	0.797	78%	0.776	S	S	*	*			trans	-165.7	90.9	137.2	-84.3	0	0	0	0	113.2
395	N	32.8	Very low	29.2	Very low	172 Å²	172	142.6 Å²	142.6	92%	0.92	78%	0.778	S	S	*	*				-179.9	156.2	120.4	-88.6	-25.5	0	0	0	110.4
396	K	31.9	Very low	29.6	Very low	186 Å²	186	142.1 Å²	142.1	81%	0.809	77%	0.771	S	S	*	*			trans	-152.8	144.8	-162.4	-167.7	-168.3	-178.6	-176.6	0	109.2
397	I	26.3	Very low	29.8	Very low	145 Å²	145	141.2 Å²	141.2	74%	0.744	77%	0.771	S	S	*	*			trans	66	141.8	-180	-20.6	177.3	0	0	0	110.1
398	V	30.7	Very low	30.1	Very low	132 Å²	132	140.9 Å²	140.9	80%	0.8	77%	0.772	S	S	*	*			cis	-130.5	163.5	21.9	-176.4	0	0	0	0	112.4
399	E	29.2	Very low	30.1	Very low	156 Å²	156	141.4 Å²	141.4	73%	0.729	77%	0.77	S	S	*	*			trans	-72.4	164.9	-168.3	-43.9	168.9	118.5	0	0	117.6
400	N	27.4	Very low	29.9	Very low	127 Å²	127	141 Å²	141	68%	0.679	77%	0.768	S	S	*	*				99.4	134.8	129.8	-83.9	-34.6	0	0	0	123.7
401	T	31	Very low	29.7	Very low	119 Å²	119	142.4 Å²	142.4	73%	0.73	78%	0.777	S	S	*	*			trans	64.3	92.3	152.3	41.6	0	0	0	0	121.6
402	K	30.1	Very low	29.8	Very low	186 Å²	186	140 Å²	140	81%	0.809	77%	0.768	S	S	*	*				61.3	134.1	105.9	-86	-172	175.3	179.7	0	121.5
403	N	32.2	Very low	29.6	Very low	139 Å²	139	138.8 Å²	138.8	74%	0.743	77%	0.77	S	S	*	*			trans	87.9	121	144.7	-64.2	6.9	0	0	0	118.8
404	N	28.9	Very low	29.4	Very low	149 Å²	149	139.7 Å²	139.7	80%	0.797	78%	0.777	S	S	*	*			trans	-35.6	142.6	161.3	-39.9	-12.3	0	0	0	113.8
405	N	32.8	Very low	29.3	Very low	132 Å²	132	143 Å²	143	71%	0.706	78%	0.779	S	S	*	*				-167.2	163	106.2	-117.4	38.1	0	0	0	114.1
406	D	36	Very low	29	Very low	126 Å²	126	139.6 Å²	139.6	67%	0.674	77%	0.769	S	S	*	*			trans	59.7	81.9	149.5	-53.7	-29.9	0	0	0	120.7
407	N	32.5	Very low	28.6	Very low	164 Å²	164	140.8 Å²	140.8	88%	0.877	78%	0.775	S	S	*	*				9.7	111.9	124.9	-61.3	-26.8	0	0	0	117.2
408	N	31.9	Very low	28.6	Very low	158 Å²	158	140.5 Å²	140.5	85%	0.845	77%	0.77	S	S	*	*			trans	-144.7	153.3	140.8	-152.1	-11.4	0	0	0	110.9
409	V	25.1	Very low	28.3	Very low	119 Å²	119	139.5 Å²	139.5	72%	0.721	77%	0.769	S	S	*	*			trans	-79.9	128.4	-166.8	178.1	0	0	0	0	111.3
410	T	26.8	Very low	28.1	Very low	120 Å²	120	141.1 Å²	141.1	74%	0.736	77%	0.77	S	S	*	*			trans	-140.7	107.5	161.7	-49.5	0	0	0	0	109.4	V412	T410-V412 HydrophobicContact CG2-CG2 4.01Å; T410-V412 PolarHBondContact O-N 3.27Å
411	T	22.9	Very low	27.9	Very low	135 Å²	135	142.5 Å²	142.5	83%	0.828	77%	0.774	S	S	*	*			trans	-74.1	109.4	172.9	47.5	0	0	0	0	109.6
412	V	28.7	Very low	27.7	Very low	123 Å²	123	144.5 Å²	144.5	75%	0.745	78%	0.779	S	S	*	*			trans	-118	126.4	169.3	-175.9	0	0	0	0	107.7	T410	T410-V412 HydrophobicContact CG2-CG2 4.01Å; T410-V412 PolarHBondContact O-N 3.27Å
413	S	25.1	Very low	27.5	Very low	110 Å²	110	142.3 Å²	142.3	77%	0.769	77%	0.774	S	S	*	*			trans	-63	139.7	-175.8	-57.6	0	0	0	0	111.9	E415	S413-E415 PolarHBondContact O-N 2.71Å
414	S	24	Very low	27.2	Very low	122 Å²	122	139.5 Å²	139.5	85%	0.853	76%	0.764	S	S	*	*			trans	-74.2	92.8	177.9	55	0	0	0	0	111.3
415	E	28.4	Very low	27.1	Very low	182 Å²	182	137 Å²	137	85%	0.85	75%	0.75	S	S	*	*			trans	-67.1	145.2	168.4	-66.5	-169.5	158.3	0	0	110.9	S413	S413-E415 PolarHBondContact O-N 2.71Å
416	S	26.3	Very low	26.9	Very low	101 Å²	101	134.4 Å²	134.4	71%	0.706	74%	0.743	S	S	*	*			trans	-75.6	131.8	-163.1	52.5	0	0	0	0	113.3	Q418	S416-Q418 PolarHBondContact O-N 2.98Å
417	F	24.8	Very low	26.7	Very low	211 Å²	211	138.5 Å²	138.5	93%	0.925	75%	0.749	S	S	*	*			trans	-69.2	79.1	168.2	-80.9	-91	0	0	0	110.8	S419	F417-S419 PolarHBondContact O-N 3.25Å
418	Q	26.7	Very low	26.6	Very low	139 Å²	139	134.6 Å²	134.6	65%	0.65	73%	0.731	S	S	*	*			trans	-63	106.1	164.5	-79.4	-174.2	-22.5	0	0	109.1	S416 Y420	S416-Q418 PolarHBondContact O-N 2.98Å; Q418-Y420 VanDerWaalsContact C-N 3.34Å; Q418-Y420 HydrophobicContact CB-CD2 4.36Å; Q418-Y420 HydrophobicContact CB-CE2 4.23Å; Q418-Y420 WeakPolarHBondContact O-CD2 3.26Å; Q418-Y420 PolarHBondContact O-N 2.74Å
419	S	24.2	Very low	26.4	Very low	111 Å²	111	133.8 Å²	133.8	78%	0.776	72%	0.724	S	S	*	*			trans	-70.1	89.6	177	-170.2	0	0	0	0	110.3	F417 M421	F417-S419 PolarHBondContact O-N 3.25Å; S419-M421 VanDerWaalsContact C-N 3.34Å; S419-M421 PolarHBondContact O-N 2.7Å
420	Y	24.4	Very low	26.5	Very low	191 Å²	191	136.7 Å²	136.7	75%	0.749	73%	0.727	S	S	*	*			trans	-64.9	92.5	172.3	-87.5	-94.1	0	0	0	109.8	Q418 I422	Q418-Y420 VanDerWaalsContact C-N 3.34Å; Q418-Y420 HydrophobicContact CB-CD2 4.36Å; Q418-Y420 HydrophobicContact CB-CE2 4.23Å; Q418-Y420 WeakPolarHBondContact O-CD2 3.26Å; Q418-Y420 PolarHBondContact O-N 2.74Å; Y420-I422 PolarHBondContact O-N 3.29Å
421	M	23	Very low	26.4	Very low	156 Å²	156	135.2 Å²	135.2	77%	0.768	72%	0.721	S	S	*	*			trans	-61.5	97.1	165.5	-84.4	-75.7	-73.7	0	0	109.4	S419 I423	S419-M421 VanDerWaalsContact C-N 3.34Å; S419-M421 PolarHBondContact O-N 2.7Å; M421-I423 VanDerWaalsContact C-N 3.31Å; M421-I423 PolarHBondContact O-N 2.78Å
422	I	27.2	Very low	26.6	Very low	160 Å²	160	134.9 Å²	134.9	82%	0.821	72%	0.719	S	S	*	*			trans	-69.9	90	172.5	-57.3	176.8	0	0	0	107.8	Y420 P424	Y420-I422 PolarHBondContact O-N 3.29Å; I422-P424 WeakPolarHBondContact O-CD 3.2Å
423	I	26.3	Very low	26.7	Very low	140 Å²	140	135.4 Å²	135.4	72%	0.718	72%	0.722	S	S	*	*	P	Polyproline II helix	trans	-69.6	119.1	175.8	-60	175.1	0	0	0	107.9	M421	M421-I423 VanDerWaalsContact C-N 3.31Å; M421-I423 PolarHBondContact O-N 2.78Å
424	P	25.5	Very low	26.9	Very low	81 Å²	81	134.4 Å²	134.4	53%	0.526	71%	0.714	S	S	.	*	P	Polyproline II helix	trans	-67.2	142.5	-177.1	26.8	-34.3	0	0	0	111.5	I422 S426	I422-P424 WeakPolarHBondContact O-CD 3.2Å; P424-S426 PolarHBondContact O-N 3.31Å
425	D	25.7	Very low	27.5	Very low	95 Å²	95	132.8 Å²	132.8	51%	0.508	71%	0.708	S	S	.	*	P	Polyproline II helix	trans	-59.8	136.4	-175	-179.3	23.3	0	0	0	112.2	R427 T428	D425-R427 PolarHBondContact O-N 3.26Å; D425-T428 PolarHBondContact O-N 3.42Å; D425-T428 PolarHBondContact O-OG1 3.08Å
426	S	29.1	Very low	28.2	Very low	78 Å²	78	133 Å²	133	55%	0.545	71%	0.705	S	S	.	*	T	Hydrogen-bonded Turn	trans	-45.2	-18.8	179.6	61.1	0	0	0	0	116.3	P424	P424-S426 PolarHBondContact O-N 3.31Å
427	R	31.4	Very low	29	Very low	213 Å²	213	136.4 Å²	136.4	80%	0.804	71%	0.71	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.5	-20.2	178.4	-64.8	-177.9	173	-155.2	-2.3	114.4	D425	D425-R427 PolarHBondContact O-N 3.26Å
428	T	31.1	Very low	30.3	Very low	82 Å²	82	132.9 Å²	132.9	50%	0.503	70%	0.701	S	S	.	*	S	Bend	trans	-91.3	-20.4	-172.1	56.8	0	0	0	0	114.9	D425 F430	D425-T428 PolarHBondContact O-N 3.42Å; D425-T428 PolarHBondContact O-OG1 3.08Å; T428-F430 PolarHBondContact O-N 2.91Å; T428-F430 VanDerWaalsContact O-N 3.11Å
429	M	27.1	Very low	31.8	Very low	141 Å²	141	132.8 Å²	132.8	70%	0.695	69%	0.694	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.4	7.2	-176.8	-75.3	-83.1	103.6	0	0	115.3
430	F	27.1	Very low	34.1	Very low	179 Å²	179	135.3 Å²	135.3	79%	0.785	69%	0.691	S	S	*	*	T	Hydrogen-bonded Turn	trans	-131.9	34.9	-178.9	-81.9	-78.6	0	0	0	113.9	T428	T428-F430 PolarHBondContact O-N 2.91Å; T428-F430 VanDerWaalsContact O-N 3.11Å
431	S	25.9	Very low	36.7	Very low	89 Å²	89	129.3 Å²	129.3	62%	0.622	67%	0.668	S	S	*	*	S	Bend	trans	-155.3	134.9	167.2	-155.7	0	0	0	0	107.7
432	T	27	Very low	39.5	Very low	128 Å²	128	127.7 Å²	127.7	79%	0.785	66%	0.658	S	S	*	*	S	Bend	cis	-154	84.5	3	-6.6	0	0	0	0	110.5
433	V	30.5	Very low	42.1	Very low	134 Å²	134	120.7 Å²	120.7	81%	0.812	62%	0.623	S	S	*	*			trans	-144.5	134.1	164.1	-175.9	0	0	0	0	108.8	A435	V433-A435 PolarHBondContact O-N 2.78Å
434	P	29.3	Very low	44.6	Very low	90 Å²	90	119.4 Å²	119.4	58%	0.584	62%	0.622	S	S	*	*			trans	-71.3	118.5	177.9	-16.5	31	0	0	0	112	K436	P434-K436 PolarHBondContact O-N 3.42Å
435	A	35.8	Very low	46.8	Very low	88 Å²	88	121.3 Å²	121.3	73%	0.727	62%	0.619	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.1	20.7	171.8	0	0	0	0	0	114.4	V433	V433-A435 PolarHBondContact O-N 2.78Å
436	K	43.3	Very low	48.6	Very low	185 Å²	185	122.1 Å²	122.1	80%	0.804	63%	0.63	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.7	-28.9	175.6	-75	-170.9	172.4	-174.6	0	112.8	P434	P434-K436 PolarHBondContact O-N 3.42Å
437	E	42.6	Very low	50.4	Low	173 Å²	173	121.4 Å²	121.4	81%	0.808	64%	0.635	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.1	-22.2	-171	-60.2	-156	143.3	0	0	115.1	R439	E437-R439 PolarHBondContact O-N 2.93Å
438	L	52.4	Low	52.2	Low	138 Å²	138	112 Å²	112	72%	0.723	60%	0.602	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.5	-3.4	-177.6	-73.1	169.3	0	0	0	114.7	K440 T453	L438-K440 VanDerWaalsContact C-N 3.33Å; L438-K440 PolarHBondContact O-N 3.35Å; L438-K440 VanDerWaalsContact O-N 3.14Å; L438-T453 HydrophobicContact CB-CG2 4.48Å; L438-T453 WeakPolarHBondContact O-CG2 3.5Å
439	R	59.3	Low	54.3	Low	137 Å²	137	117.2 Å²	117.2	52%	0.517	62%	0.62	S	S	.	*			trans	-89.9	60.8	-176.7	-65.8	-171.8	-179.8	-134.9	9.8	112.8	E437 Y441 S451 Y452 T453	E437-R439 PolarHBondContact O-N 2.93Å; R439-Y441 PolarHBondContact O-N 2.84Å; R439-S451 WeakPolarHBondContact CD-O 3.43Å; R439-S451 VanDerWaalsContact CD-OG 3.26Å; R439-S451 WeakPolarHBondContact CD-OG 3.46Å; R439-S451 PolarHBondContact NH1-O 2.84Å; R439-Y452 CarbonylContact C-O 3.5Å; R439-Y452 VanDerWaalsContact CA-O 3.29Å; R439-Y452 WeakPolarHBondContact CA-O 3.12Å; R439-T453 HydrophobicContact CG-CG2 4.37Å
440	K	72.2	Confident	56.7	Low	164 Å²	164	115.5 Å²	115.5	71%	0.713	61%	0.609	S	S	*	*			trans	-55.8	-20.4	-175.7	-172.2	169.1	-176.6	172.7	0	115.5	L438 Y452	L438-K440 VanDerWaalsContact C-N 3.33Å; L438-K440 PolarHBondContact O-N 3.35Å; L438-K440 VanDerWaalsContact O-N 3.14Å; K440-Y452 PolarHBondContact N-O 3.25Å
441	Y	79.6	Confident	59.1	Low	65 Å²	65	108.6 Å²	108.6	26%	0.255	58%	0.583	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-117.7	97.6	-172.5	-60.6	-79	0	0	0	111.5	R439 S451 Y452 R454 R455 L458	R439-Y441 PolarHBondContact O-N 2.84Å; Y441-S451 CarbonylContact O-C 3.49Å; Y441-S451 WeakPolarHBondContact O-CA 3.36Å; Y441-Y452 PolarHBondContact N-O 2.89Å; Y441-Y452 PolarHBondContact O-N 3.37Å; Y441-R454 VanDerWaalsContact CD2-C 3.47Å; Y441-R455 HydrophobicContact CD1-CB 3.95Å; Y441-R455 HydrophobicContact CD1-CG 4.2Å; Y441-R455 HydrophobicContact CE1-CB 3.65Å; Y441-R455 HydrophobicContact CE1-CG 4.04Å; Y441-R455 HydrophobicContact CE2-CB 4.28Å; Y441-R455 HydrophobicContact CG-CB 4.38Å; Y441-L458 HydrophobicContact CD1-CD2 4.4Å
442	H	80.6	Confident	61.8	Low	122 Å²	122	106.8 Å²	106.8	57%	0.565	56%	0.563	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-85	152.7	174.9	55.6	-96.9	0	0	0	111.9	L458	H442-L458 VanDerWaalsContact O-CD1 3.28Å; H442-L458 WeakPolarHBondContact O-CD1 3.27Å; H442-L458 WeakPolarHBondContact O-CD2 3.5Å
443	C	81.7	Confident	63.9	Low	13 Å²	13	104 Å²	104	9%	0.088	55%	0.546	C	S	.	.			trans	-71.2	142.4	164.9	-160.7	0	0	0	0	110.6	C448 K450 L458 H461 H465	C443-C448 HydrophobicContact CB-CB 4.34Å; C443-K450 WeakPolarHBondContact CB-O 3.44Å; C443-K450 PolarHBondContact N-O 3.36Å; C443-L458 HydrophobicContact CB-CD1 4.3Å; C443-H461 PolarHBondContact SG-NE2 3.47Å; C443-H465 VanDerWaalsContact SG-CD2 3.56Å
444	T	78.7	Confident	65.8	Low	112 Å²	112	103.1 Å²	103.1	69%	0.687	53%	0.528	S	S	*	.			trans	-104.4	6.6	177	56.7	0	0	0	0	112.3
445	Y	73.1	Confident	67.7	Low	121 Å²	121	106.3 Å²	106.3	48%	0.475	53%	0.528	S	S	.	.	S	Bend	trans	-82.1	134.2	178.5	-156.4	-89.6	0	0	0	110.3	G447 C448 H465	Y445-G447 PolarHBondContact O-N 2.82Å; Y445-C448 WeakPolarHBondContact O-CB 3.37Å; Y445-C448 PolarHBondContact O-N 3.39Å; Y445-C448 VanDerWaalsContact O-N 3.14Å; Y445-H465 AromaticContact CD1-CE1 3.14Å; Y445-H465 WeakPolarHBondContact CD1-CE1 3.24Å; Y445-H465 AromaticContact CD1-CG 3.97Å; Y445-H465 AromaticContact CD1-ND1 3.33Å; Y445-H465 VanDerWaalsContact CD1-ND1 3.33Å; Y445-H465 WeakPolarHBondContact CD1-ND1 3.07Å; Y445-H465 AromaticContact CD1-NE2 3.57Å; Y445-H465 HydrophobicContact CD2-CB 3.59Å; Y445-H465 AromaticContact CD2-CE1 3.92Å; Y445-H465 AromaticContact CD2-CG 3.7Å; Y445-H465 AromaticContact CD2-ND1 3.91Å; Y445-H465 AromaticContact CE1-CE1 3.13Å; Y445-H465 WeakPolarHBondContact CE1-CE1 3.39Å; Y445-H465 AromaticContact CE1-ND1 3.69Å; Y445-H465 HydrophobicContact CE2-CB 3.77Å; Y445-H465 AromaticContact CE2-CE1 3.9Å; Y445-H465 HydrophobicContact CG-CB 4.01Å; Y445-H465 AromaticContact CG-CD2 3.89Å; Y445-H465 AromaticContact CG-CE1 3.54Å; Y445-H465 AromaticContact CG-CG 3.56Å; Y445-H465 AromaticContact CG-ND1 3.43Å; Y445-H465 AromaticContact CZ-CE1 3.52Å
446	P	62.3	Low	69.4	Low	112 Å²	112	108.8 Å²	108.8	73%	0.727	52%	0.523	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.6	138	179.7	-28.7	36.1	0	0	0	113.1	C448	P446-C448 PolarHBondContact O-N 3.44Å
447	G	67.7	Low	70.8	Confident	63 Å²	63	103.7 Å²	103.7	65%	0.649	50%	0.502	S	S	*	.	T	Hydrogen-bonded Turn	trans	71.9	1.4	-179.2	0	0	0	0	0	116.2	Y445	Y445-G447 PolarHBondContact O-N 2.82Å
448	C	68.5	Low	72.6	Confident	16 Å²	16	96.1 Å²	96.1	11%	0.108	47%	0.467	C	S	.	.			trans	-108.8	92.5	-174.7	-159	0	0	0	0	114.1	C443 Y445 P446 K450 H461 H465	C443-C448 HydrophobicContact CB-CB 4.34Å; Y445-C448 WeakPolarHBondContact O-CB 3.37Å; Y445-C448 PolarHBondContact O-N 3.39Å; Y445-C448 VanDerWaalsContact O-N 3.14Å; P446-C448 PolarHBondContact O-N 3.44Å; C448-K450 PolarHBondContact O-N 3.49Å; C448-H461 PolarHBondContact SG-CE1 2.94Å; C448-H461 PolarHBondContact SG-NE2 3.16Å; C448-H465 WeakPolarHBondContact CB-NE2 3.47Å; C448-H465 PolarHBondContact SG-NE2 3.35Å
449	E	75.4	Confident	73.5	Confident	192 Å²	192	93.1 Å²	93.1	90%	0.897	45%	0.452	S	S	*	.			trans	-72.7	11.8	-179.6	-55.5	-172.1	158.5	0	0	115.4	S451	E449-S451 PolarHBondContact O-N 3.4Å
450	K	76.5	Confident	73.9	Confident	105 Å²	105	90.4 Å²	90.4	46%	0.457	44%	0.444	S	S	.	.			trans	-74.9	124.5	-174.1	-62.9	-177.8	-161	158.6	0	111.3	C443 C448 Y452	C443-K450 WeakPolarHBondContact CB-O 3.44Å; C443-K450 PolarHBondContact N-O 3.36Å; C448-K450 PolarHBondContact O-N 3.49Å; K450-Y452 HydrophobicContact CB-CE2 3.72Å
451	S	78.2	Confident	74.1	Confident	33 Å²	33	82.9 Å²	82.9	23%	0.231	41%	0.412	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	149.7	179.9	54.7	0	0	0	0	112.4	R439 Y441 E449	R439-S451 WeakPolarHBondContact CD-O 3.43Å; R439-S451 VanDerWaalsContact CD-OG 3.26Å; R439-S451 WeakPolarHBondContact CD-OG 3.46Å; R439-S451 PolarHBondContact NH1-O 2.84Å; Y441-S451 CarbonylContact O-C 3.49Å; Y441-S451 WeakPolarHBondContact O-CA 3.36Å; E449-S451 PolarHBondContact O-N 3.4Å
452	Y	82	Confident	73.6	Confident	52 Å²	52	82 Å²	82	20%	0.204	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	155.2	-161.6	-64.1	-84.8	0	0	0	112.6	R439 K440 Y441 K450 Q457 L458 H461	R439-Y452 CarbonylContact C-O 3.5Å; R439-Y452 VanDerWaalsContact CA-O 3.29Å; R439-Y452 WeakPolarHBondContact CA-O 3.12Å; K440-Y452 PolarHBondContact N-O 3.25Å; Y441-Y452 PolarHBondContact N-O 2.89Å; Y441-Y452 PolarHBondContact O-N 3.37Å; K450-Y452 HydrophobicContact CB-CE2 3.72Å; Y452-Q457 HydrophobicContact CD1-CB 3.51Å; Y452-Q457 HydrophobicContact CE1-CB 4.31Å; Y452-Q457 HydrophobicContact CG-CB 3.92Å; Y452-L458 HydrophobicContact CD2-CB 4.28Å; Y452-L458 HydrophobicContact CD2-CD1 4.31Å; Y452-H461 HydrophobicContact CE1-CB 4.46Å; Y452-H461 HydrophobicContact CE2-CB 3.68Å; Y452-H461 AromaticContact CE2-CD2 3.45Å; Y452-H461 VanDerWaalsContact CE2-CD2 3.45Å; Y452-H461 WeakPolarHBondContact CE2-CD2 3.23Å; Y452-H461 AromaticContact CE2-CG 3.7Å; Y452-H461 AromaticContact CZ-CD2 3.95Å; Y452-H461 AromaticContact CZ-CG 3.76Å; Y452-H461 WeakPolarHBondContact OH-CB 3.43Å; Y452-H461 VanDerWaalsContact OH-CG 3.24Å
453	T	71.8	Confident	73.1	Confident	70 Å²	70	79.9 Å²	79.9	43%	0.429	40%	0.403	S	S	.	.	S	Bend	trans	-87.8	-23.9	-178.8	62.3	0	0	0	0	113	L438 R439 Q457	L438-T453 HydrophobicContact CB-CG2 4.48Å; L438-T453 WeakPolarHBondContact O-CG2 3.5Å; R439-T453 HydrophobicContact CG-CG2 4.37Å; T453-Q457 PolarHBondContact OG1-OE1 3.48Å
454	R	69.7	Low	72.4	Confident	115 Å²	115	82 Å²	82	43%	0.434	42%	0.417	S	S	.	.	S	Bend	trans	-126.7	141.2	179	-61.7	-172.9	-179.8	-152.2	-4.2	112	Y383 Y441 F456 Q457 L458	Y383-R454 VanDerWaalsContact CD2-NH1 3.32Å; Y383-R454 VanDerWaalsContact CE2-NH1 3.34Å; Y383-R454 VanDerWaalsContact CG-NH2 3.26Å; Y441-R454 VanDerWaalsContact CD2-C 3.47Å; R454-F456 PolarHBondContact O-N 3.27Å; R454-Q457 HydrophobicContact CB-CG 4.34Å; R454-Q457 WeakPolarHBondContact O-CB 3.36Å; R454-Q457 PolarHBondContact O-N 2.97Å; R454-L458 PolarHBondContact O-N 3.33Å
455	R	70	Confident	71.9	Confident	156 Å²	156	79.7 Å²	79.7	59%	0.589	40%	0.397	S	S	*	.	H	α-helix	trans	-55.5	-35.7	178.5	-168.1	171.3	173.2	89	-7.4	112.9	Y441 Q457 L458 N459	Y441-R455 HydrophobicContact CD1-CB 3.95Å; Y441-R455 HydrophobicContact CD1-CG 4.2Å; Y441-R455 HydrophobicContact CE1-CB 3.65Å; Y441-R455 HydrophobicContact CE1-CG 4.04Å; Y441-R455 HydrophobicContact CE2-CB 4.28Å; Y441-R455 HydrophobicContact CG-CB 4.38Å; R455-Q457 VanDerWaalsContact C-N 3.32Å; R455-Q457 PolarHBondContact O-N 3.31Å; R455-L458 PolarHBondContact O-N 3.23Å; R455-N459 PolarHBondContact O-N 3.48Å; R455-N459 PolarHBondContact O-OD1 3.38Å
456	F	70.7	Confident	71.3	Confident	141 Å²	141	79.5 Å²	79.5	62%	0.618	40%	0.404	S	S	*	.	H	α-helix	trans	-57.5	-40.8	173.7	173.9	-98.3	0	0	0	113.3	R454 N459 Q460	R454-F456 PolarHBondContact O-N 3.27Å; F456-N459 PolarHBondContact O-N 3.25Å; F456-Q460 HydrophobicContact CD1-CG 4.19Å; F456-Q460 HydrophobicContact CE1-CG 3.75Å; F456-Q460 HydrophobicContact CE2-CG 4.11Å; F456-Q460 HydrophobicContact CZ-CG 3.71Å; F456-Q460 WeakPolarHBondContact O-CB 3.35Å; F456-Q460 VanDerWaalsContact O-CG 3.31Å; F456-Q460 WeakPolarHBondContact O-CG 3.46Å; F456-Q460 PolarHBondContact O-N 3.47Å
457	Q	74.1	Confident	70.6	Confident	78 Å²	78	77.9 Å²	77.9	36%	0.364	39%	0.388	S	S	.	.	H	α-helix	trans	-70.2	-37	178.4	-61.6	172.7	-21.5	0	0	111.4	Y452 T453 R454 R455 H461	Y452-Q457 HydrophobicContact CD1-CB 3.51Å; Y452-Q457 HydrophobicContact CE1-CB 4.31Å; Y452-Q457 HydrophobicContact CG-CB 3.92Å; T453-Q457 PolarHBondContact OG1-OE1 3.48Å; R454-Q457 HydrophobicContact CB-CG 4.34Å; R454-Q457 WeakPolarHBondContact O-CB 3.36Å; R454-Q457 PolarHBondContact O-N 2.97Å; R455-Q457 VanDerWaalsContact C-N 3.32Å; R455-Q457 PolarHBondContact O-N 3.31Å; Q457-H461 WeakPolarHBondContact O-CB 3.39Å; Q457-H461 PolarHBondContact O-N 3.25Å
458	L	78.9	Confident	69.6	Low	13 Å²	13	81.8 Å²	81.8	7%	0.068	40%	0.4	C	S	.	.	H	α-helix	trans	-62.9	-45.4	170.4	173.2	61.8	0	0	0	110.8	Y441 H442 C443 Y452 R454 R455 Q460 H461 I462	Y441-L458 HydrophobicContact CD1-CD2 4.4Å; H442-L458 VanDerWaalsContact O-CD1 3.28Å; H442-L458 WeakPolarHBondContact O-CD1 3.27Å; H442-L458 WeakPolarHBondContact O-CD2 3.5Å; C443-L458 HydrophobicContact CB-CD1 4.3Å; Y452-L458 HydrophobicContact CD2-CB 4.28Å; Y452-L458 HydrophobicContact CD2-CD1 4.31Å; R454-L458 PolarHBondContact O-N 3.33Å; R455-L458 PolarHBondContact O-N 3.23Å; L458-Q460 PolarHBondContact O-N 3.22Å; L458-H461 CarbonylContact O-C 3.29Å; L458-H461 WeakPolarHBondContact O-CA 3.38Å; L458-H461 WeakPolarHBondContact O-CB 3.34Å; L458-H461 PolarHBondContact O-N 3.5Å; L458-H461 VanDerWaalsContact O-N 3.08Å; L458-I462 HydrophobicContact CD1-CD1 3.81Å; L458-I462 HydrophobicContact CD1-CG1 3.9Å; L458-I462 HydrophobicContact CD2-CD1 4.22Å; L458-I462 HydrophobicContact CG-CD1 3.71Å; L458-I462 HydrophobicContact CG-CG1 4.23Å; L458-I462 WeakPolarHBondContact O-CG1 3.5Å; L458-I462 PolarHBondContact O-N 3.25Å
459	N	72.4	Confident	68.7	Low	76 Å²	76	83 Å²	83	41%	0.406	42%	0.415	S	S	.	.	H	α-helix	trans	-61.4	-46.5	177.9	-69.8	11.8	0	0	0	111.5	R455 F456 H461 I462 L463	R455-N459 PolarHBondContact O-N 3.48Å; R455-N459 PolarHBondContact O-OD1 3.38Å; F456-N459 PolarHBondContact O-N 3.25Å; N459-H461 PolarHBondContact O-N 3.01Å; N459-I462 PolarHBondContact O-N 2.95Å; N459-I462 VanDerWaalsContact O-N 3.14Å; N459-L463 WeakPolarHBondContact O-CG 3.27Å; N459-L463 PolarHBondContact O-N 3.33Å
460	Q	68.6	Low	67.9	Low	79 Å²	79	75.1 Å²	75.1	37%	0.369	38%	0.38	S	S	.	.	H	α-helix	trans	-55.5	-35.9	172.3	-76.7	-80.3	-25.7	0	0	112.3	F456 L458	F456-Q460 HydrophobicContact CD1-CG 4.19Å; F456-Q460 HydrophobicContact CE1-CG 3.75Å; F456-Q460 HydrophobicContact CE2-CG 4.11Å; F456-Q460 HydrophobicContact CZ-CG 3.71Å; F456-Q460 WeakPolarHBondContact O-CB 3.35Å; F456-Q460 VanDerWaalsContact O-CG 3.31Å; F456-Q460 WeakPolarHBondContact O-CG 3.46Å; F456-Q460 PolarHBondContact O-N 3.47Å; L458-Q460 PolarHBondContact O-N 3.22Å
461	H	74.6	Confident	67.3	Low	7 Å²	7	73.2 Å²	73.2	3%	0.032	37%	0.374	C	S	.	.	H	α-helix	trans	-77.5	-38.1	174.5	173.8	38.7	0	0	0	113.4	C443 C448 Y452 Q457 L458 N459 L463 T464 H465	C443-H461 PolarHBondContact SG-NE2 3.47Å; C448-H461 PolarHBondContact SG-CE1 2.94Å; C448-H461 PolarHBondContact SG-NE2 3.16Å; Y452-H461 HydrophobicContact CE1-CB 4.46Å; Y452-H461 HydrophobicContact CE2-CB 3.68Å; Y452-H461 AromaticContact CE2-CD2 3.45Å; Y452-H461 VanDerWaalsContact CE2-CD2 3.45Å; Y452-H461 WeakPolarHBondContact CE2-CD2 3.23Å; Y452-H461 AromaticContact CE2-CG 3.7Å; Y452-H461 AromaticContact CZ-CD2 3.95Å; Y452-H461 AromaticContact CZ-CG 3.76Å; Y452-H461 WeakPolarHBondContact OH-CB 3.43Å; Y452-H461 VanDerWaalsContact OH-CG 3.24Å; Q457-H461 WeakPolarHBondContact O-CB 3.39Å; Q457-H461 PolarHBondContact O-N 3.25Å; L458-H461 CarbonylContact O-C 3.29Å; L458-H461 WeakPolarHBondContact O-CA 3.38Å; L458-H461 WeakPolarHBondContact O-CB 3.34Å; L458-H461 PolarHBondContact O-N 3.5Å; L458-H461 VanDerWaalsContact O-N 3.08Å; N459-H461 PolarHBondContact O-N 3.01Å; H461-L463 PolarHBondContact O-N 3.44Å; H461-T464 PolarHBondContact ND1-OG1 3.24Å; H461-T464 WeakPolarHBondContact O-CA 3.19Å; H461-T464 WeakPolarHBondContact O-CB 3.41Å; H461-T464 PolarHBondContact O-N 3.19Å; H461-T464 PolarHBondContact O-OG1 3.22Å; H461-H465 AromaticContact CE1-CD2 3.46Å; H461-H465 PolarHBondContact CE1-CD2 3.18Å; H461-H465 VanDerWaalsContact CE1-CD2 3.46Å; H461-H465 AromaticContact NE2-CD2 3.67Å
462	I	70.8	Confident	66.8	Low	46 Å²	46	75 Å²	75	24%	0.236	39%	0.387	C	S	.	.	H	α-helix	trans	-60.9	-33	173.3	-72.7	171.6	0	0	0	110.1	L458 N459 T464 H465 I466	L458-I462 HydrophobicContact CD1-CD1 3.81Å; L458-I462 HydrophobicContact CD1-CG1 3.9Å; L458-I462 HydrophobicContact CD2-CD1 4.22Å; L458-I462 HydrophobicContact CG-CD1 3.71Å; L458-I462 HydrophobicContact CG-CG1 4.23Å; L458-I462 WeakPolarHBondContact O-CG1 3.5Å; L458-I462 PolarHBondContact O-N 3.25Å; N459-I462 PolarHBondContact O-N 2.95Å; N459-I462 VanDerWaalsContact O-N 3.14Å; I462-T464 VanDerWaalsContact C-N 3.26Å; I462-T464 PolarHBondContact O-N 3.42Å; I462-H465 CarbonylContact O-C 3.54Å; I462-H465 WeakPolarHBondContact O-CA 3.3Å; I462-H465 WeakPolarHBondContact O-CB 3.46Å; I462-H465 PolarHBondContact O-N 3.43Å; I462-I466 HydrophobicContact CG2-CD1 3.44Å; I462-I466 VanDerWaalsContact CG2-CD1 3.44Å; I462-I466 HydrophobicContact CG2-CG1 3.93Å; I462-I466 WeakPolarHBondContact O-CG1 3.41Å; I462-I466 PolarHBondContact O-N 2.82Å
463	L	69.5	Low	66.5	Low	77 Å²	77	73 Å²	73	40%	0.403	38%	0.38	S	S	.	.	H	α-helix	trans	-60.5	-31	169	-68.4	176.9	0	0	0	113	N459 H461 H465 I466 I467	N459-L463 WeakPolarHBondContact O-CG 3.27Å; N459-L463 PolarHBondContact O-N 3.33Å; H461-L463 PolarHBondContact O-N 3.44Å; L463-H465 PolarHBondContact O-N 2.89Å; L463-I466 PolarHBondContact O-N 2.85Å; L463-I467 HydrophobicContact CB-CD1 3.86Å; L463-I467 HydrophobicContact CB-CG1 4.21Å; L463-I467 HydrophobicContact CD2-CD1 4.18Å; L463-I467 HydrophobicContact CD2-CG1 4.22Å; L463-I467 HydrophobicContact CG-CD1 4.42Å; L463-I467 VanDerWaalsContact O-CB 3.22Å; L463-I467 WeakPolarHBondContact O-CB 3.37Å; L463-I467 VanDerWaalsContact O-CG1 3.25Å; L463-I467 WeakPolarHBondContact O-CG1 3.43Å; L463-I467 PolarHBondContact O-N 3.36Å
464	T	65.9	Low	66.7	Low	59 Å²	59	75.3 Å²	75.3	36%	0.362	39%	0.39	S	S	.	.	H	α-helix	trans	-71.8	-5	171.4	67.9	0	0	0	0	114.3	H461 I462 F483	H461-T464 PolarHBondContact ND1-OG1 3.24Å; H461-T464 WeakPolarHBondContact O-CA 3.19Å; H461-T464 WeakPolarHBondContact O-CB 3.41Å; H461-T464 PolarHBondContact O-N 3.19Å; H461-T464 PolarHBondContact O-OG1 3.22Å; I462-T464 VanDerWaalsContact C-N 3.26Å; I462-T464 PolarHBondContact O-N 3.42Å; T464-F483 HydrophobicContact CG2-CB 4.46Å
465	H	70	Confident	66.9	Low	62 Å²	62	70.8 Å²	70.8	29%	0.287	38%	0.377	S	S	.	.	H	α-helix	trans	-108.4	-31.9	170.6	-69	-65.6	0	0	0	113.4	C443 Y445 C448 H461 I462 L463	C443-H465 VanDerWaalsContact SG-CD2 3.56Å; Y445-H465 AromaticContact CD1-CE1 3.14Å; Y445-H465 WeakPolarHBondContact CD1-CE1 3.24Å; Y445-H465 AromaticContact CD1-CG 3.97Å; Y445-H465 AromaticContact CD1-ND1 3.33Å; Y445-H465 VanDerWaalsContact CD1-ND1 3.33Å; Y445-H465 WeakPolarHBondContact CD1-ND1 3.07Å; Y445-H465 AromaticContact CD1-NE2 3.57Å; Y445-H465 HydrophobicContact CD2-CB 3.59Å; Y445-H465 AromaticContact CD2-CE1 3.92Å; Y445-H465 AromaticContact CD2-CG 3.7Å; Y445-H465 AromaticContact CD2-ND1 3.91Å; Y445-H465 AromaticContact CE1-CE1 3.13Å; Y445-H465 WeakPolarHBondContact CE1-CE1 3.39Å; Y445-H465 AromaticContact CE1-ND1 3.69Å; Y445-H465 HydrophobicContact CE2-CB 3.77Å; Y445-H465 AromaticContact CE2-CE1 3.9Å; Y445-H465 HydrophobicContact CG-CB 4.01Å; Y445-H465 AromaticContact CG-CD2 3.89Å; Y445-H465 AromaticContact CG-CE1 3.54Å; Y445-H465 AromaticContact CG-CG 3.56Å; Y445-H465 AromaticContact CG-ND1 3.43Å; Y445-H465 AromaticContact CZ-CE1 3.52Å; C448-H465 WeakPolarHBondContact CB-NE2 3.47Å; C448-H465 PolarHBondContact SG-NE2 3.35Å; H461-H465 AromaticContact CE1-CD2 3.46Å; H461-H465 PolarHBondContact CE1-CD2 3.18Å; H461-H465 VanDerWaalsContact CE1-CD2 3.46Å; H461-H465 AromaticContact NE2-CD2 3.67Å; I462-H465 CarbonylContact O-C 3.54Å; I462-H465 WeakPolarHBondContact O-CA 3.3Å; I462-H465 WeakPolarHBondContact O-CB 3.46Å; I462-H465 PolarHBondContact O-N 3.43Å; L463-H465 PolarHBondContact O-N 2.89Å
466	I	59.8	Low	66.5	Low	118 Å²	118	69 Å²	69	61%	0.605	39%	0.385	S	S	*	.	H	α-helix	trans	-86.9	-34.7	-178.6	-65.3	-177.5	0	0	0	111.9	I462 L463 T468	I462-I466 HydrophobicContact CG2-CD1 3.44Å; I462-I466 VanDerWaalsContact CG2-CD1 3.44Å; I462-I466 HydrophobicContact CG2-CG1 3.93Å; I462-I466 WeakPolarHBondContact O-CG1 3.41Å; I462-I466 PolarHBondContact O-N 2.82Å; L463-I466 PolarHBondContact O-N 2.85Å; I466-T468 PolarHBondContact O-N 3.22Å
467	I	47	Very low	66	Low	78 Å²	78	70.5 Å²	70.5	40%	0.4	40%	0.4	S	S	.	.	S	Bend	trans	-76.8	108.8	-179.3	-59.7	177.1	0	0	0	109.4	L463 G469	L463-I467 HydrophobicContact CB-CD1 3.86Å; L463-I467 HydrophobicContact CB-CG1 4.21Å; L463-I467 HydrophobicContact CD2-CD1 4.18Å; L463-I467 HydrophobicContact CD2-CG1 4.22Å; L463-I467 HydrophobicContact CG-CD1 4.42Å; L463-I467 VanDerWaalsContact O-CB 3.22Å; L463-I467 WeakPolarHBondContact O-CB 3.37Å; L463-I467 VanDerWaalsContact O-CG1 3.25Å; L463-I467 WeakPolarHBondContact O-CG1 3.43Å; L463-I467 PolarHBondContact O-N 3.36Å; I467-G469 VanDerWaalsContact C-N 3.3Å; I467-G469 WeakPolarHBondContact CG2-O 3.38Å; I467-G469 PolarHBondContact O-N 3.11Å
468	T	47.8	Very low	65.7	Low	145 Å²	145	67.8 Å²	67.8	89%	0.89	39%	0.39	S	S	*	.	S	Bend	trans	-68.5	82.9	171.3	51.6	0	0	0	0	111.2	I466	I466-T468 PolarHBondContact O-N 3.22Å
469	G	50	Low	65.1	Low	41 Å²	41	72.6 Å²	72.6	42%	0.423	42%	0.424	S	S	.	.	S	Bend	trans	103.6	138.4	171.3	0	0	0	0	0	114.3	I467	I467-G469 VanDerWaalsContact C-N 3.3Å; I467-G469 WeakPolarHBondContact CG2-O 3.38Å; I467-G469 PolarHBondContact O-N 3.11Å
470	P	56.9	Low	64.7	Low	26 Å²	26	73.4 Å²	73.4	17%	0.169	43%	0.427	C	S	.	.			trans	-68.1	142.7	176.3	25.1	-31.5	0	0	0	112.4	S472 K481 Y482 F483	P470-S472 PolarHBondContact O-N 3.25Å; P470-K481 HydrophobicContact CB-CB 3.7Å; P470-K481 HydrophobicContact CG-CB 3.56Å; P470-K481 HydrophobicContact CG-CD 3.7Å; P470-K481 HydrophobicContact CG-CG 4.31Å; P470-Y482 CarbonylContact C-O 3.57Å; P470-F483 HydrophobicContact CB-CD1 3.85Å; P470-F483 HydrophobicContact CB-CD2 4.06Å; P470-F483 HydrophobicContact CB-CE1 3.7Å; P470-F483 HydrophobicContact CB-CE2 3.9Å; P470-F483 HydrophobicContact CB-CG 4.03Å; P470-F483 HydrophobicContact CB-CZ 3.73Å; P470-F483 HydrophobicContact CG-CE1 3.93Å; P470-F483 HydrophobicContact CG-CE2 4.15Å; P470-F483 HydrophobicContact CG-CZ 3.69Å
471	I	64.1	Low	64.1	Low	66 Å²	66	74.2 Å²	74.2	34%	0.338	43%	0.429	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.3	114.4	-176.6	-44.1	168.4	0	0	0	109.8	K481 Y482 L488	I471-K481 CarbonylContact O-C 3.58Å; I471-K481 WeakPolarHBondContact O-CA 3.44Å; I471-Y482 WeakPolarHBondContact CB-O 3.49Å; I471-Y482 WeakPolarHBondContact CG1-O 3.42Å; I471-Y482 PolarHBondContact N-O 3.16Å; I471-Y482 PolarHBondContact O-N 3.22Å; I471-L488 HydrophobicContact CB-CD2 4.41Å; I471-L488 HydrophobicContact CG2-CD2 3.64Å
472	S	68.5	Low	63.6	Low	70 Å²	70	76 Å²	76	49%	0.49	44%	0.436	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.1	157.7	176	47.1	0	0	0	0	112.6	P470	P470-S472 PolarHBondContact O-N 3.25Å
473	C	75.7	Confident	62.5	Low	9 Å²	9	80.3 Å²	80.3	6%	0.061	45%	0.453	C	S	.	.			trans	-83.2	126.7	164.7	-171.1	0	0	0	0	111.5	A475 C478 M480 L488 H491 H496	C473-A475 PolarHBondContact O-N 3.4Å; C473-C478 HydrophobicContact CB-CB 4.13Å; C473-M480 PolarHBondContact N-O 2.71Å; C473-L488 HydrophobicContact CB-CD1 3.88Å; C473-H491 PolarHBondContact SG-CD2 3.33Å; C473-H491 PolarHBondContact SG-NE2 3.28Å; C473-H491 VanDerWaalsContact SG-NE2 3.42Å; C473-H496 VanDerWaalsContact SG-CD2 3.54Å
474	D	76.1	Confident	61.8	Low	120 Å²	120	78 Å²	78	64%	0.642	44%	0.444	S	S	*	.			trans	-71.5	14.3	-178	-32.8	-67.2	0	0	0	114.4	K492	D474-K492 WeakPolarHBondContact OD2-CE 3.42Å; D474-K492 IonicContact OD2-NZ 2.68Å; D474-K492 PolarHBondContact OD2-NZ 3.29Å
475	A	74.2	Confident	61.7	Low	20 Å²	20	80.8 Å²	80.8	17%	0.165	45%	0.452	C	S	.	.	S	Bend	trans	-100.5	137.3	-172	0	0	0	0	0	111.1	C473 N477 C478 H496	C473-A475 PolarHBondContact O-N 3.4Å; A475-N477 PolarHBondContact O-N 3.42Å; A475-C478 HydrophobicContact CB-CB 4.19Å; A475-C478 WeakPolarHBondContact O-CB 3.2Å; A475-C478 PolarHBondContact O-N 3.33Å; A475-C478 VanDerWaalsContact O-N 3.11Å; A475-H496 HydrophobicContact CB-CB 4.36Å; A475-H496 VanDerWaalsContact CB-CE1 3.4Å; A475-H496 WeakPolarHBondContact CB-CE1 3.48Å; A475-H496 VanDerWaalsContact CB-ND1 3.25Å; A475-H496 WeakPolarHBondContact CB-ND1 3.43Å
476	P	60.7	Low	61.3	Low	117 Å²	117	82.3 Å²	82.3	76%	0.76	46%	0.459	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.2	139.1	178.1	24.1	-33.5	0	0	0	110.8	C478	P476-C478 VanDerWaalsContact C-N 3.27Å; P476-C478 PolarHBondContact O-N 3.01Å
477	N	60.4	Low	61.4	Low	173 Å²	173	79.6 Å²	79.6	93%	0.925	45%	0.446	S	S	*	.	T	Hydrogen-bonded Turn	trans	63	19.5	-176.1	-52.2	-23	0	0	0	115.6	A475	A475-N477 PolarHBondContact O-N 3.42Å
478	C	67.6	Low	62.5	Low	22 Å²	22	76.3 Å²	76.3	15%	0.149	43%	0.43	C	S	.	.			trans	-111.3	100.6	175.2	-164.8	0	0	0	0	113.8	C473 A475 P476 M480 H491 H496	C473-C478 HydrophobicContact CB-CB 4.13Å; A475-C478 HydrophobicContact CB-CB 4.19Å; A475-C478 WeakPolarHBondContact O-CB 3.2Å; A475-C478 PolarHBondContact O-N 3.33Å; A475-C478 VanDerWaalsContact O-N 3.11Å; P476-C478 VanDerWaalsContact C-N 3.27Å; P476-C478 PolarHBondContact O-N 3.01Å; C478-M480 PolarHBondContact O-N 3.31Å; C478-H491 PolarHBondContact SG-CE1 3.35Å; C478-H491 PolarHBondContact SG-NE2 3.12Å; C478-H496 WeakPolarHBondContact CB-NE2 3.33Å; C478-H496 PolarHBondContact SG-NE2 3.4Å
479	S	66.3	Low	63.5	Low	114 Å²	114	74.4 Å²	74.4	80%	0.797	41%	0.409	S	S	*	.			trans	-83	11.3	176.7	-46.9	0	0	0	0	114.5
480	M	63.7	Low	64.3	Low	93 Å²	93	77.3 Å²	77.3	46%	0.458	41%	0.407	S	S	.	.			trans	-75.5	134	-178.2	-64.6	-59.6	-62.5	0	0	111.4	C473 C478 Y482	C473-M480 PolarHBondContact N-O 2.71Å; C478-M480 PolarHBondContact O-N 3.31Å; M480-Y482 HydrophobicContact CB-CE2 3.66Å; M480-Y482 WeakPolarHBondContact CE-OH 3.19Å
481	K	57.4	Low	65.1	Low	95 Å²	95	76.6 Å²	76.6	41%	0.413	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	145.9	177.2	-38.7	176.8	-168.2	166.5	0	110.4	P470 I471 E692	P470-K481 HydrophobicContact CB-CB 3.7Å; P470-K481 HydrophobicContact CG-CB 3.56Å; P470-K481 HydrophobicContact CG-CD 3.7Å; P470-K481 HydrophobicContact CG-CG 4.31Å; I471-K481 CarbonylContact O-C 3.58Å; I471-K481 WeakPolarHBondContact O-CA 3.44Å; K481-E692 IonicContact NZ-OE1 3.6Å; K481-E692 PolarHBondContact NZ-OE1 3.24Å; K481-E692 IonicContact NZ-OE2 2.84Å; K481-E692 PolarHBondContact NZ-OE2 3.06Å
482	Y	63.8	Low	65.5	Low	46 Å²	46	77.1 Å²	77.1	18%	0.18	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	136.1	-174.1	-67.4	-75.6	0	0	0	113.4	P470 I471 M480 S484 D487 L488 H491	P470-Y482 CarbonylContact C-O 3.57Å; I471-Y482 WeakPolarHBondContact CB-O 3.49Å; I471-Y482 WeakPolarHBondContact CG1-O 3.42Å; I471-Y482 PolarHBondContact N-O 3.16Å; I471-Y482 PolarHBondContact O-N 3.22Å; M480-Y482 HydrophobicContact CB-CE2 3.66Å; M480-Y482 WeakPolarHBondContact CE-OH 3.19Å; Y482-S484 PolarHBondContact O-N 3.11Å; Y482-D487 HydrophobicContact CD1-CB 3.56Å; Y482-D487 HydrophobicContact CE1-CB 4.31Å; Y482-D487 HydrophobicContact CG-CB 4.05Å; Y482-L488 HydrophobicContact CD2-CB 4.24Å; Y482-L488 HydrophobicContact CD2-CD1 3.94Å; Y482-L488 HydrophobicContact CE2-CD1 4.45Å; Y482-L488 HydrophobicContact CG-CB 4.48Å; Y482-H491 HydrophobicContact CD2-CB 4.23Å; Y482-H491 HydrophobicContact CE1-CB 4.44Å; Y482-H491 HydrophobicContact CE2-CB 3.42Å; Y482-H491 VanDerWaalsContact CE2-CB 3.42Å; Y482-H491 AromaticContact CE2-CD2 3.94Å; Y482-H491 AromaticContact CE2-CG 3.32Å; Y482-H491 AromaticContact CE2-ND1 3.56Å; Y482-H491 AromaticContact CZ-CG 3.67Å; Y482-H491 AromaticContact CZ-ND1 3.6Å; Y482-H491 PolarHBondContact OH-ND1 3.11Å
483	F	46.5	Very low	65.6	Low	135 Å²	135	79.4 Å²	79.4	59%	0.592	41%	0.407	S	S	*	.	S	Bend	trans	-82.7	9	176.8	-62.4	-85.2	0	0	0	113.8	T464 P470	T464-F483 HydrophobicContact CG2-CB 4.46Å; P470-F483 HydrophobicContact CB-CD1 3.85Å; P470-F483 HydrophobicContact CB-CD2 4.06Å; P470-F483 HydrophobicContact CB-CE1 3.7Å; P470-F483 HydrophobicContact CB-CE2 3.9Å; P470-F483 HydrophobicContact CB-CG 4.03Å; P470-F483 HydrophobicContact CB-CZ 3.73Å; P470-F483 HydrophobicContact CG-CE1 3.93Å; P470-F483 HydrophobicContact CG-CE2 4.15Å; P470-F483 HydrophobicContact CG-CZ 3.69Å
484	S	56.3	Low	64.8	Low	30 Å²	30	84.6 Å²	84.6	21%	0.21	43%	0.429	C	S	.	.	S	Bend	trans	-148.8	137.3	178	-175.6	0	0	0	0	110.4	Y482 E486 D487 L488	Y482-S484 PolarHBondContact O-N 3.11Å; S484-E486 PolarHBondContact O-N 3.14Å; S484-E486 PolarHBondContact OG-N 3.07Å; S484-D487 WeakPolarHBondContact CB-OD2 3.11Å; S484-D487 PolarHBondContact O-N 3.36Å; S484-L488 PolarHBondContact O-N 3.23Å; S484-L488 VanDerWaalsContact O-N 3.09Å
485	E	62.4	Low	64.2	Low	117 Å²	117	84.8 Å²	84.8	55%	0.547	42%	0.424	S	S	.	.	H	α-helix	trans	-58.7	-31.5	173	-163.2	-161.2	150.9	0	0	111.6	L488 K489	E485-L488 PolarHBondContact O-N 3.06Å; E485-K489 VanDerWaalsContact CD-NZ 3.32Å; E485-K489 WeakPolarHBondContact O-CG 3.38Å; E485-K489 PolarHBondContact O-N 3.46Å; E485-K489 WeakPolarHBondContact OE1-CE 3.48Å; E485-K489 IonicContact OE1-NZ 2.64Å; E485-K489 PolarHBondContact OE1-NZ 3.48Å; E485-K489 IonicContact OE2-NZ 3.85Å
486	E	62.3	Low	63.9	Low	93 Å²	93	86.8 Å²	86.8	44%	0.435	43%	0.43	S	S	.	.	H	α-helix	trans	-74.8	-32.3	179.8	-177.9	45.4	-137.1	0	0	112.4	S484 R490	S484-E486 PolarHBondContact O-N 3.14Å; S484-E486 PolarHBondContact OG-N 3.07Å; E486-R490 PolarHBondContact O-N 3.18Å; E486-R490 VanDerWaalsContact O-N 3.15Å; E486-R490 PolarHBondContact O-NE 3.26Å; E486-R490 VanDerWaalsContact O-NE 3.17Å; E486-R490 PolarHBondContact O-NH2 2.6Å; E486-R490 IonicContact OE1-NE 2.87Å; E486-R490 PolarHBondContact OE1-NE 3.37Å; E486-R490 VanDerWaalsContact OE1-NE 3.09Å
487	D	60.8	Low	63.6	Low	62 Å²	62	83.2 Å²	83.2	33%	0.332	41%	0.408	S	S	.	.	H	α-helix	trans	-69	-37.8	168.2	-74.6	-64	0	0	0	111.4	Y482 S484 R490 H491	Y482-D487 HydrophobicContact CD1-CB 3.56Å; Y482-D487 HydrophobicContact CE1-CB 4.31Å; Y482-D487 HydrophobicContact CG-CB 4.05Å; S484-D487 WeakPolarHBondContact CB-OD2 3.11Å; S484-D487 PolarHBondContact O-N 3.36Å; D487-R490 PolarHBondContact O-N 3.23Å; D487-R490 IonicContact OD1-CZ 2.67Å; D487-R490 IonicContact OD1-NH1 3.66Å; D487-R490 PolarHBondContact OD1-NH1 3.3Å; D487-R490 IonicContact OD1-NH2 3.19Å; D487-R490 PolarHBondContact OD1-NH2 2.84Å; D487-R490 IonicContact OD2-NH2 2.62Å; D487-H491 WeakPolarHBondContact O-CB 3.3Å; D487-H491 PolarHBondContact O-N 3.3Å
488	L	69.9	Low	62.8	Low	9 Å²	9	80.6 Å²	80.6	5%	0.047	40%	0.403	C	S	.	.	H	α-helix	trans	-66.4	-39.4	174.2	-179.4	60.7	0	0	0	112.5	I471 C473 Y482 S484 E485 H491 K492	I471-L488 HydrophobicContact CB-CD2 4.41Å; I471-L488 HydrophobicContact CG2-CD2 3.64Å; C473-L488 HydrophobicContact CB-CD1 3.88Å; Y482-L488 HydrophobicContact CD2-CB 4.24Å; Y482-L488 HydrophobicContact CD2-CD1 3.94Å; Y482-L488 HydrophobicContact CE2-CD1 4.45Å; Y482-L488 HydrophobicContact CG-CB 4.48Å; S484-L488 PolarHBondContact O-N 3.23Å; S484-L488 VanDerWaalsContact O-N 3.09Å; E485-L488 PolarHBondContact O-N 3.06Å; L488-H491 WeakPolarHBondContact O-CB 3.24Å; L488-H491 PolarHBondContact O-N 3.08Å; L488-K492 HydrophobicContact CD1-CD 4.36Å; L488-K492 HydrophobicContact CD1-CG 4.17Å; L488-K492 HydrophobicContact CG-CD 4.18Å; L488-K492 HydrophobicContact CG-CG 4.42Å; L488-K492 WeakPolarHBondContact O-CB 3.1Å; L488-K492 WeakPolarHBondContact O-CG 3.26Å; L488-K492 PolarHBondContact O-N 3.06Å
489	K	70.7	Confident	61.3	Low	105 Å²	105	81.6 Å²	81.6	46%	0.457	41%	0.413	S	S	.	.	H	α-helix	trans	-59.7	-49.5	173.8	-78.4	168	-177.4	164.2	0	111.1	E485 H491 K492 L493	E485-K489 VanDerWaalsContact CD-NZ 3.32Å; E485-K489 WeakPolarHBondContact O-CG 3.38Å; E485-K489 PolarHBondContact O-N 3.46Å; E485-K489 WeakPolarHBondContact OE1-CE 3.48Å; E485-K489 IonicContact OE1-NZ 2.64Å; E485-K489 PolarHBondContact OE1-NZ 3.48Å; E485-K489 IonicContact OE2-NZ 3.85Å; K489-H491 VanDerWaalsContact C-N 3.32Å; K489-H491 PolarHBondContact O-N 2.64Å; K489-K492 PolarHBondContact O-N 3.46Å; K489-L493 WeakPolarHBondContact O-CB 3.47Å; K489-L493 PolarHBondContact O-N 3.05Å
490	R	65.5	Low	59.8	Low	101 Å²	101	79.2 Å²	79.2	38%	0.381	39%	0.391	S	S	.	.	H	α-helix	trans	-62.8	-36.1	175.5	-76.8	178	-79.7	107	-5.8	112.7	E486 D487 F494	E486-R490 PolarHBondContact O-N 3.18Å; E486-R490 VanDerWaalsContact O-N 3.15Å; E486-R490 PolarHBondContact O-NE 3.26Å; E486-R490 VanDerWaalsContact O-NE 3.17Å; E486-R490 PolarHBondContact O-NH2 2.6Å; E486-R490 IonicContact OE1-NE 2.87Å; E486-R490 PolarHBondContact OE1-NE 3.37Å; E486-R490 VanDerWaalsContact OE1-NE 3.09Å; D487-R490 PolarHBondContact O-N 3.23Å; D487-R490 IonicContact OD1-CZ 2.67Å; D487-R490 IonicContact OD1-NH1 3.66Å; D487-R490 PolarHBondContact OD1-NH1 3.3Å; D487-R490 IonicContact OD1-NH2 3.19Å; D487-R490 PolarHBondContact OD1-NH2 2.84Å; D487-R490 IonicContact OD2-NH2 2.62Å; R490-F494 PolarHBondContact O-N 3.1Å; R490-F494 VanDerWaalsContact O-N 3.16Å
491	H	73.8	Confident	58.4	Low	12 Å²	12	79.6 Å²	79.6	6%	0.056	39%	0.39	C	S	.	.	H	α-helix	trans	-64	-51.3	172.5	169.5	86	0	0	0	112.4	C473 C478 Y482 D487 L488 K489 L493 F494 K495 H496	C473-H491 PolarHBondContact SG-CD2 3.33Å; C473-H491 PolarHBondContact SG-NE2 3.28Å; C473-H491 VanDerWaalsContact SG-NE2 3.42Å; C478-H491 PolarHBondContact SG-CE1 3.35Å; C478-H491 PolarHBondContact SG-NE2 3.12Å; Y482-H491 HydrophobicContact CD2-CB 4.23Å; Y482-H491 HydrophobicContact CE1-CB 4.44Å; Y482-H491 HydrophobicContact CE2-CB 3.42Å; Y482-H491 VanDerWaalsContact CE2-CB 3.42Å; Y482-H491 AromaticContact CE2-CD2 3.94Å; Y482-H491 AromaticContact CE2-CG 3.32Å; Y482-H491 AromaticContact CE2-ND1 3.56Å; Y482-H491 AromaticContact CZ-CG 3.67Å; Y482-H491 AromaticContact CZ-ND1 3.6Å; Y482-H491 PolarHBondContact OH-ND1 3.11Å; D487-H491 WeakPolarHBondContact O-CB 3.3Å; D487-H491 PolarHBondContact O-N 3.3Å; L488-H491 WeakPolarHBondContact O-CB 3.24Å; L488-H491 PolarHBondContact O-N 3.08Å; K489-H491 VanDerWaalsContact C-N 3.32Å; K489-H491 PolarHBondContact O-N 2.64Å; H491-L493 VanDerWaalsContact C-N 3.28Å; H491-L493 PolarHBondContact O-N 3.25Å; H491-F494 PolarHBondContact O-N 3.11Å; H491-F494 VanDerWaalsContact O-N 3.12Å; H491-K495 PolarHBondContact O-N 3.39Å; H491-H496 AromaticContact CD2-CD2 3.86Å; H491-H496 AromaticContact CE1-NE2 3.95Å; H491-H496 AromaticContact NE2-CD2 3.3Å; H491-H496 PolarHBondContact NE2-CD2 3.45Å; H491-H496 VanDerWaalsContact NE2-CD2 3.3Å; H491-H496 AromaticContact NE2-NE2 3.28Å; H491-H496 PolarHBondContact NE2-NE2 3.39Å
492	K	73.2	Confident	57.2	Low	76 Å²	76	79.8 Å²	79.8	33%	0.33	40%	0.396	S	S	.	.	I	π-helix	trans	-57	-42.9	178.4	-76.6	176.1	175.4	178.1	0	110.8	D474 L488 K489 F494 H496 S497	D474-K492 WeakPolarHBondContact OD2-CE 3.42Å; D474-K492 IonicContact OD2-NZ 2.68Å; D474-K492 PolarHBondContact OD2-NZ 3.29Å; L488-K492 HydrophobicContact CD1-CD 4.36Å; L488-K492 HydrophobicContact CD1-CG 4.17Å; L488-K492 HydrophobicContact CG-CD 4.18Å; L488-K492 HydrophobicContact CG-CG 4.42Å; L488-K492 WeakPolarHBondContact O-CB 3.1Å; L488-K492 WeakPolarHBondContact O-CG 3.26Å; L488-K492 PolarHBondContact O-N 3.06Å; K489-K492 PolarHBondContact O-N 3.46Å; K492-F494 PolarHBondContact O-N 3.13Å; K492-H496 CarbonylContact O-C 3.53Å; K492-H496 VanDerWaalsContact O-C 3.29Å; K492-H496 VanDerWaalsContact O-CA 3.27Å; K492-H496 WeakPolarHBondContact O-CA 3.45Å; K492-H496 PolarHBondContact O-N 3.15Å; K492-S497 PolarHBondContact O-N 2.96Å
493	L	70.1	Confident	55.8	Low	118 Å²	118	80 Å²	80	62%	0.618	41%	0.405	S	S	*	.	I	π-helix	trans	-57.2	-49.5	174.2	-165.6	76.7	0	0	0	112.3	K489 H491 S497	K489-L493 WeakPolarHBondContact O-CB 3.47Å; K489-L493 PolarHBondContact O-N 3.05Å; H491-L493 VanDerWaalsContact C-N 3.28Å; H491-L493 PolarHBondContact O-N 3.25Å; L493-S497 VanDerWaalsContact O-CB 3.31Å; L493-S497 WeakPolarHBondContact O-CB 3.35Å
494	F	59.7	Low	55	Low	118 Å²	118	77.3 Å²	77.3	52%	0.518	40%	0.401	S	S	.	.	I	π-helix	trans	-79.9	-27	-175	-93.3	-81	0	0	0	115.7	R490 H491 K492	R490-F494 PolarHBondContact O-N 3.1Å; R490-F494 VanDerWaalsContact O-N 3.16Å; H491-F494 PolarHBondContact O-N 3.11Å; H491-F494 VanDerWaalsContact O-N 3.12Å; K492-F494 PolarHBondContact O-N 3.13Å
495	K	63.3	Low	53.7	Low	124 Å²	124	86 Å²	86	54%	0.539	43%	0.43	S	S	.	.	I	π-helix	trans	-112.3	-27.3	-175.5	-71.4	-68.5	-171.1	174.2	0	113.9	H491 K501	H491-K495 PolarHBondContact O-N 3.39Å; K495-K501 VanDerWaalsContact O-CE 3.32Å; K495-K501 WeakPolarHBondContact O-CE 3.48Å; K495-K501 PolarHBondContact O-NZ 2.85Å
496	H	67.1	Low	52.3	Low	63 Å²	63	87 Å²	87	29%	0.292	43%	0.434	S	S	.	.	I	π-helix	trans	-126.7	-2.2	-167.7	-60.5	-65.3	0	0	0	115.6	C473 A475 C478 H491 K492 S498	C473-H496 VanDerWaalsContact SG-CD2 3.54Å; A475-H496 HydrophobicContact CB-CB 4.36Å; A475-H496 VanDerWaalsContact CB-CE1 3.4Å; A475-H496 WeakPolarHBondContact CB-CE1 3.48Å; A475-H496 VanDerWaalsContact CB-ND1 3.25Å; A475-H496 WeakPolarHBondContact CB-ND1 3.43Å; C478-H496 WeakPolarHBondContact CB-NE2 3.33Å; C478-H496 PolarHBondContact SG-NE2 3.4Å; H491-H496 AromaticContact CD2-CD2 3.86Å; H491-H496 AromaticContact CE1-NE2 3.95Å; H491-H496 AromaticContact NE2-CD2 3.3Å; H491-H496 PolarHBondContact NE2-CD2 3.45Å; H491-H496 VanDerWaalsContact NE2-CD2 3.3Å; H491-H496 AromaticContact NE2-NE2 3.28Å; H491-H496 PolarHBondContact NE2-NE2 3.39Å; K492-H496 CarbonylContact O-C 3.53Å; K492-H496 VanDerWaalsContact O-C 3.29Å; K492-H496 VanDerWaalsContact O-CA 3.27Å; K492-H496 WeakPolarHBondContact O-CA 3.45Å; K492-H496 PolarHBondContact O-N 3.15Å; H496-S498 PolarHBondContact O-N 2.84Å; H496-S498 VanDerWaalsContact O-N 3.09Å
497	S	54.5	Low	50.9	Low	41 Å²	41	91.1 Å²	91.1	29%	0.287	45%	0.453	S	S	.	.			trans	-55.1	119.1	163.6	-172.7	0	0	0	0	109.4	K492 L493 A499 K501	K492-S497 PolarHBondContact O-N 2.96Å; L493-S497 VanDerWaalsContact O-CB 3.31Å; L493-S497 WeakPolarHBondContact O-CB 3.35Å; S497-A499 PolarHBondContact OG-N 2.91Å; S497-A499 PolarHBondContact OG-O 3.16Å; S497-K501 WeakPolarHBondContact O-CD 3.38Å; S497-K501 WeakPolarHBondContact O-CE 3.37Å; S497-K501 WeakPolarHBondContact O-CG 3.47Å
498	S	43.4	Very low	49.3	Very low	119 Å²	119	95 Å²	95	83%	0.832	47%	0.474	S	S	*	.			trans	-84.8	-19.8	170.8	47.4	0	0	0	0	111.8	H496	H496-S498 PolarHBondContact O-N 2.84Å; H496-S498 VanDerWaalsContact O-N 3.09Å
499	A	36.3	Very low	47.3	Very low	43 Å²	43	98.2 Å²	98.2	36%	0.355	50%	0.497	S	S	.	.	S	Bend	trans	-77.5	127	167.3	0	0	0	0	0	110.3	S497 K501	S497-A499 PolarHBondContact OG-N 2.91Å; S497-A499 PolarHBondContact OG-O 3.16Å; A499-K501 PolarHBondContact O-N 2.99Å
500	N	34.3	Very low	45.7	Very low	64 Å²	64	99.9 Å²	99.9	34%	0.342	52%	0.516	S	S	.	.	S	Bend	trans	57.1	40.9	166.9	-84.3	-17.3	0	0	0	117.8	D502 S503 L573	N500-D502 PolarHBondContact O-N 2.84Å; N500-S503 VanDerWaalsContact CG-CB 3.47Å; N500-S503 WeakPolarHBondContact OD1-CB 3.38Å; N500-L573 HydrophobicContact CB-CD1 3.84Å; N500-L573 HydrophobicContact CB-CD2 3.85Å; N500-L573 HydrophobicContact CB-CG 3.96Å; N500-L573 WeakPolarHBondContact ND2-CD1 3.22Å
501	K	35.2	Very low	44.2	Very low	100 Å²	100	100.2 Å²	100.2	44%	0.435	52%	0.524	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64	-28.1	156.4	-85	173.2	174.1	168	0	112.5	K495 S497 A499	K495-K501 VanDerWaalsContact O-CE 3.32Å; K495-K501 WeakPolarHBondContact O-CE 3.48Å; K495-K501 PolarHBondContact O-NZ 2.85Å; S497-K501 WeakPolarHBondContact O-CD 3.38Å; S497-K501 WeakPolarHBondContact O-CE 3.37Å; S497-K501 WeakPolarHBondContact O-CG 3.47Å; A499-K501 PolarHBondContact O-N 2.99Å
502	D	32.9	Very low	42.2	Very low	99 Å²	99	106.2 Å²	106.2	53%	0.529	56%	0.564	S	S	.	*	T	Hydrogen-bonded Turn	trans	-82.8	-45.6	-178	-49	-68.3	0	0	0	111.5	N500 C504 R505 Q506	N500-D502 PolarHBondContact O-N 2.84Å; D502-C504 PolarHBondContact O-N 2.86Å; D502-C504 VanDerWaalsContact O-N 3.14Å; D502-R505 CarbonylContact O-C 3.53Å; D502-R505 WeakPolarHBondContact O-CA 3.4Å; D502-R505 PolarHBondContact O-N 2.77Å; D502-Q506 HydrophobicContact CB-CG 4.47Å; D502-Q506 VanDerWaalsContact O-CB 3.28Å; D502-Q506 WeakPolarHBondContact O-CB 3.31Å; D502-Q506 VanDerWaalsContact O-CG 3.26Å; D502-Q506 WeakPolarHBondContact O-CG 3.31Å; D502-Q506 PolarHBondContact O-N 3.32Å
503	S	33.5	Very low	40.4	Very low	52 Å²	52	107.7 Å²	107.7	36%	0.364	57%	0.572	S	S	.	*	T	Hydrogen-bonded Turn	trans	-59	-28.9	175	174.3	0	0	0	0	114	N500 R505 L573	N500-S503 VanDerWaalsContact CG-CB 3.47Å; N500-S503 WeakPolarHBondContact OD1-CB 3.38Å; S503-R505 VanDerWaalsContact C-N 3.26Å; S503-R505 PolarHBondContact O-N 3.19Å; S503-L573 WeakPolarHBondContact OG-CD1 3.24Å
504	C	28.7	Very low	38.4	Very low	78 Å²	78	106.3 Å²	106.3	53%	0.527	57%	0.572	S	S	.	*	T	Hydrogen-bonded Turn	trans	-81.9	1	172.4	-163.4	0	0	0	0	114	D502 F575	D502-C504 PolarHBondContact O-N 2.86Å; D502-C504 VanDerWaalsContact O-N 3.14Å; C504-F575 HydrophobicContact CB-CZ 4.37Å
505	R	30.7	Very low	37	Very low	213 Å²	213	108.3 Å²	108.3	80%	0.804	59%	0.588	S	S	*	*	T	Hydrogen-bonded Turn	trans	-126.2	-6.9	177.1	-77.4	179	157.1	-174.7	-10.4	113.8	D502 S503	D502-R505 CarbonylContact O-C 3.53Å; D502-R505 WeakPolarHBondContact O-CA 3.4Å; D502-R505 PolarHBondContact O-N 2.77Å; S503-R505 VanDerWaalsContact C-N 3.26Å; S503-R505 PolarHBondContact O-N 3.19Å
506	Q	32.1	Very low	35.3	Very low	137 Å²	137	111.9 Å²	111.9	64%	0.64	61%	0.606	S	S	*	*			trans	-110.1	24.2	-176.7	-70.5	175.9	-45.8	0	0	113.6	D502	D502-Q506 HydrophobicContact CB-CG 4.47Å; D502-Q506 VanDerWaalsContact O-CB 3.28Å; D502-Q506 WeakPolarHBondContact O-CB 3.31Å; D502-Q506 VanDerWaalsContact O-CG 3.26Å; D502-Q506 WeakPolarHBondContact O-CG 3.31Å; D502-Q506 PolarHBondContact O-N 3.32Å
507	Q	33.2	Very low	33.5	Very low	179 Å²	179	113.4 Å²	113.4	84%	0.836	62%	0.624	S	S	*	*	S	Bend	trans	-94	105.4	144.5	-78.8	-165.6	-20	0	0	106.6	C509	Q507-C509 PolarHBondContact O-N 2.97Å
508	D	26.2	Very low	32	Very low	143 Å²	143	123.6 Å²	123.6	77%	0.765	66%	0.658	S	S	*	*			trans	-61	99.8	-173.1	-71.7	-53.8	0	0	0	111.4	T510	D508-T510 PolarHBondContact O-N 2.63Å; D508-T510 PolarHBondContact O-OG1 2.89Å
509	C	29.3	Very low	31.1	Very low	77 Å²	77	122.5 Å²	122.5	52%	0.52	65%	0.65	S	S	.	*			trans	-65.5	102.4	173.5	-168.1	0	0	0	0	108	Q507 I511	Q507-C509 PolarHBondContact O-N 2.97Å; C509-I511 PolarHBondContact O-N 3.39Å
510	T	36.5	Very low	30.6	Very low	140 Å²	140	127 Å²	127	86%	0.859	66%	0.664	S	S	*	*			trans	-72.7	27.7	-170.8	-20	0	0	0	0	113.4	D508	D508-T510 PolarHBondContact O-N 2.63Å; D508-T510 PolarHBondContact O-OG1 2.89Å
511	I	34.2	Very low	30.2	Very low	108 Å²	108	131.3 Å²	131.3	55%	0.554	68%	0.679	S	S	*	*			trans	-124	104.3	-175.1	-55.1	177.9	0	0	0	107.8	C509 E513	C509-I511 PolarHBondContact O-N 3.39Å; I511-E513 PolarHBondContact O-N 3.27Å
512	P	31.2	Very low	30	Very low	138 Å²	138	134.6 Å²	134.6	90%	0.896	70%	0.696	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.3	25.2	-177.6	-23.5	35.3	0	0	0	117.1
513	E	36.7	Very low	29.7	Very low	107 Å²	107	133.4 Å²	133.4	50%	0.5	70%	0.696	S	S	.	*	T	Hydrogen-bonded Turn	trans	-135.6	18.7	-177.6	-57.5	-161.7	121.6	0	0	113.6	I511 D515 K776 R780	I511-E513 PolarHBondContact O-N 3.27Å; E513-D515 VanDerWaalsContact C-N 3.29Å; E513-D515 PolarHBondContact O-N 3.08Å; E513-K776 VanDerWaalsContact OE1-CE 3.31Å; E513-K776 WeakPolarHBondContact OE1-CE 3.33Å; E513-K776 IonicContact OE1-NZ 3.36Å; E513-K776 PolarHBondContact OE1-NZ 2.92Å; E513-K776 IonicContact OE2-NZ 2.63Å; E513-K776 PolarHBondContact OE2-NZ 3.15Å; E513-R780 IonicContact OE2-NH2 2.64Å; E513-R780 PolarHBondContact OE2-NH2 2.84Å
514	C	27.6	Very low	29.5	Very low	90 Å²	90	137.3 Å²	137.3	61%	0.608	71%	0.708	S	S	*	*			trans	-82.9	48.7	-165.2	-151.5	0	0	0	0	115.9	E516	C514-E516 PolarHBondContact O-N 3.4Å
515	D	29.3	Very low	29.4	Very low	160 Å²	160	140.7 Å²	140.7	86%	0.856	72%	0.719	S	S	*	*			trans	-91.5	74.2	178.2	-81.2	-46.3	0	0	0	113.3	E513	E513-D515 VanDerWaalsContact C-N 3.29Å; E513-D515 PolarHBondContact O-N 3.08Å
516	E	28.3	Very low	29.1	Very low	198 Å²	198	136.1 Å²	136.1	93%	0.925	72%	0.715	S	S	*	*			trans	-105.5	74.2	164.3	-74	-140	159.6	0	0	112.5	C514	C514-E516 PolarHBondContact O-N 3.4Å
517	S	28.7	Very low	28.8	Very low	95 Å²	95	135.5 Å²	135.5	66%	0.664	72%	0.721	S	S	*	*			trans	-140.7	118.8	156.6	74.6	0	0	0	0	112.4	S519	S517-S519 PolarHBondContact O-N 2.85Å
518	Y	22.7	Very low	28.4	Very low	255 Å²	255	134.9 Å²	134.9	100%	1	72%	0.722	S	S	*	*			trans	-84.6	94.1	177.5	-106.2	-99.9	0	0	0	110.5
519	S	25.3	Very low	28.4	Very low	96 Å²	96	133.3 Å²	133.3	67%	0.671	72%	0.722	S	S	*	*			trans	-151.7	151.2	162.1	41.9	0	0	0	0	110.1	S517	S517-S519 PolarHBondContact O-N 2.85Å
520	E	26.1	Very low	28.6	Very low	138 Å²	138	134.2 Å²	134.2	65%	0.645	73%	0.729	S	S	*	*			trans	-80.1	140	-162.4	-67.7	171.3	122	0	0	114.5	K718	E520-K718 IonicContact OE1-NZ 3.98Å
521	K	26	Very low	28.1	Very low	154 Å²	154	134.6 Å²	134.6	67%	0.67	73%	0.726	S	S	*	*			trans	42.6	128.1	153.9	-52.1	176.6	178.6	-178.3	0	118.9
522	H	31.2	Very low	28	Very low	170 Å²	170	136.1 Å²	136.1	79%	0.787	74%	0.74	S	S	*	*				-169.1	164.3	75.9	-111.7	-87.7	0	0	0	113.1
523	S	26.7	Very low	27.9	Very low	74 Å²	74	137.1 Å²	137.1	52%	0.517	74%	0.737	S	S	.	*			trans	-81.2	178	163.4	54.7	0	0	0	0	110.9
524	E	28.6	Very low	28.1	Very low	133 Å²	133	137.4 Å²	137.4	62%	0.621	75%	0.748	S	S	*	*			cis	-170.8	178.1	28.5	-145.3	148.1	-92.5	0	0	110.7
525	I	26.7	Very low	28.1	Very low	149 Å²	149	142.4 Å²	142.4	76%	0.764	76%	0.759	S	S	*	*			trans	71.5	145.3	160	-62.4	156.6	0	0	0	117.3
526	T	24.7	Very low	28.1	Very low	117 Å²	117	139 Å²	139	72%	0.718	75%	0.749	S	S	*	*			cis	-163.3	160.8	-29.6	-81.3	0	0	0	0	107.8
527	T	24.7	Very low	28.1	Very low	125 Å²	125	135.1 Å²	135.1	77%	0.767	74%	0.738	S	S	*	*			trans	-58.1	157.9	174.7	32.3	0	0	0	0	116.1
528	I	25.8	Very low	28.3	Very low	165 Å²	165	139 Å²	139	85%	0.846	75%	0.746	S	S	*	*				-172.2	131.9	129.1	-99	154.8	0	0	0	114.2
529	S	27.1	Very low	28.9	Very low	110 Å²	110	132 Å²	132	77%	0.769	73%	0.732	S	S	*	*			trans	53	147.8	155	-152.8	0	0	0	0	124.7
530	S	31.7	Very low	29	Very low	96 Å²	96	133.6 Å²	133.6	67%	0.671	74%	0.737	S	S	*	*			trans	-105	-174.7	175	-42.1	0	0	0	0	112.9
531	N	27.6	Very low	29.1	Very low	148 Å²	148	135.6 Å²	135.6	79%	0.791	75%	0.746	S	S	*	*			trans	85.2	145.6	172.6	-46	-30.7	0	0	0	113.8
532	V	31.2	Very low	29	Very low	141 Å²	141	132.7 Å²	132.7	86%	0.855	74%	0.742	S	S	*	*			cis	-135.2	169.5	30.9	172.7	0	0	0	0	113.4
533	L	29.2	Very low	28.8	Very low	159 Å²	159	134.9 Å²	134.9	83%	0.832	74%	0.743	S	S	*	*			trans	-84.5	-176.7	-172	-106.3	68.5	0	0	0	115.7
534	P	40	Very low	28.9	Very low	112 Å²	112	138.5 Å²	138.5	73%	0.727	76%	0.757	S	S	*	*			trans	-129.4	-137.8	-151.4	46.6	-28.6	0	0	0	113.7
535	K	29.3	Very low	28.9	Very low	195 Å²	195	137.8 Å²	137.8	85%	0.848	76%	0.762	S	S	*	*			trans	116.1	147.3	173.1	-71.9	178.5	179.1	-176.3	0	112.8
536	S	29	Very low	29.1	Very low	90 Å²	90	137.2 Å²	137.2	63%	0.629	77%	0.765	S	S	*	*			cis	-169.5	170.4	-15.1	54.3	0	0	0	0	110.4
537	T	27.5	Very low	29.3	Very low	116 Å²	116	136.6 Å²	136.6	71%	0.712	77%	0.765	S	S	*	*			trans	61.4	146.5	154.7	45.1	0	0	0	0	118.1
538	E	32.3	Very low	29.7	Very low	175 Å²	175	137.5 Å²	137.5	82%	0.818	77%	0.771	S	S	*	*			cis	-155.6	168.8	1.9	-123.1	165	-147.8	0	0	109.6
539	P	37	Very low	30	Very low	110 Å²	110	135.3 Å²	135.3	71%	0.714	77%	0.765	S	S	*	*			trans	-104.7	-169.4	-179	38.5	-28.2	0	0	0	114.1
540	V	26.6	Very low	30.3	Very low	128 Å²	128	137.6 Å²	137.6	78%	0.776	77%	0.768	S	S	*	*			trans	79.6	143.2	179.8	-167.6	0	0	0	0	111.3
541	E	28.7	Very low	30.4	Very low	180 Å²	180	138.8 Å²	138.8	84%	0.841	77%	0.767	S	S	*	*			cis	-136.2	-149	24.1	-152.2	156.8	-128.7	0	0	115.4
542	T	24.5	Very low	30.7	Very low	93 Å²	93	139 Å²	139	57%	0.571	77%	0.766	S	S	*	*			trans	-122.9	171.3	-155	67.6	0	0	0	0	114.8
543	R	26.2	Very low	30.9	Very low	217 Å²	217	137.9 Å²	137.9	82%	0.819	75%	0.752	S	S	*	*			trans	71.9	141.3	158	-71.5	168.4	-179.5	132.9	-5.5	115.7
544	N	29.4	Very low	31.3	Very low	150 Å²	150	138 Å²	138	80%	0.802	75%	0.746	S	S	*	*			cis	-153.9	172.5	30.6	-102	-34.7	0	0	0	114.2
545	T	26.9	Very low	30.9	Very low	118 Å²	118	138.9 Å²	138.9	72%	0.724	74%	0.744	S	S	*	*			trans	-95.1	145.9	177.1	51.5	0	0	0	0	114.8
546	T	32.4	Very low	31.2	Very low	136 Å²	136	140.7 Å²	140.7	83%	0.834	75%	0.746	S	S	*	*			trans	-173.9	128.1	131.4	27.6	0	0	0	0	107.9
547	S	27.9	Very low	31.3	Very low	104 Å²	104	141.9 Å²	141.9	73%	0.727	75%	0.75	S	S	*	*				80.7	109.5	50.1	-59.3	0	0	0	0	114.9
548	T	33.7	Very low	31.4	Very low	145 Å²	145	143.8 Å²	143.8	89%	0.89	76%	0.755	S	S	*	*			trans	-157.7	143.2	141.6	-72.6	0	0	0	0	108.7
549	T	31.5	Very low	31.3	Very low	118 Å²	118	140.9 Å²	140.9	72%	0.724	75%	0.751	S	S	*	*			trans	-130.6	162.9	-167.8	44.8	0	0	0	0	112.8
550	L	34.3	Very low	31	Very low	158 Å²	158	141.5 Å²	141.5	83%	0.827	76%	0.755	S	S	*	*			trans	-167.2	108.8	146.6	-93.3	139.9	0	0	0	106.3
551	N	32.4	Very low	31.1	Very low	121 Å²	121	143.5 Å²	143.5	65%	0.647	76%	0.759	S	S	*	*				60.3	140	84.3	-78.4	-39.4	0	0	0	113.5
552	I	35.8	Very low	31.1	Very low	152 Å²	152	139.1 Å²	139.1	78%	0.779	75%	0.754	S	S	*	*			cis	-143	123	41.7	-67.3	170	0	0	0	108.8
553	Q	34.8	Very low	31.2	Very low	119 Å²	119	140.7 Å²	140.7	56%	0.556	77%	0.766	S	S	*	*				56.8	142.9	94.3	-77.6	-172.8	9.1	0	0	116.6
554	K	36.4	Very low	31.3	Very low	160 Å²	160	139.7 Å²	139.7	70%	0.696	77%	0.768	S	S	*	*			cis	-152.2	138.3	18.9	-109.5	138.8	174.6	145.5	0	110
555	N	32.4	Very low	31.1	Very low	131 Å²	131	137.5 Å²	137.5	70%	0.701	76%	0.764	S	S	*	*				70.1	141.3	90.5	-56.3	12	0	0	0	115
556	R	36.4	Very low	31	Very low	234 Å²	234	139.1 Å²	139.1	88%	0.883	77%	0.774	S	S	*	*			cis	-140.9	140.2	26.9	-69.8	173.3	164.7	141.8	-6.3	112.2
557	T	30.5	Very low	30.7	Very low	114 Å²	114	139.4 Å²	139.4	70%	0.699	77%	0.769	S	S	*	*				78.9	110.8	68.9	-35.5	0	0	0	0	114.4
558	L	30.3	Very low	30.6	Very low	156 Å²	156	139.7 Å²	139.7	82%	0.817	77%	0.771	S	S	*	*				-179.4	166.1	90.5	-84	164.3	0	0	0	110.1
559	P	29.5	Very low	30.2	Very low	114 Å²	114	140.1 Å²	140.1	74%	0.74	77%	0.767	S	S	*	*			cis	-122	173.1	-37.3	39.6	-25.2	0	0	0	112.7
560	P	29.7	Very low	30	Very low	123 Å²	123	139.4 Å²	139.4	80%	0.799	76%	0.764	S	S	*	*			trans	-107.4	148.1	-167.1	38.3	-32.6	0	0	0	116.8
561	I	28.9	Very low	29.7	Very low	170 Å²	170	138.4 Å²	138.4	87%	0.872	77%	0.765	S	S	*	*			trans	-137.4	125.4	164.1	-60.5	-177.6	0	0	0	111.1
562	A	28.6	Very low	29.5	Very low	88 Å²	88	137.5 Å²	137.5	73%	0.727	76%	0.76	S	S	*	*			trans	32.3	115.5	162.5	0	0	0	0	0	121.1
563	P	26.7	Very low	29.2	Very low	127 Å²	127	133.9 Å²	133.9	83%	0.825	74%	0.742	S	S	*	*			trans	-84.4	146.1	172	34.7	-34	0	0	0	113.3
564	K	28.1	Very low	29.2	Very low	196 Å²	196	135.5 Å²	135.5	85%	0.852	75%	0.753	S	S	*	*			trans	-136.2	120.2	160.8	-78.7	-170.5	175.9	-179.6	0	111.7
565	S	26.8	Very low	29.7	Very low	103 Å²	103	131.7 Å²	131.7	72%	0.72	74%	0.736	S	S	*	*			trans	44.8	78.6	158.1	55.1	0	0	0	0	117.6	I567	S565-I567 PolarHBondContact O-N 3.43Å
566	T	23.3	Very low	30.8	Very low	152 Å²	152	136 Å²	136	93%	0.933	74%	0.743	S	S	*	*			trans	-65.4	94.9	157.2	-8.2	0	0	0	0	109.5
567	I	27.3	Very low	32.3	Very low	142 Å²	142	126.5 Å²	126.5	73%	0.728	71%	0.71	S	S	*	*	P	Polyproline II helix	trans	-82.3	119.5	167.7	-63.3	178.7	0	0	0	107.5	S565 L569	S565-I567 PolarHBondContact O-N 3.43Å; I567-L569 PolarHBondContact O-N 3.36Å
568	S	25.4	Very low	34.3	Very low	110 Å²	110	124 Å²	124	77%	0.769	69%	0.694	S	S	*	*	P	Polyproline II helix	trans	-65.9	117.5	178.6	29.6	0	0	0	0	110.9	P570	S568-P570 WeakPolarHBondContact O-CD 3.05Å
569	L	25.5	Very low	36.6	Very low	155 Å²	155	116.8 Å²	116.8	81%	0.812	66%	0.656	S	S	*	*	P	Polyproline II helix	trans	-63.9	121.6	179.7	-128.7	74.3	0	0	0	110.7	I567 T571	I567-L569 PolarHBondContact O-N 3.36Å; L569-T571 PolarHBondContact O-N 3.27Å
570	P	26.2	Very low	38.6	Very low	103 Å²	103	117.6 Å²	117.6	67%	0.669	66%	0.659	S	S	*	*	P	Polyproline II helix	trans	-76.9	118.6	170	30.2	-31.2	0	0	0	109.3	S568 N572	S568-P570 WeakPolarHBondContact O-CD 3.05Å; P570-N572 PolarHBondContact O-N 2.89Å
571	T	29.1	Very low	40.6	Very low	136 Å²	136	117.1 Å²	117.1	83%	0.834	64%	0.642	S	S	*	*	S	Bend	trans	-73.8	36.5	-172.6	-30	0	0	0	0	114.5	L569	L569-T571 PolarHBondContact O-N 3.27Å
572	N	27	Very low	42.3	Very low	102 Å²	102	113.8 Å²	113.8	55%	0.545	63%	0.632	S	S	.	*			trans	-144	145.6	-177.3	-76	-82.1	0	0	0	111.2	P570	P570-N572 PolarHBondContact O-N 2.89Å
573	L	30.6	Very low	44.3	Very low	77 Å²	77	114.1 Å²	114.1	40%	0.403	64%	0.643	S	S	.	*			trans	79.2	76	-177.6	-54	-179.8	0	0	0	117.5	N500 S503 F575	N500-L573 HydrophobicContact CB-CD1 3.84Å; N500-L573 HydrophobicContact CB-CD2 3.85Å; N500-L573 HydrophobicContact CB-CG 3.96Å; N500-L573 WeakPolarHBondContact ND2-CD1 3.22Å; S503-L573 WeakPolarHBondContact OG-CD1 3.24Å; L573-F575 HydrophobicContact CD2-CE2 4.09Å
574	I	35.5	Very low	46.5	Very low	152 Å²	152	109 Å²	109	78%	0.779	61%	0.611	S	S	*	*			trans	-98.5	90.4	156.8	-52.9	-178.4	0	0	0	109.5	R576	I574-R576 HydrophobicContact CG2-CB 3.91Å; I574-R576 HydrophobicContact CG2-CG 4.07Å; I574-R576 PolarHBondContact O-N 3.1Å
575	F	46.8	Very low	48.7	Very low	81 Å²	81	102.2 Å²	102.2	36%	0.355	60%	0.596	S	S	.	*			trans	-70.8	74.1	163.6	-79.1	-77.6	0	0	0	109.7	C504 L573 N577 V578	C504-F575 HydrophobicContact CB-CZ 4.37Å; L573-F575 HydrophobicContact CD2-CE2 4.09Å; F575-N577 PolarHBondContact O-N 3.48Å; F575-V578 HydrophobicContact CB-CG2 4.27Å
576	R	55.5	Low	51	Low	221 Å²	221	102.8 Å²	102.8	83%	0.834	59%	0.586	S	S	*	*			trans	-65	12	-170.7	-147.6	177.5	-176.5	177.5	2	115.8	I574	I574-R576 HydrophobicContact CG2-CB 3.91Å; I574-R576 HydrophobicContact CG2-CG 4.07Å; I574-R576 PolarHBondContact O-N 3.1Å
577	N	66.3	Low	53.2	Low	35 Å²	35	98.7 Å²	98.7	19%	0.187	56%	0.563	C	S	.	*			trans	-139.6	51.9	-176.1	-57.8	-76.1	0	0	0	111.1	F575 Y588 Y591 L594	F575-N577 PolarHBondContact O-N 3.48Å; N577-Y588 WeakPolarHBondContact CB-O 3.49Å; N577-Y588 PolarHBondContact O-N 2.78Å; N577-Y591 WeakPolarHBondContact OD1-CA 3.39Å; N577-Y591 VanDerWaalsContact OD1-CB 3.26Å; N577-Y591 WeakPolarHBondContact OD1-CB 3.31Å; N577-Y591 PolarHBondContact OD1-N 3.29Å; N577-Y591 VanDerWaalsContact OD1-N 3.1Å; N577-L594 HydrophobicContact CB-CB 4.36Å; N577-L594 HydrophobicContact CB-CD2 4.14Å
578	V	72.6	Confident	55.4	Low	62 Å²	62	94.6 Å²	94.6	38%	0.376	54%	0.539	S	S	.	.	B	Isolated β-bridge	trans	-84.7	145.1	169.3	173.3	0	0	0	0	110	F575 T580	F575-V578 HydrophobicContact CB-CG2 4.27Å; V578-T580 PolarHBondContact O-N 2.87Å
579	C	78.7	Confident	57.3	Low	3 Å²	3	91.9 Å²	91.9	2%	0.02	52%	0.521	C	S	.	.			trans	-76.6	112.6	169.1	-170.7	0	0	0	0	110.6	Y581 K586 L594 H597 H601	C579-Y581 PolarHBondContact O-N 2.84Å; C579-K586 HydrophobicContact CB-CB 4.46Å; C579-K586 WeakPolarHBondContact CB-O 3.29Å; C579-K586 PolarHBondContact N-O 3.38Å; C579-L594 HydrophobicContact CB-CD1 3.91Å; C579-H597 WeakPolarHBondContact CB-NE2 3.03Å; C579-H597 PolarHBondContact SG-NE2 3.06Å; C579-H601 VanDerWaalsContact SG-CD2 3.6Å
580	T	71.4	Confident	59.4	Low	131 Å²	131	86.3 Å²	86.3	80%	0.804	50%	0.495	S	S	*	.			trans	-76.3	-2.9	177.3	51.4	0	0	0	0	113.9	V578	V578-T580 PolarHBondContact O-N 2.87Å
581	Y	72.4	Confident	61.5	Low	114 Å²	114	87.9 Å²	87.9	45%	0.447	49%	0.488	S	S	.	.	S	Bend	trans	-66.4	131.1	179.3	-164.7	-88.4	0	0	0	110.9	C579 G583 C584 H601	C579-Y581 PolarHBondContact O-N 2.84Å; Y581-G583 PolarHBondContact O-N 2.83Å; Y581-C584 WeakPolarHBondContact O-CB 3.41Å; Y581-C584 PolarHBondContact O-N 3.26Å; Y581-H601 HydrophobicContact CD1-CB 4.33Å; Y581-H601 AromaticContact CD1-CE1 3.19Å; Y581-H601 WeakPolarHBondContact CD1-CE1 3.19Å; Y581-H601 AromaticContact CD1-CG 3.76Å; Y581-H601 AromaticContact CD1-ND1 3.35Å; Y581-H601 WeakPolarHBondContact CD1-ND1 3.25Å; Y581-H601 AromaticContact CD1-NE2 3.87Å; Y581-H601 HydrophobicContact CD2-CB 3.65Å; Y581-H601 AromaticContact CD2-CG 3.76Å; Y581-H601 HydrophobicContact CE1-CB 4.46Å; Y581-H601 AromaticContact CE1-CE1 3.25Å; Y581-H601 WeakPolarHBondContact CE1-CE1 3.35Å; Y581-H601 AromaticContact CE1-ND1 3.77Å; Y581-H601 HydrophobicContact CE2-CB 3.79Å; Y581-H601 HydrophobicContact CG-CB 3.93Å; Y581-H601 AromaticContact CG-CD2 3.73Å; Y581-H601 AromaticContact CG-CE1 3.76Å; Y581-H601 AromaticContact CG-CG 3.49Å; Y581-H601 VanDerWaalsContact CG-CG 3.49Å; Y581-H601 AromaticContact CG-ND1 3.61Å; Y581-H601 AromaticContact CZ-CE1 3.85Å
582	P	65.3	Low	63.5	Low	100 Å²	100	85.8 Å²	85.8	65%	0.649	48%	0.479	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.7	135.2	-177.6	-31.2	36.4	0	0	0	113.6	C584	P582-C584 PolarHBondContact O-N 3.48Å; P582-C584 VanDerWaalsContact O-N 3.13Å
583	G	69.3	Low	65.7	Low	94 Å²	94	86 Å²	86	97%	0.969	48%	0.475	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.7	2.3	-178.6	0	0	0	0	0	116	Y581	Y581-G583 PolarHBondContact O-N 2.83Å
584	C	73.7	Confident	67.9	Low	20 Å²	20	83 Å²	83	14%	0.135	46%	0.459	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.7	-52.8	-179.3	-162.6	0	0	0	0	114.7	Y581 P582 K586 H597 H601	Y581-C584 WeakPolarHBondContact O-CB 3.41Å; Y581-C584 PolarHBondContact O-N 3.26Å; P582-C584 PolarHBondContact O-N 3.48Å; P582-C584 VanDerWaalsContact O-N 3.13Å; C584-K586 PolarHBondContact O-N 3.02Å; C584-H597 VanDerWaalsContact SG-CE1 3.5Å; C584-H597 PolarHBondContact SG-NE2 3.47Å; C584-H601 WeakPolarHBondContact CB-NE2 3.44Å; C584-H601 PolarHBondContact SG-NE2 2.71Å
585	G	73.3	Confident	69.8	Low	54 Å²	54	81.3 Å²	81.3	56%	0.557	45%	0.446	S	S	*	.			trans	59.8	0.7	174.5	0	0	0	0	0	118.1	S587	G585-S587 PolarHBondContact O-N 3.45Å
586	K	75.1	Confident	71.2	Confident	114 Å²	114	80.7 Å²	80.7	50%	0.496	45%	0.446	S	S	.	.			trans	-67.2	124.1	-170.1	-71.9	174.3	-170	170.7	0	112.1	C579 C584 Y588	C579-K586 HydrophobicContact CB-CB 4.46Å; C579-K586 WeakPolarHBondContact CB-O 3.29Å; C579-K586 PolarHBondContact N-O 3.38Å; C584-K586 PolarHBondContact O-N 3.02Å; K586-Y588 HydrophobicContact CB-CE2 3.56Å; K586-Y588 WeakPolarHBondContact O-CD2 3.44Å; K586-Y588 VanDerWaalsContact O-CE2 3.29Å; K586-Y588 WeakPolarHBondContact O-CE2 3.31Å
587	S	71.4	Confident	72.3	Confident	66 Å²	66	71 Å²	71	46%	0.462	41%	0.41	S	S	.	.	B	Isolated β-bridge	trans	-87.5	149.1	173.3	65.1	0	0	0	0	112	G585	G585-S587 PolarHBondContact O-N 3.45Å
588	Y	73.5	Confident	72.7	Confident	56 Å²	56	72.1 Å²	72.1	22%	0.22	42%	0.416	C	S	.	.			trans	-130.2	141.8	-177.3	-71.5	-83.5	0	0	0	113.1	N577 K586 S590 K593 L594 H597	N577-Y588 WeakPolarHBondContact CB-O 3.49Å; N577-Y588 PolarHBondContact O-N 2.78Å; K586-Y588 HydrophobicContact CB-CE2 3.56Å; K586-Y588 WeakPolarHBondContact O-CD2 3.44Å; K586-Y588 VanDerWaalsContact O-CE2 3.29Å; K586-Y588 WeakPolarHBondContact O-CE2 3.31Å; Y588-S590 PolarHBondContact O-N 3.35Å; Y588-S590 VanDerWaalsContact O-N 3.1Å; Y588-K593 HydrophobicContact CD1-CB 3.65Å; Y588-K593 HydrophobicContact CG-CB 4.2Å; Y588-L594 HydrophobicContact CD2-CB 4.04Å; Y588-L594 HydrophobicContact CD2-CD1 3.94Å; Y588-L594 HydrophobicContact CE2-CD1 4.35Å; Y588-L594 HydrophobicContact CG-CB 4.18Å; Y588-H597 HydrophobicContact CE1-CB 4.12Å; Y588-H597 HydrophobicContact CE2-CB 3.96Å; Y588-H597 AromaticContact CE2-CD2 3.16Å; Y588-H597 WeakPolarHBondContact CE2-CD2 3.45Å; Y588-H597 AromaticContact CE2-CG 3.76Å; Y588-H597 AromaticContact CE2-NE2 3.99Å; Y588-H597 AromaticContact CZ-CD2 3.45Å; Y588-H597 VanDerWaalsContact CZ-CD2 3.45Å; Y588-H597 AromaticContact CZ-CG 3.56Å; Y588-H597 PolarHBondContact OH-CD2 3.19Å; Y588-H597 VanDerWaalsContact OH-CD2 3.22Å
589	S	64.7	Low	73	Confident	54 Å²	54	71.8 Å²	71.8	38%	0.378	41%	0.408	S	S	.	.	S	Bend	trans	-68.4	-2.8	175.8	33.2	0	0	0	0	114.6	K593	S589-K593 PolarHBondContact OG-NZ 3.42Å
590	S	69.1	Low	72.8	Confident	38 Å²	38	74.7 Å²	74.7	27%	0.266	43%	0.428	S	S	.	.	S	Bend	trans	-165.9	153.6	171.5	61	0	0	0	0	112.1	Y588 S592 K593 L594	Y588-S590 PolarHBondContact O-N 3.35Å; Y588-S590 VanDerWaalsContact O-N 3.1Å; S590-S592 PolarHBondContact O-N 3.28Å; S590-K593 PolarHBondContact O-N 2.96Å; S590-K593 WeakPolarHBondContact OG-CG 3.46Å; S590-K593 PolarHBondContact OG-N 3.14Å; S590-L594 PolarHBondContact O-N 2.96Å; S590-L594 VanDerWaalsContact O-N 3.13Å
591	Y	70.3	Confident	73.1	Confident	136 Å²	136	71.3 Å²	71.3	53%	0.533	40%	0.403	S	S	.	.	H	α-helix	trans	-54.9	-37.4	173.6	-178.9	-101.2	0	0	0	112.4	N577 K593 L594 K595	N577-Y591 WeakPolarHBondContact OD1-CA 3.39Å; N577-Y591 VanDerWaalsContact OD1-CB 3.26Å; N577-Y591 WeakPolarHBondContact OD1-CB 3.31Å; N577-Y591 PolarHBondContact OD1-N 3.29Å; N577-Y591 VanDerWaalsContact OD1-N 3.1Å; Y591-K593 VanDerWaalsContact C-N 3.29Å; Y591-K593 PolarHBondContact O-N 3.02Å; Y591-L594 PolarHBondContact O-N 3.32Å; Y591-K595 HydrophobicContact CE1-CB 4.36Å; Y591-K595 HydrophobicContact CE1-CD 3.81Å; Y591-K595 WeakPolarHBondContact O-CB 3.47Å; Y591-K595 PolarHBondContact O-N 3.19Å
592	S	71.3	Confident	72.9	Confident	91 Å²	91	72.9 Å²	72.9	64%	0.636	41%	0.413	S	S	*	.	H	α-helix	trans	-61.3	-35	177.3	-48.2	0	0	0	0	113.1	S590 L596	S590-S592 PolarHBondContact O-N 3.28Å; S592-L596 WeakPolarHBondContact O-CB 3.46Å; S592-L596 PolarHBondContact O-N 3.45Å; S592-L596 VanDerWaalsContact O-N 3.13Å
593	K	72.9	Confident	72.7	Confident	107 Å²	107	70 Å²	70	47%	0.465	39%	0.394	S	S	.	.	H	α-helix	trans	-76.7	-38.8	175.1	-68.1	176.9	-175	178	0	111.6	Y588 S589 S590 Y591 L596 H597	Y588-K593 HydrophobicContact CD1-CB 3.65Å; Y588-K593 HydrophobicContact CG-CB 4.2Å; S589-K593 PolarHBondContact OG-NZ 3.42Å; S590-K593 PolarHBondContact O-N 2.96Å; S590-K593 WeakPolarHBondContact OG-CG 3.46Å; S590-K593 PolarHBondContact OG-N 3.14Å; Y591-K593 VanDerWaalsContact C-N 3.29Å; Y591-K593 PolarHBondContact O-N 3.02Å; K593-L596 WeakPolarHBondContact O-CB 3.28Å; K593-L596 PolarHBondContact O-N 3.16Å; K593-H597 PolarHBondContact O-N 3.32Å
594	L	77.3	Confident	72.3	Confident	14 Å²	14	68.1 Å²	68.1	7%	0.073	36%	0.36	C	S	.	.	H	α-helix	trans	-58.9	-49.3	171.3	173.2	59.9	0	0	0	111	N577 C579 Y588 S590 Y591 L596 H597 L598	N577-L594 HydrophobicContact CB-CB 4.36Å; N577-L594 HydrophobicContact CB-CD2 4.14Å; C579-L594 HydrophobicContact CB-CD1 3.91Å; Y588-L594 HydrophobicContact CD2-CB 4.04Å; Y588-L594 HydrophobicContact CD2-CD1 3.94Å; Y588-L594 HydrophobicContact CE2-CD1 4.35Å; Y588-L594 HydrophobicContact CG-CB 4.18Å; S590-L594 PolarHBondContact O-N 2.96Å; S590-L594 VanDerWaalsContact O-N 3.13Å; Y591-L594 PolarHBondContact O-N 3.32Å; L594-L596 VanDerWaalsContact C-N 3.27Å; L594-L596 PolarHBondContact O-N 2.99Å; L594-H597 CarbonylContact O-C 3.55Å; L594-H597 WeakPolarHBondContact O-CA 3.41Å; L594-H597 WeakPolarHBondContact O-CB 3.19Å; L594-H597 PolarHBondContact O-N 3.02Å; L594-L598 HydrophobicContact CD1-CD1 4.32Å; L594-L598 HydrophobicContact CD1-CD2 4.27Å; L594-L598 HydrophobicContact CD1-CG 4.03Å; L594-L598 HydrophobicContact CG-CD1 4.15Å; L594-L598 HydrophobicContact CG-CG 4.33Å; L594-L598 WeakPolarHBondContact O-CG 3.41Å; L594-L598 PolarHBondContact O-N 3.38Å
595	K	75.1	Confident	72	Confident	116 Å²	116	70.7 Å²	70.7	50%	0.504	37%	0.369	S	S	.	.	H	α-helix	trans	-63.2	-29.7	177.9	-170.9	164.1	-174.9	164.6	0	113.2	Y591	Y591-K595 HydrophobicContact CE1-CB 4.36Å; Y591-K595 HydrophobicContact CE1-CD 3.81Å; Y591-K595 WeakPolarHBondContact O-CB 3.47Å; Y591-K595 PolarHBondContact O-N 3.19Å
596	L	77.1	Confident	71.9	Confident	68 Å²	68	74.4 Å²	74.4	36%	0.356	37%	0.367	S	S	.	.	H	α-helix	trans	-70.6	-36.2	170.8	-171.7	66.4	0	0	0	112	S592 K593 L594 Q620	S592-L596 WeakPolarHBondContact O-CB 3.46Å; S592-L596 PolarHBondContact O-N 3.45Å; S592-L596 VanDerWaalsContact O-N 3.13Å; K593-L596 WeakPolarHBondContact O-CB 3.28Å; K593-L596 PolarHBondContact O-N 3.16Å; L594-L596 VanDerWaalsContact C-N 3.27Å; L594-L596 PolarHBondContact O-N 2.99Å; L596-Q620 HydrophobicContact CD1-CG 3.97Å
597	H	78.7	Confident	71.9	Confident	17 Å²	17	72.5 Å²	72.5	8%	0.079	36%	0.357	C	S	.	.	H	α-helix	trans	-74.4	-38.5	176.4	165.3	45.6	0	0	0	113.4	C579 C584 Y588 K593 L594 R599 S600 H601	C579-H597 WeakPolarHBondContact CB-NE2 3.03Å; C579-H597 PolarHBondContact SG-NE2 3.06Å; C584-H597 VanDerWaalsContact SG-CE1 3.5Å; C584-H597 PolarHBondContact SG-NE2 3.47Å; Y588-H597 HydrophobicContact CE1-CB 4.12Å; Y588-H597 HydrophobicContact CE2-CB 3.96Å; Y588-H597 AromaticContact CE2-CD2 3.16Å; Y588-H597 WeakPolarHBondContact CE2-CD2 3.45Å; Y588-H597 AromaticContact CE2-CG 3.76Å; Y588-H597 AromaticContact CE2-NE2 3.99Å; Y588-H597 AromaticContact CZ-CD2 3.45Å; Y588-H597 VanDerWaalsContact CZ-CD2 3.45Å; Y588-H597 AromaticContact CZ-CG 3.56Å; Y588-H597 PolarHBondContact OH-CD2 3.19Å; Y588-H597 VanDerWaalsContact OH-CD2 3.22Å; K593-H597 PolarHBondContact O-N 3.32Å; L594-H597 CarbonylContact O-C 3.55Å; L594-H597 WeakPolarHBondContact O-CA 3.41Å; L594-H597 WeakPolarHBondContact O-CB 3.19Å; L594-H597 PolarHBondContact O-N 3.02Å; H597-R599 PolarHBondContact O-N 3.43Å; H597-S600 PolarHBondContact ND1-OG 3.36Å; H597-S600 VanDerWaalsContact ND1-OG 3.1Å; H597-S600 WeakPolarHBondContact O-CB 2.93Å; H597-S600 PolarHBondContact O-N 2.82Å; H597-S600 PolarHBondContact O-OG 3.17Å; H597-H601 AromaticContact CE1-CD2 3.77Å; H597-H601 AromaticContact CE1-NE2 4Å; H597-H601 AromaticContact NE2-CD2 3.97Å
598	L	74	Confident	72.2	Confident	60 Å²	60	72.6 Å²	72.6	31%	0.314	36%	0.355	S	S	.	.	H	α-helix	trans	-56.6	-26.1	179	-70.1	171.2	0	0	0	112.7	L594 S600 H601 K602	L594-L598 HydrophobicContact CD1-CD1 4.32Å; L594-L598 HydrophobicContact CD1-CD2 4.27Å; L594-L598 HydrophobicContact CD1-CG 4.03Å; L594-L598 HydrophobicContact CG-CD1 4.15Å; L594-L598 HydrophobicContact CG-CG 4.33Å; L594-L598 WeakPolarHBondContact O-CG 3.41Å; L594-L598 PolarHBondContact O-N 3.38Å; L598-S600 VanDerWaalsContact C-N 3.28Å; L598-S600 PolarHBondContact O-N 2.85Å; L598-H601 PolarHBondContact O-N 2.86Å; L598-K602 PolarHBondContact O-N 3.03Å
599	R	78.5	Confident	72.5	Confident	55 Å²	55	70.4 Å²	70.4	21%	0.208	35%	0.348	C	S	.	.	H	α-helix	trans	-63.1	-25.4	170.9	-62.8	177.8	177.9	176.8	-3.5	114.5	H597 H601 C603 E604 Y606 Y607 T619	H597-R599 PolarHBondContact O-N 3.43Å; R599-H601 VanDerWaalsContact C-N 3.35Å; R599-C603 PolarHBondContact O-N 2.05Å; R599-C603 VanDerWaalsContact O-N 3.17Å; R599-E604 PolarHBondContact O-N 2.92Å; R599-E604 VanDerWaalsContact O-N 3.15Å; R599-Y606 HydrophobicContact CG-CE2 4.3Å; R599-Y607 PolarHBondContact NH1-OH 3.06Å; R599-Y607 VanDerWaalsContact NH1-OH 3.16Å; R599-T619 PolarHBondContact NH1-O 2.71Å
600	S	74.8	Confident	73.1	Confident	64 Å²	64	77.3 Å²	77.3	45%	0.448	37%	0.366	S	S	.	.	H	α-helix	trans	-73.7	-27.9	175.7	68.4	0	0	0	0	112.4	H597 L598	H597-S600 PolarHBondContact ND1-OG 3.36Å; H597-S600 VanDerWaalsContact ND1-OG 3.1Å; H597-S600 WeakPolarHBondContact O-CB 2.93Å; H597-S600 PolarHBondContact O-N 2.82Å; H597-S600 PolarHBondContact O-OG 3.17Å; L598-S600 VanDerWaalsContact C-N 3.28Å; L598-S600 PolarHBondContact O-N 2.85Å
601	H	76.9	Confident	73.4	Confident	59 Å²	59	80.5 Å²	80.5	27%	0.273	38%	0.375	S	S	.	.	H	α-helix	trans	-76.1	-40.6	174.9	-66	-55.6	0	0	0	112.1	C579 Y581 C584 H597 L598 R599 C603	C579-H601 VanDerWaalsContact SG-CD2 3.6Å; Y581-H601 HydrophobicContact CD1-CB 4.33Å; Y581-H601 AromaticContact CD1-CE1 3.19Å; Y581-H601 WeakPolarHBondContact CD1-CE1 3.19Å; Y581-H601 AromaticContact CD1-CG 3.76Å; Y581-H601 AromaticContact CD1-ND1 3.35Å; Y581-H601 WeakPolarHBondContact CD1-ND1 3.25Å; Y581-H601 AromaticContact CD1-NE2 3.87Å; Y581-H601 HydrophobicContact CD2-CB 3.65Å; Y581-H601 AromaticContact CD2-CG 3.76Å; Y581-H601 HydrophobicContact CE1-CB 4.46Å; Y581-H601 AromaticContact CE1-CE1 3.25Å; Y581-H601 WeakPolarHBondContact CE1-CE1 3.35Å; Y581-H601 AromaticContact CE1-ND1 3.77Å; Y581-H601 HydrophobicContact CE2-CB 3.79Å; Y581-H601 HydrophobicContact CG-CB 3.93Å; Y581-H601 AromaticContact CG-CD2 3.73Å; Y581-H601 AromaticContact CG-CE1 3.76Å; Y581-H601 AromaticContact CG-CG 3.49Å; Y581-H601 VanDerWaalsContact CG-CG 3.49Å; Y581-H601 AromaticContact CG-ND1 3.61Å; Y581-H601 AromaticContact CZ-CE1 3.85Å; C584-H601 WeakPolarHBondContact CB-NE2 3.44Å; C584-H601 PolarHBondContact SG-NE2 2.71Å; H597-H601 AromaticContact CE1-CD2 3.77Å; H597-H601 AromaticContact CE1-NE2 4Å; H597-H601 AromaticContact NE2-CD2 3.97Å; L598-H601 PolarHBondContact O-N 2.86Å; R599-H601 VanDerWaalsContact C-N 3.35Å; H601-C603 VanDerWaalsContact C-N 3.26Å; H601-C603 PolarHBondContact O-N 2.7Å
602	K	68.3	Low	73.6	Confident	148 Å²	148	79.8 Å²	79.8	64%	0.643	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.7	1.8	177.1	-58.6	-168.8	172.9	-163.8	0	114.4	L598 E604	L598-K602 PolarHBondContact O-N 3.03Å; K602-E604 HydrophobicContact CB-CG 3.59Å; K602-E604 HydrophobicContact CD-CG 4.47Å; K602-E604 WeakPolarHBondContact CD-OE1 3.49Å; K602-E604 IonicContact NZ-OE1 2.79Å; K602-E604 PolarHBondContact O-N 3.07Å
603	C	62.4	Low	73.8	Confident	39 Å²	39	78.9 Å²	78.9	26%	0.264	39%	0.392	S	S	.	.	T	Hydrogen-bonded Turn	trans	44.9	26.6	-169.7	-92.8	0	0	0	0	115.6	C36 R599 H601 K605	C36-C603 WeakPolarHBondContact CB-SG 3.24Å; C36-C603 WeakPolarHBondContact SG-CB 3.21Å; C36-C603 CovalentContact SG-SG 2.05Å; C36-C603 PolarHBondContact SG-SG 2.99Å; R599-C603 PolarHBondContact O-N 2.05Å; R599-C603 VanDerWaalsContact O-N 3.17Å; H601-C603 VanDerWaalsContact C-N 3.26Å; H601-C603 PolarHBondContact O-N 2.7Å; C603-K605 PolarHBondContact O-N 3.13Å
604	E	59.4	Low	74.1	Confident	55 Å²	55	76 Å²	76	26%	0.257	39%	0.385	S	S	.	.			trans	-72	99.5	-169.9	-72.6	168.5	169.2	0	0	112.7	R599 K602 Y606	R599-E604 PolarHBondContact O-N 2.92Å; R599-E604 VanDerWaalsContact O-N 3.15Å; K602-E604 HydrophobicContact CB-CG 3.59Å; K602-E604 HydrophobicContact CD-CG 4.47Å; K602-E604 WeakPolarHBondContact CD-OE1 3.49Å; K602-E604 IonicContact NZ-OE1 2.79Å; K602-E604 PolarHBondContact O-N 3.07Å; E604-Y606 HydrophobicContact CB-CD2 3.91Å; E604-Y606 HydrophobicContact CB-CE2 3.38Å; E604-Y606 HydrophobicContact CG-CE2 4.08Å; E604-Y606 PolarHBondContact O-N 2.81Å; E604-Y606 PolarHBondContact OE1-OH 3.23Å; E604-Y606 WeakPolarHBondContact OE2-CE2 3.08Å; E604-Y606 PolarHBondContact OE2-OH 2.74Å
605	K	68.2	Low	73.9	Confident	74 Å²	74	81.5 Å²	81.5	32%	0.322	41%	0.414	S	S	.	.			trans	-91	61.8	-176.4	-70.8	174.7	-179	-176.7	0	113.4	C603 Y607 T617 F618 T619	C603-K605 PolarHBondContact O-N 3.13Å; K605-Y607 VanDerWaalsContact C-N 3.28Å; K605-Y607 PolarHBondContact O-N 3.48Å; K605-T617 WeakPolarHBondContact CB-OG1 3.16Å; K605-T617 WeakPolarHBondContact CD-OG1 3.4Å; K605-F618 CarbonylContact C-O 3.16Å; K605-F618 VanDerWaalsContact CA-O 3.31Å; K605-F618 WeakPolarHBondContact CA-O 3.17Å; K605-T619 HydrophobicContact CG-CG2 4.01Å
606	Y	71.7	Confident	74.2	Confident	132 Å²	132	76.9 Å²	76.9	52%	0.518	40%	0.397	S	S	.	.			trans	-58.5	-23.7	-175.9	-66.9	-74.1	0	0	0	117	R599 E604 F618	R599-Y606 HydrophobicContact CG-CE2 4.3Å; E604-Y606 HydrophobicContact CB-CD2 3.91Å; E604-Y606 HydrophobicContact CB-CE2 3.38Å; E604-Y606 HydrophobicContact CG-CE2 4.08Å; E604-Y606 PolarHBondContact O-N 2.81Å; E604-Y606 PolarHBondContact OE1-OH 3.23Å; E604-Y606 WeakPolarHBondContact OE2-CE2 3.08Å; E604-Y606 PolarHBondContact OE2-OH 2.74Å; Y606-F618 PolarHBondContact N-O 2.99Å
607	Y	75.2	Confident	74.3	Confident	73 Å²	73	76.3 Å²	76.3	29%	0.286	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	114.9	-172.8	-54.7	-88.1	0	0	0	110.2	R599 K605 T617 F618 T619 Q620 L621 V624	R599-Y607 PolarHBondContact NH1-OH 3.06Å; R599-Y607 VanDerWaalsContact NH1-OH 3.16Å; K605-Y607 VanDerWaalsContact C-N 3.28Å; K605-Y607 PolarHBondContact O-N 3.48Å; Y607-T617 CarbonylContact O-C 3.58Å; Y607-T617 WeakPolarHBondContact O-CA 3.48Å; Y607-F618 WeakPolarHBondContact CD2-O 3.4Å; Y607-F618 PolarHBondContact N-O 3.42Å; Y607-F618 PolarHBondContact O-N 2.79Å; Y607-T619 WeakPolarHBondContact CE2-O 3.29Å; Y607-Q620 VanDerWaalsContact CD2-C 3.43Å; Y607-L621 HydrophobicContact CD1-CB 3.92Å; Y607-L621 HydrophobicContact CD1-CD1 4.09Å; Y607-L621 HydrophobicContact CE1-CB 3.91Å; Y607-L621 HydrophobicContact CG-CB 4.4Å; Y607-V624 WeakPolarHBondContact O-CG2 3.49Å
608	V	77.3	Confident	74.1	Confident	69 Å²	69	76.2 Å²	76.2	42%	0.418	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	141.2	179.3	-167.6	0	0	0	0	110.1	T617	V608-T617 HydrophobicContact CG1-CG2 4.27Å; V608-T617 HydrophobicContact CG2-CG2 4.08Å
609	C	79.9	Confident	74.1	Confident	9 Å²	9	75.5 Å²	75.5	6%	0.061	40%	0.395	C	S	.	.			trans	-63.3	136.8	170.6	-178.5	0	0	0	0	111.5	A616 H627 H631	C609-A616 HydrophobicContact CB-CB 4.34Å; C609-A616 PolarHBondContact N-O 3.08Å; C609-H627 PolarHBondContact SG-CD2 3.4Å; C609-H627 PolarHBondContact SG-NE2 3.36Å; C609-H627 VanDerWaalsContact SG-NE2 3.45Å; C609-H631 PolarHBondContact SG-NE2 2.99Å
610	R	76.9	Confident	73.8	Confident	200 Å²	200	76.5 Å²	76.5	76%	0.755	40%	0.402	S	S	*	.			trans	-81.4	-9.7	-178.2	-67.9	178.9	168.4	-167	-6.2	115.1	E628	R610-E628 PolarHBondContact N-OE1 2.92Å; R610-E628 VanDerWaalsContact N-OE1 3.16Å
611	K	75.3	Confident	73.8	Confident	104 Å²	104	77.3 Å²	77.3	45%	0.452	40%	0.401	S	S	.	.	S	Bend	trans	-73.9	128.5	-179.3	-172.5	171	-177.4	175.4	0	111.2	G613 C614 H631	K611-G613 PolarHBondContact O-N 3.47Å; K611-C614 PolarHBondContact O-N 3.37Å; K611-H631 WeakPolarHBondContact CB-CD2 3.33Å; K611-H631 HydrophobicContact CD-CB 3.59Å; K611-H631 WeakPolarHBondContact CD-CD2 3.43Å
612	P	74.7	Confident	73.4	Confident	122 Å²	122	77.5 Å²	77.5	79%	0.792	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.6	136	174.2	-29	36	0	0	0	112.7	C614	P612-C614 VanDerWaalsContact C-N 3.29Å; P612-C614 PolarHBondContact O-N 3.44Å
613	G	75.8	Confident	73.6	Confident	72 Å²	72	71.4 Å²	71.4	74%	0.742	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.2	-9.6	177.3	0	0	0	0	0	116.3	K611	K611-G613 PolarHBondContact O-N 3.47Å
614	C	78.4	Confident	74.3	Confident	46 Å²	46	69.8 Å²	69.8	31%	0.311	38%	0.376	S	S	.	.			trans	-81.6	-34.8	-176.1	-163.9	0	0	0	0	114.6	K611 P612 A616 H627 H631	K611-C614 PolarHBondContact O-N 3.37Å; P612-C614 VanDerWaalsContact C-N 3.29Å; P612-C614 PolarHBondContact O-N 3.44Å; C614-A616 PolarHBondContact O-N 3.32Å; C614-H627 PolarHBondContact SG-CE1 2.79Å; C614-H627 PolarHBondContact SG-NE2 3.1Å; C614-H631 PolarHBondContact SG-CE1 3.13Å
615	N	74.1	Confident	74.9	Confident	129 Å²	129	73.5 Å²	73.5	69%	0.69	39%	0.388	S	S	*	.			trans	52.5	11	178	-60.1	-15.5	0	0	0	116.8
616	A	80	Confident	74.8	Confident	19 Å²	19	72.1 Å²	72.1	16%	0.157	39%	0.387	C	S	.	.			trans	-73.9	131.2	-174.8	0	0	0	0	0	111.5	C609 C614 F618 H627	C609-A616 HydrophobicContact CB-CB 4.34Å; C609-A616 PolarHBondContact N-O 3.08Å; C614-A616 PolarHBondContact O-N 3.32Å; A616-F618 HydrophobicContact CB-CE2 3.72Å; A616-F618 HydrophobicContact CB-CZ 4.07Å; A616-H627 VanDerWaalsContact CB-CE1 3.47Å; A616-H627 WeakPolarHBondContact CB-CE1 3.29Å; A616-H627 WeakPolarHBondContact CB-NE2 3.36Å
617	T	79.6	Confident	75.2	Confident	57 Å²	57	66.8 Å²	66.8	35%	0.35	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	146.1	-175.3	64.8	0	0	0	0	112.2	K605 Y607 V608	K605-T617 WeakPolarHBondContact CB-OG1 3.16Å; K605-T617 WeakPolarHBondContact CD-OG1 3.4Å; Y607-T617 CarbonylContact O-C 3.58Å; Y607-T617 WeakPolarHBondContact O-CA 3.48Å; V608-T617 HydrophobicContact CG1-CG2 4.27Å; V608-T617 HydrophobicContact CG2-CG2 4.08Å
618	F	73.9	Confident	75.1	Confident	14 Å²	14	66.1 Å²	66.1	6%	0.061	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	147.8	-169.1	-58.1	-99.4	0	0	0	111.7	Y39 K605 Y606 Y607 A616 Q620 G623 V624 H627	Y39-F618 HydrophobicContact CD2-CE1 4.29Å; Y39-F618 AromaticContact CE2-CD1 3.98Å; Y39-F618 HydrophobicContact CE2-CD1 3.98Å; Y39-F618 AromaticContact CE2-CE1 3.35Å; Y39-F618 HydrophobicContact CE2-CE1 3.35Å; Y39-F618 HydrophobicContact CE2-CZ 4.1Å; Y39-F618 AromaticContact CZ-CE1 3.51Å; Y39-F618 AromaticContact CZ-CZ 3.89Å; Y39-F618 WeakPolarHBondContact OH-CE1 3.5Å; Y39-F618 WeakPolarHBondContact OH-CZ 3.39Å; K605-F618 CarbonylContact C-O 3.16Å; K605-F618 VanDerWaalsContact CA-O 3.31Å; K605-F618 WeakPolarHBondContact CA-O 3.17Å; Y606-F618 PolarHBondContact N-O 2.99Å; Y607-F618 WeakPolarHBondContact CD2-O 3.4Å; Y607-F618 PolarHBondContact N-O 3.42Å; Y607-F618 PolarHBondContact O-N 2.79Å; A616-F618 HydrophobicContact CB-CE2 3.72Å; A616-F618 HydrophobicContact CB-CZ 4.07Å; F618-Q620 VanDerWaalsContact C-N 3.27Å; F618-Q620 PolarHBondContact O-N 3.29Å; F618-G623 VanDerWaalsContact CD1-C 3.46Å; F618-V624 HydrophobicContact CB-CG2 4.12Å; F618-V624 HydrophobicContact CD2-CB 4.3Å; F618-V624 HydrophobicContact CD2-CG2 3.34Å; F618-V624 HydrophobicContact CE2-CG2 4.03Å; F618-V624 HydrophobicContact CG-CG2 3.94Å; F618-H627 HydrophobicContact CE1-CB 3.87Å; F618-H627 HydrophobicContact CE2-CB 4.03Å; F618-H627 AromaticContact CE2-CD2 3.85Å; F618-H627 AromaticContact CE2-CG 3.88Å; F618-H627 HydrophobicContact CZ-CB 3.3Å; F618-H627 AromaticContact CZ-CD2 3.8Å; F618-H627 AromaticContact CZ-CG 3.34Å; F618-H627 AromaticContact CZ-ND1 3.77Å
619	T	75.6	Confident	74.8	Confident	46 Å²	46	63.9 Å²	63.9	28%	0.282	35%	0.352	S	S	.	.	S	Bend	trans	-75.5	-14.6	174.3	54.9	0	0	0	0	113.3	R599 K605 Y607	R599-T619 PolarHBondContact NH1-O 2.71Å; K605-T619 HydrophobicContact CG-CG2 4.01Å; Y607-T619 WeakPolarHBondContact CE2-O 3.29Å
620	Q	71.3	Confident	74.5	Confident	76 Å²	76	65.3 Å²	65.3	36%	0.355	36%	0.363	S	S	.	.	S	Bend	trans	-142.5	144.9	-177.5	-51.4	-169.8	8.5	0	0	112.7	L596 Y607 F618 S622 G623 V624	L596-Q620 HydrophobicContact CD1-CG 3.97Å; Y607-Q620 VanDerWaalsContact CD2-C 3.43Å; F618-Q620 VanDerWaalsContact C-N 3.27Å; F618-Q620 PolarHBondContact O-N 3.29Å; Q620-S622 VanDerWaalsContact CB-OG 3.28Å; Q620-S622 WeakPolarHBondContact CB-OG 3.42Å; Q620-S622 PolarHBondContact O-N 2.97Å; Q620-S622 PolarHBondContact OE1-OG 3.47Å; Q620-S622 VanDerWaalsContact OE1-OG 3.14Å; Q620-G623 WeakPolarHBondContact O-CA 3.48Å; Q620-G623 PolarHBondContact O-N 2.8Å; Q620-V624 PolarHBondContact O-N 3.44Å
621	L	74.5	Confident	74.5	Confident	81 Å²	81	57.3 Å²	57.3	42%	0.424	33%	0.334	S	S	.	.	H	α-helix	trans	-62.1	-28.3	176.3	-176.5	63.5	0	0	0	113.5	Y607 G623 V624 R625	Y607-L621 HydrophobicContact CD1-CB 3.92Å; Y607-L621 HydrophobicContact CD1-CD1 4.09Å; Y607-L621 HydrophobicContact CE1-CB 3.91Å; Y607-L621 HydrophobicContact CG-CB 4.4Å; L621-G623 PolarHBondContact O-N 3.11Å; L621-V624 PolarHBondContact O-N 2.96Å; L621-R625 WeakPolarHBondContact O-CG 3.48Å; L621-R625 PolarHBondContact O-N 3.49Å
622	S	68.6	Low	74	Confident	63 Å²	63	55.7 Å²	55.7	44%	0.441	33%	0.329	S	S	.	.	H	α-helix	trans	-59.4	-35.1	170.6	47.3	0	0	0	0	112.3	Q620 S626	Q620-S622 VanDerWaalsContact CB-OG 3.28Å; Q620-S622 WeakPolarHBondContact CB-OG 3.42Å; Q620-S622 PolarHBondContact O-N 2.97Å; Q620-S622 PolarHBondContact OE1-OG 3.47Å; Q620-S622 VanDerWaalsContact OE1-OG 3.14Å; S622-S626 WeakPolarHBondContact O-CB 3.38Å; S622-S626 PolarHBondContact O-N 2.78Å; S622-S626 PolarHBondContact O-OG 3.14Å
623	G	73.3	Confident	73	Confident	19 Å²	19	52 Å²	52	20%	0.196	31%	0.306	C	S	.	.	H	α-helix	trans	-65	-53.7	173.7	0	0	0	0	0	111.8	F618 Q620 L621 R625 S626 H627	F618-G623 VanDerWaalsContact CD1-C 3.46Å; Q620-G623 WeakPolarHBondContact O-CA 3.48Å; Q620-G623 PolarHBondContact O-N 2.8Å; L621-G623 PolarHBondContact O-N 3.11Å; G623-R625 PolarHBondContact O-N 2.99Å; G623-S626 PolarHBondContact O-N 2.97Å; G623-H627 WeakPolarHBondContact O-CB 3.42Å; G623-H627 PolarHBondContact O-N 3.15Å
624	V	77	Confident	71.4	Confident	5 Å²	5	54.1 Å²	54.1	3%	0.03	30%	0.299	C	S	.	.	H	α-helix	trans	-54	-51.8	175.4	166.4	0	0	0	0	111	Y607 F618 Q620 L621 S626 H627 E628	Y607-V624 WeakPolarHBondContact O-CG2 3.49Å; F618-V624 HydrophobicContact CB-CG2 4.12Å; F618-V624 HydrophobicContact CD2-CB 4.3Å; F618-V624 HydrophobicContact CD2-CG2 3.34Å; F618-V624 HydrophobicContact CE2-CG2 4.03Å; F618-V624 HydrophobicContact CG-CG2 3.94Å; Q620-V624 PolarHBondContact O-N 3.44Å; L621-V624 PolarHBondContact O-N 2.96Å; V624-S626 VanDerWaalsContact C-N 3.33Å; V624-S626 PolarHBondContact O-N 3.27Å; V624-H627 CarbonylContact O-C 3.58Å; V624-H627 WeakPolarHBondContact O-CA 3.36Å; V624-H627 WeakPolarHBondContact O-CB 3.31Å; V624-H627 PolarHBondContact O-N 3.2Å; V624-E628 HydrophobicContact CG1-CG 3.97Å; V624-E628 WeakPolarHBondContact CG1-OE1 3.31Å; V624-E628 WeakPolarHBondContact CG1-OE2 3.26Å; V624-E628 WeakPolarHBondContact O-CG 3.44Å; V624-E628 PolarHBondContact O-N 2.82Å
625	R	71.8	Confident	69.6	Low	134 Å²	134	59.9 Å²	59.9	51%	0.506	32%	0.321	S	S	.	.	H	α-helix	trans	-57.4	-43.6	178.7	-72.6	176.3	173.8	-179.4	-3.9	112.8	L621 G623 H627 L629	L621-R625 WeakPolarHBondContact O-CG 3.48Å; L621-R625 PolarHBondContact O-N 3.49Å; G623-R625 PolarHBondContact O-N 2.99Å; R625-H627 PolarHBondContact O-N 2.96Å; R625-L629 WeakPolarHBondContact O-CG 3.48Å; R625-L629 PolarHBondContact O-N 2.91Å
626	S	66.7	Low	67.8	Low	44 Å²	44	59.8 Å²	59.8	31%	0.308	32%	0.315	S	S	.	.	H	α-helix	trans	-64.9	-25.2	177.6	-57.9	0	0	0	0	113.2	S622 G623 V624	S622-S626 WeakPolarHBondContact O-CB 3.38Å; S622-S626 PolarHBondContact O-N 2.78Å; S622-S626 PolarHBondContact O-OG 3.14Å; G623-S626 PolarHBondContact O-N 2.97Å; V624-S626 VanDerWaalsContact C-N 3.33Å; V624-S626 PolarHBondContact O-N 3.27Å
627	H	79.2	Confident	65.6	Low	21 Å²	21	64.1 Å²	64.1	10%	0.097	34%	0.344	C	S	.	.	H	α-helix	trans	-92.7	-36.9	-178.7	164.5	88.6	0	0	0	112.6	C609 C614 A616 F618 G623 V624 R625 L629 S630 H631	C609-H627 PolarHBondContact SG-CD2 3.4Å; C609-H627 PolarHBondContact SG-NE2 3.36Å; C609-H627 VanDerWaalsContact SG-NE2 3.45Å; C614-H627 PolarHBondContact SG-CE1 2.79Å; C614-H627 PolarHBondContact SG-NE2 3.1Å; A616-H627 VanDerWaalsContact CB-CE1 3.47Å; A616-H627 WeakPolarHBondContact CB-CE1 3.29Å; A616-H627 WeakPolarHBondContact CB-NE2 3.36Å; F618-H627 HydrophobicContact CE1-CB 3.87Å; F618-H627 HydrophobicContact CE2-CB 4.03Å; F618-H627 AromaticContact CE2-CD2 3.85Å; F618-H627 AromaticContact CE2-CG 3.88Å; F618-H627 HydrophobicContact CZ-CB 3.3Å; F618-H627 AromaticContact CZ-CD2 3.8Å; F618-H627 AromaticContact CZ-CG 3.34Å; F618-H627 AromaticContact CZ-ND1 3.77Å; G623-H627 WeakPolarHBondContact O-CB 3.42Å; G623-H627 PolarHBondContact O-N 3.15Å; V624-H627 CarbonylContact O-C 3.58Å; V624-H627 WeakPolarHBondContact O-CA 3.36Å; V624-H627 WeakPolarHBondContact O-CB 3.31Å; V624-H627 PolarHBondContact O-N 3.2Å; R625-H627 PolarHBondContact O-N 2.96Å; H627-L629 PolarHBondContact O-N 3.17Å; H627-S630 WeakPolarHBondContact O-CA 3.34Å; H627-S630 WeakPolarHBondContact O-CB 3.48Å; H627-S630 PolarHBondContact O-N 3.34Å; H627-S630 PolarHBondContact O-OG 3.23Å; H627-H631 AromaticContact CD2-NE2 3.8Å; H627-H631 AromaticContact CE1-CE1 3.63Å; H627-H631 AromaticContact CE1-NE2 3.96Å; H627-H631 AromaticContact NE2-CE1 3.39Å; H627-H631 PolarHBondContact NE2-CE1 2.88Å; H627-H631 AromaticContact NE2-NE2 3.25Å; H627-H631 PolarHBondContact NE2-NE2 2.82Å
628	E	74.2	Confident	63.3	Low	59 Å²	59	66.9 Å²	66.9	28%	0.276	37%	0.365	S	S	.	.	H	α-helix	trans	-60.2	-34.4	173	-74.2	174	154.6	0	0	110.7	R610 V624 S630 H631	R610-E628 PolarHBondContact N-OE1 2.92Å; R610-E628 VanDerWaalsContact N-OE1 3.16Å; V624-E628 HydrophobicContact CG1-CG 3.97Å; V624-E628 WeakPolarHBondContact CG1-OE1 3.31Å; V624-E628 WeakPolarHBondContact CG1-OE2 3.26Å; V624-E628 WeakPolarHBondContact O-CG 3.44Å; V624-E628 PolarHBondContact O-N 2.82Å; E628-S630 VanDerWaalsContact C-N 3.25Å; E628-S630 PolarHBondContact O-N 2.79Å; E628-H631 WeakPolarHBondContact O-CB 3.26Å; E628-H631 PolarHBondContact O-N 2.83Å; E628-H631 VanDerWaalsContact O-N 3.1Å
629	L	70	Confident	61.3	Low	22 Å²	22	74 Å²	74	12%	0.115	40%	0.399	C	S	.	.	H	α-helix	trans	-60.4	-29.9	168.8	-67	168	0	0	0	113.7	R625 H627 H631 I632 S633 L732 T746	R625-L629 WeakPolarHBondContact O-CG 3.48Å; R625-L629 PolarHBondContact O-N 2.91Å; H627-L629 PolarHBondContact O-N 3.17Å; L629-H631 PolarHBondContact O-N 2.76Å; L629-I632 PolarHBondContact O-N 2.67Å; L629-S633 WeakPolarHBondContact O-CB 3.47Å; L629-S633 PolarHBondContact O-N 3.28Å; L629-S633 VanDerWaalsContact O-N 3.11Å; L629-S633 PolarHBondContact O-OG 2.87Å; L629-L732 HydrophobicContact CD1-CB 3.97Å; L629-L732 HydrophobicContact CD2-CB 3.66Å; L629-L732 HydrophobicContact CG-CB 4.42Å; L629-T746 HydrophobicContact CB-CG2 3.79Å
630	S	73.8	Confident	59	Low	39 Å²	39	81.6 Å²	81.6	27%	0.273	42%	0.422	S	S	.	.	H	α-helix	trans	-65.4	-29.6	176.1	80.2	0	0	0	0	111.9	H627 E628 I632 S633 I634	H627-S630 WeakPolarHBondContact O-CA 3.34Å; H627-S630 WeakPolarHBondContact O-CB 3.48Å; H627-S630 PolarHBondContact O-N 3.34Å; H627-S630 PolarHBondContact O-OG 3.23Å; E628-S630 VanDerWaalsContact C-N 3.25Å; E628-S630 PolarHBondContact O-N 2.79Å; S630-I632 VanDerWaalsContact C-N 3.29Å; S630-I632 PolarHBondContact O-N 3.05Å; S630-S633 PolarHBondContact O-N 3.17Å; S630-I634 WeakPolarHBondContact O-CD1 3.43Å; S630-I634 WeakPolarHBondContact O-CG1 3.08Å; S630-I634 PolarHBondContact O-N 2.68Å
631	H	76.3	Confident	57.4	Low	32 Å²	32	82.1 Å²	82.1	15%	0.148	43%	0.427	C	S	.	.	H	α-helix	trans	-70.6	-24.6	178.5	-62.3	-25.9	0	0	0	114.5	C609 K611 C614 H627 E628 L629	C609-H631 PolarHBondContact SG-NE2 2.99Å; K611-H631 WeakPolarHBondContact CB-CD2 3.33Å; K611-H631 HydrophobicContact CD-CB 3.59Å; K611-H631 WeakPolarHBondContact CD-CD2 3.43Å; C614-H631 PolarHBondContact SG-CE1 3.13Å; H627-H631 AromaticContact CD2-NE2 3.8Å; H627-H631 AromaticContact CE1-CE1 3.63Å; H627-H631 AromaticContact CE1-NE2 3.96Å; H627-H631 AromaticContact NE2-CE1 3.39Å; H627-H631 PolarHBondContact NE2-CE1 2.88Å; H627-H631 AromaticContact NE2-NE2 3.25Å; H627-H631 PolarHBondContact NE2-NE2 2.82Å; E628-H631 WeakPolarHBondContact O-CB 3.26Å; E628-H631 PolarHBondContact O-N 2.83Å; E628-H631 VanDerWaalsContact O-N 3.1Å; L629-H631 PolarHBondContact O-N 2.76Å
632	I	66	Low	55.3	Low	70 Å²	70	84 Å²	84	36%	0.359	44%	0.438	S	S	.	.	H	α-helix	trans	-86.2	-30.9	174.6	-54.1	167.7	0	0	0	109.4	L629 S630 I634 M730	L629-I632 PolarHBondContact O-N 2.67Å; S630-I632 VanDerWaalsContact C-N 3.29Å; S630-I632 PolarHBondContact O-N 3.05Å; I632-I634 PolarHBondContact O-N 2.71Å; I632-M730 HydrophobicContact CG2-CE 4.03Å
633	S	53.3	Low	53.7	Low	43 Å²	43	89.1 Å²	89.1	30%	0.301	46%	0.455	S	S	.	.	H	α-helix	trans	-79.8	-11	-172.3	-57.6	0	0	0	0	115.7	L629 S630 H635 T746	L629-S633 WeakPolarHBondContact O-CB 3.47Å; L629-S633 PolarHBondContact O-N 3.28Å; L629-S633 VanDerWaalsContact O-N 3.11Å; L629-S633 PolarHBondContact O-OG 2.87Å; S630-S633 PolarHBondContact O-N 3.17Å; S633-H635 VanDerWaalsContact C-N 3.25Å; S633-H635 PolarHBondContact O-N 3.3Å; S633-T746 WeakPolarHBondContact OG-CG2 3.26Å
634	I	42.3	Very low	51.6	Low	118 Å²	118	94.9 Å²	94.9	61%	0.605	47%	0.471	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70	-17.9	-174.7	-75.2	158.5	0	0	0	113.3	S630 I632	S630-I634 WeakPolarHBondContact O-CD1 3.43Å; S630-I634 WeakPolarHBondContact O-CG1 3.08Å; S630-I634 PolarHBondContact O-N 2.68Å; I632-I634 PolarHBondContact O-N 2.71Å
635	H	39.3	Very low	49.2	Very low	167 Å²	167	99.4 Å²	99.4	77%	0.773	50%	0.501	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.6	-2.5	-172.7	-87.9	-84.8	0	0	0	117.1	S633	S633-H635 VanDerWaalsContact C-N 3.25Å; S633-H635 PolarHBondContact O-N 3.3Å
636	K	38.2	Very low	47.3	Very low	127 Å²	127	97.2 Å²	97.2	55%	0.552	50%	0.499	S	S	*	.			trans	-125.8	38.3	-172.4	-77.2	-168.3	170.3	-176.9	0	115.5	Y644	K636-Y644 PolarHBondContact NZ-OH 3.26Å
637	S	32.8	Very low	45.5	Very low	110 Å²	110	100.1 Å²	100.1	77%	0.769	52%	0.515	S	S	*	.	S	Bend	trans	-91.6	-10.2	179.4	54.8	0	0	0	0	115.5
638	S	32.3	Very low	43.1	Very low	115 Å²	115	106.9 Å²	106.9	80%	0.804	55%	0.548	S	S	*	.	S	Bend	trans	-134.3	-0.4	-166.4	-163.8	0	0	0	0	116.6
639	E	30.2	Very low	41.1	Very low	163 Å²	163	108.9 Å²	108.9	76%	0.762	56%	0.56	S	S	*	*	S	Bend	trans	-102.1	145.5	176.7	-69	-176.5	143.1	0	0	111.2
640	R	28.6	Very low	39.1	Very low	206 Å²	206	112.7 Å²	112.7	78%	0.777	58%	0.58	S	S	*	*			trans	-72.7	143.1	177.9	-56.9	168.3	75	124.6	5	109	D642	R640-D642 HydrophobicContact CB-CB 4.41Å; R640-D642 WeakPolarHBondContact CB-OD2 3.28Å; R640-D642 WeakPolarHBondContact CD-OD2 3.34Å; R640-D642 IonicContact CZ-OD2 3.83Å; R640-D642 IonicContact NE-OD2 2.86Å; R640-D642 PolarHBondContact NE-OD2 2.62Å; R640-D642 PolarHBondContact O-N 2.77Å; R640-D642 VanDerWaalsContact O-N 3.15Å
641	L	36.3	Very low	37	Very low	86 Å²	86	118.1 Å²	118.1	45%	0.45	61%	0.606	S	S	.	*	G	3₁₀ helix	trans	-81.3	12.3	-176.8	-125.4	155.1	0	0	0	113.3	Q643 Y644 G742	L641-Q643 PolarHBondContact O-N 3.26Å; L641-Y644 HydrophobicContact CD2-CD2 3.45Å; L641-Y644 VanDerWaalsContact CD2-CD2 3.45Å; L641-Y644 HydrophobicContact CD2-CE2 4.22Å; L641-Y644 HydrophobicContact CD2-CG 3.83Å; L641-Y644 PolarHBondContact O-N 3.46Å; L641-G742 WeakPolarHBondContact CD1-O 3.26Å
642	D	30.7	Very low	34.9	Very low	122 Å²	122	122 Å²	122	65%	0.652	63%	0.627	S	S	*	*	G	3₁₀ helix	trans	-59.9	-10	-177.4	-51.9	-15.7	0	0	0	113.5	R640	R640-D642 HydrophobicContact CB-CB 4.41Å; R640-D642 WeakPolarHBondContact CB-OD2 3.28Å; R640-D642 WeakPolarHBondContact CD-OD2 3.34Å; R640-D642 IonicContact CZ-OD2 3.83Å; R640-D642 IonicContact NE-OD2 2.86Å; R640-D642 PolarHBondContact NE-OD2 2.62Å; R640-D642 PolarHBondContact O-N 2.77Å; R640-D642 VanDerWaalsContact O-N 3.15Å
643	Q	36.4	Very low	33	Very low	170 Å²	170	126 Å²	126	79%	0.794	64%	0.642	S	S	*	*	G	3₁₀ helix	trans	-93.1	-5.5	-177.9	-163.7	56.4	54.7	0	0	114.8	L641	L641-Q643 PolarHBondContact O-N 3.26Å
644	Y	27.5	Very low	31.7	Very low	139 Å²	139	128 Å²	128	55%	0.545	67%	0.669	S	S	.	*	S	Bend	trans	-97.1	126.9	177.1	-84	-99.7	0	0	0	111.9	K636 L641 I646	K636-Y644 PolarHBondContact NZ-OH 3.26Å; L641-Y644 HydrophobicContact CD2-CD2 3.45Å; L641-Y644 VanDerWaalsContact CD2-CD2 3.45Å; L641-Y644 HydrophobicContact CD2-CE2 4.22Å; L641-Y644 HydrophobicContact CD2-CG 3.83Å; L641-Y644 PolarHBondContact O-N 3.46Å; Y644-I646 PolarHBondContact O-N 3.24Å
645	P	28	Very low	31.1	Very low	101 Å²	101	128 Å²	128	66%	0.656	68%	0.675	S	S	*	*			trans	-58.6	133.8	174.6	-24.9	34.7	0	0	0	112.2	T647	P645-T647 PolarHBondContact O-N 3.22Å
646	I	31.2	Very low	30.5	Very low	88 Å²	88	125.9 Å²	125.9	45%	0.451	68%	0.679	S	S	.	*	S	Bend	trans	-69.6	-14.7	-179.7	-66.6	167.4	0	0	0	112	Y644 M648 I649	Y644-I646 PolarHBondContact O-N 3.24Å; I646-M648 PolarHBondContact O-N 3.46Å; I646-I649 PolarHBondContact O-N 2.81Å
647	T	28.9	Very low	30	Very low	105 Å²	105	127.4 Å²	127.4	64%	0.644	69%	0.692	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.8	24.6	-167	63.3	0	0	0	0	116.7	P645	P645-T647 PolarHBondContact O-N 3.22Å
648	M	28.2	Very low	29.7	Very low	162 Å²	162	128.2 Å²	128.2	80%	0.798	69%	0.688	S	S	*	*	T	Hydrogen-bonded Turn	trans	-122.4	-4.9	166	-77.1	-166.8	176.6	0	0	113.2	I646	I646-M648 PolarHBondContact O-N 3.46Å
649	I	33.4	Very low	29.6	Very low	102 Å²	102	129.2 Å²	129.2	52%	0.523	69%	0.689	S	S	.	*	S	Bend	trans	-87.6	-32.8	-179.7	-61.8	177.6	0	0	0	111	I646 N651 I652	I646-I649 PolarHBondContact O-N 2.81Å; I649-N651 VanDerWaalsContact C-N 3.26Å; I649-N651 PolarHBondContact O-N 2.73Å; I649-I652 PolarHBondContact O-N 3.16Å
650	D	28.5	Very low	29.4	Very low	101 Å²	101	125.5 Å²	125.5	54%	0.54	68%	0.681	S	S	.	*	T	Hydrogen-bonded Turn	trans	-66.6	-26.3	-173.3	-47.8	-55.1	0	0	0	112.9	I652	D650-I652 PolarHBondContact O-N 2.68Å
651	N	28.9	Very low	29.5	Very low	153 Å²	153	123.1 Å²	123.1	82%	0.818	68%	0.679	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.1	3	178.4	-73.2	-8.8	0	0	0	114.8	I649	I649-N651 VanDerWaalsContact C-N 3.26Å; I649-N651 PolarHBondContact O-N 2.73Å
652	I	31.4	Very low	29.1	Very low	114 Å²	114	126 Å²	126	59%	0.585	69%	0.694	S	S	*	*	T	Hydrogen-bonded Turn	trans	-112.4	-23.9	178.2	-59.5	179.1	0	0	0	111.7	I649 D650	I649-I652 PolarHBondContact O-N 3.16Å; D650-I652 PolarHBondContact O-N 2.68Å
653	F	27.6	Very low	29	Very low	155 Å²	155	128.8 Å²	128.8	68%	0.68	70%	0.7	S	S	*	*			trans	-107.6	77.2	175.6	-77.4	-86	0	0	0	110.7	T655	F653-T655 PolarHBondContact O-N 3.34Å
654	G	24.5	Very low	28.3	Very low	85 Å²	85	127.3 Å²	127.3	88%	0.876	70%	0.697	S	S	*	*			trans	-69.6	66.7	176.3	0	0	0	0	0	113.7
655	T	29.5	Very low	28.3	Very low	117 Å²	117	127.2 Å²	127.2	72%	0.718	71%	0.706	S	S	*	*			trans	-130.9	105.8	171.5	51.5	0	0	0	0	109.4	F653 L657	F653-T655 PolarHBondContact O-N 3.34Å; T655-L657 PolarHBondContact O-N 3.35Å
656	S	26.4	Very low	28.1	Very low	122 Å²	122	126.5 Å²	126.5	85%	0.853	70%	0.703	S	S	*	*			trans	-58.9	132.9	173.4	-176.9	0	0	0	0	110.6
657	L	29.3	Very low	28.1	Very low	160 Å²	160	131.1 Å²	131.1	84%	0.838	72%	0.723	S	S	*	*			trans	-128.4	121.1	160.1	-163.1	71.8	0	0	0	108.9	T655 T659	T655-L657 PolarHBondContact O-N 3.35Å; L657-T659 PolarHBondContact O-N 3.01Å
658	D	26.7	Very low	28.2	Very low	127 Å²	127	130.4 Å²	130.4	68%	0.679	72%	0.722	S	S	*	*			trans	-66.6	127.6	-168.5	-162.6	-33.4	0	0	0	111.6	S660	D658-S660 VanDerWaalsContact C-N 3.33Å; D658-S660 WeakPolarHBondContact OD1-CB 3.47Å; D658-S660 PolarHBondContact OD1-N 2.83Å; D658-S660 VanDerWaalsContact OD1-N 3.07Å; D658-S660 PolarHBondContact OD1-OG 2.98Å
659	T	29.1	Very low	28.1	Very low	135 Å²	135	130 Å²	130	83%	0.828	72%	0.724	S	S	*	*			trans	-93	11.6	-175.4	-21.8	0	0	0	0	113	L657 Q661	L657-T659 PolarHBondContact O-N 3.01Å; T659-Q661 PolarHBondContact O-N 2.97Å
660	S	27.4	Very low	27.8	Very low	86 Å²	86	129.5 Å²	129.5	60%	0.601	73%	0.734	S	S	*	*			trans	-75.1	35.8	-174	55.1	0	0	0	0	116.1	D658	D658-S660 VanDerWaalsContact C-N 3.33Å; D658-S660 WeakPolarHBondContact OD1-CB 3.47Å; D658-S660 PolarHBondContact OD1-N 2.83Å; D658-S660 VanDerWaalsContact OD1-N 3.07Å; D658-S660 PolarHBondContact OD1-OG 2.98Å
661	Q	30.8	Very low	27.8	Very low	156 Å²	156	133.5 Å²	133.5	73%	0.729	75%	0.75	S	S	*	*			trans	-138	132.9	174	-75.1	-62.1	-11	0	0	114.2	T659	T659-Q661 PolarHBondContact O-N 2.97Å
662	L	27.6	Very low	27.7	Very low	146 Å²	146	133.7 Å²	133.7	76%	0.764	75%	0.749	S	S	*	*			trans	58.9	82.6	161	-53	173	0	0	0	116.4
663	K	27	Very low	27.5	Very low	181 Å²	181	130.9 Å²	130.9	79%	0.787	74%	0.737	S	S	*	*				64.7	116	75.8	-67.7	-174.6	173.1	177.6	0	117.2
664	L	22.8	Very low	27.5	Very low	138 Å²	138	127.3 Å²	127.3	72%	0.723	73%	0.725	S	S	*	*			trans	65.6	140.9	140	-62.8	166.1	0	0	0	118.4	S666	L664-S666 WeakPolarHBondContact CD2-OG 3.36Å
665	N	26.5	Very low	27.7	Very low	138 Å²	138	128 Å²	128	74%	0.738	71%	0.708	S	S	*	*			cis	-118.6	155.3	1.4	-55.9	-62.2	0	0	0	110.3
666	S	24.2	Very low	27.6	Very low	85 Å²	85	125.7 Å²	125.7	59%	0.594	70%	0.696	S	S	*	*			cis	83.4	52.4	12	89.4	0	0	0	0	119.2	L664	L664-S666 WeakPolarHBondContact CD2-OG 3.36Å
667	Q	32	Very low	28	Very low	186 Å²	186	123.8 Å²	123.8	87%	0.869	68%	0.681	S	S	*	*			trans	-163.1	133.9	153.7	-110.4	154.8	-23.4	0	0	109.2
668	S	29.7	Very low	27.9	Very low	89 Å²	89	119.8 Å²	119.8	62%	0.622	66%	0.661	S	S	*	*			cis	-158.8	142	-12.3	47.7	0	0	0	0	110.8
669	N	26.1	Very low	28	Very low	155 Å²	155	120.3 Å²	120.3	83%	0.829	67%	0.668	S	S	*	*				28.5	134.6	121.6	-41.2	-15.9	0	0	0	117.2
670	A	28.7	Very low	27.9	Very low	91 Å²	91	120 Å²	120	75%	0.752	66%	0.661	S	S	*	*			cis	-156.5	-174.8	2.1	0	0	0	0	0	107.5
671	E	28.3	Very low	27.9	Very low	184 Å²	184	123.6 Å²	123.6	86%	0.86	67%	0.672	S	S	*	*			cis	-139.4	157.4	16.5	-65	171.4	111.8	0	0	111
672	I	26.2	Very low	27.8	Very low	157 Å²	157	125.6 Å²	125.6	81%	0.805	68%	0.679	S	S	*	*			trans	-137.5	161.1	179.1	-67.7	179	0	0	0	108.9
673	T	27.2	Very low	27.8	Very low	55 Å²	55	123.5 Å²	123.5	34%	0.337	68%	0.676	S	S	.	*			trans	99.7	158.4	179.2	74.3	0	0	0	0	112.7	I234 S235 Q236	I234-T673 WeakPolarHBondContact CA-OG1 3.33Å; I234-T673 PolarHBondContact N-OG1 2.9Å; I234-T673 PolarHBondContact O-OG1 2.8Å; S235-T673 CarbonylContact C-O 2.95Å; S235-T673 PolarHBondContact N-OG1 3.45Å; S235-T673 CarbonylContact O-C 3.55Å; S235-T673 PolarHBondContact O-OG1 3.22Å; Q236-T673 PolarHBondContact N-O 3.22Å
674	N	28.3	Very low	27.9	Very low	80 Å²	80	122.3 Å²	122.3	43%	0.428	68%	0.677	S	S	.	*			cis	-147.8	158.3	-9.8	-127.2	14.9	0	0	0	105.9	I234	I234-N674 HydrophobicContact CG1-CB 3.94Å; I234-N674 VanDerWaalsContact CG1-ND2 3.26Å; I234-N674 WeakPolarHBondContact CG1-ND2 3.42Å
675	I	27.9	Very low	28.1	Very low	101 Å²	101	123.1 Å²	123.1	52%	0.518	68%	0.677	S	S	.	*			cis	-150.7	132.5	36.3	-87.3	112.1	0	0	0	106.8	L303	L303-I675 HydrophobicContact CD1-CG2 3.7Å; L303-I675 HydrophobicContact CG-CG2 4.48Å
676	S	28.8	Very low	28.1	Very low	67 Å²	67	122.5 Å²	122.5	47%	0.469	68%	0.681	S	S	.	*				85.2	152.8	70.8	-99.2	0	0	0	0	115	N302	N302-S676 VanDerWaalsContact CB-O 3.3Å; N302-S676 WeakPolarHBondContact CB-O 3.42Å; N302-S676 PolarHBondContact ND2-O 3.31Å
677	P	33.4	Very low	28.1	Very low	82 Å²	82	125 Å²	125	53%	0.532	68%	0.684	S	S	.	*				-134.4	175.7	-125.5	42.8	-26.8	0	0	0	116.4
678	D	27.1	Very low	27.7	Very low	77 Å²	77	124.4 Å²	124.4	41%	0.412	68%	0.682	S	S	.	*			trans	-146	15.9	179.4	-110.5	-10.7	0	0	0	117.5	N302 L303 L304	N302-D678 HydrophobicContact CB-CB 4.32Å; L303-D678 VanDerWaalsContact CA-OD2 3.24Å; L303-D678 WeakPolarHBondContact CA-OD2 3.29Å; L303-D678 PolarHBondContact N-OD2 3.15Å; L304-D678 VanDerWaalsContact C-OD1 3.32Å; L304-D678 VanDerWaalsContact N-CG 3.31Å; L304-D678 PolarHBondContact N-OD1 3.32Å; L304-D678 PolarHBondContact N-OD2 2.85Å; L304-D678 VanDerWaalsContact N-OD2 3.13Å
679	V	28.2	Very low	27.6	Very low	137 Å²	137	127 Å²	127	83%	0.83	69%	0.687	S	S	*	*			trans	-111.7	88.1	-179.8	-174.8	0	0	0	0	111
680	L	28.7	Very low	27.4	Very low	129 Å²	129	125.7 Å²	125.7	68%	0.675	69%	0.685	S	S	*	*			trans	-110.4	95.6	167.9	-72.2	-167.6	0	0	0	112.4	A306 K682	A306-L680 HydrophobicContact CB-CD1 3.35Å; A306-L680 HydrophobicContact CB-CG 4.47Å; L680-K682 PolarHBondContact O-N 2.92Å
681	L	26.3	Very low	27.3	Very low	161 Å²	161	126.1 Å²	126.1	84%	0.843	68%	0.683	S	S	*	*			trans	20.6	89.2	132.6	-161.1	74.2	0	0	0	116.2	S683	L681-S683 PolarHBondContact O-N 2.89Å
682	K	28.1	Very low	27.1	Very low	198 Å²	198	123.4 Å²	123.4	86%	0.861	67%	0.67	S	S	*	*			trans	-66.7	126.3	158.2	-85.9	-171.3	173.4	-177.2	0	108.8	L680 I684	L680-K682 PolarHBondContact O-N 2.92Å; K682-I684 PolarHBondContact O-N 3.23Å
683	S	27.9	Very low	27.2	Very low	102 Å²	102	123.7 Å²	123.7	71%	0.713	67%	0.671	S	S	*	*			trans	-56.8	127.8	175.3	-170	0	0	0	0	110.4	L681	L681-S683 PolarHBondContact O-N 2.89Å
684	I	29.1	Very low	27	Very low	157 Å²	157	126.4 Å²	126.4	81%	0.805	69%	0.692	S	S	*	*			trans	-88.1	105.4	158.6	-63.8	176.5	0	0	0	105	K682	K682-I684 PolarHBondContact O-N 3.23Å
685	E	27.5	Very low	27	Very low	154 Å²	154	129.3 Å²	129.3	72%	0.72	71%	0.706	S	S	*	*			trans	-55.4	144.5	170	-64.1	179	154.9	0	0	109.6	M687	E685-M687 PolarHBondContact O-N 2.9Å
686	P	25.9	Very low	27	Very low	126 Å²	126	128.8 Å²	128.8	82%	0.818	72%	0.717	S	S	*	*			trans	-67.9	93	-178.2	28.4	-34.6	0	0	0	110.1	E688	P686-E688 PolarHBondContact O-N 3.02Å
687	M	24.5	Very low	26.8	Very low	136 Å²	136	131 Å²	131	67%	0.67	73%	0.73	S	S	*	*			trans	-60.5	113.6	171	-72.8	-159.5	80.6	0	0	109.4	E685 I689	E685-M687 PolarHBondContact O-N 2.9Å; M687-I689 VanDerWaalsContact C-N 3.26Å; M687-I689 HydrophobicContact CB-CG1 4.46Å; M687-I689 PolarHBondContact O-N 3.43Å
688	E	23	Very low	26.6	Very low	174 Å²	174	134.7 Å²	134.7	81%	0.813	75%	0.745	S	S	*	*			trans	-67.7	79.9	175.6	-63.1	-170.6	133.9	0	0	111	P686 T690	P686-E688 PolarHBondContact O-N 3.02Å; E688-T690 PolarHBondContact O-N 3.38Å
689	I	28	Very low	26.5	Very low	143 Å²	143	137.4 Å²	137.4	73%	0.733	76%	0.758	S	S	*	*			trans	-76.3	82	171.4	-57.6	-177.7	0	0	0	108.3	M687 S691	M687-I689 VanDerWaalsContact C-N 3.26Å; M687-I689 HydrophobicContact CB-CG1 4.46Å; M687-I689 PolarHBondContact O-N 3.43Å; I689-S691 PolarHBondContact O-N 3.03Å
690	T	21.9	Very low	26.6	Very low	129 Å²	129	139.3 Å²	139.3	79%	0.791	76%	0.758	S	S	*	*			trans	-67.9	93.4	177.8	39.2	0	0	0	0	111.5	E688	E688-T690 PolarHBondContact O-N 3.38Å
691	S	28.1	Very low	26.9	Very low	100 Å²	100	141.1 Å²	141.1	70%	0.699	76%	0.763	S	S	*	*			trans	-145	108.9	163.8	60.7	0	0	0	0	110.8	I689 I693	I689-S691 PolarHBondContact O-N 3.03Å; S691-I693 PolarHBondContact O-N 3.22Å
692	E	24.1	Very low	27	Very low	127 Å²	127	140.9 Å²	140.9	59%	0.593	76%	0.763	S	S	*	*			trans	-63.5	125.9	-172.5	-55.7	175.8	145	0	0	113.6	K481	K481-E692 IonicContact NZ-OE1 3.6Å; K481-E692 PolarHBondContact NZ-OE1 3.24Å; K481-E692 IonicContact NZ-OE2 2.84Å; K481-E692 PolarHBondContact NZ-OE2 3.06Å
693	I	27.2	Very low	27.2	Very low	162 Å²	162	143.2 Å²	143.2	83%	0.831	77%	0.766	S	S	*	*			trans	-140.3	85.1	141.4	-54.6	-176.5	0	0	0	108.2	S691	S691-I693 PolarHBondContact O-N 3.22Å
694	S	23.5	Very low	27.4	Very low	112 Å²	112	143.7 Å²	143.7	78%	0.783	77%	0.769	S	S	*	*			trans	-88.2	117.4	177.5	-53.4	0	0	0	0	111.2
695	I	28	Very low	27.2	Very low	141 Å²	141	144.7 Å²	144.7	72%	0.723	78%	0.775	S	S	*	*			trans	-135.8	136.8	159.8	-58.7	-176.4	0	0	0	108.1
696	A	27	Very low	27.1	Very low	90 Å²	90	142.5 Å²	142.5	74%	0.744	77%	0.774	S	S	*	*			trans	-71.5	156	-159	0	0	0	0	0	116.5
697	P	24.9	Very low	27	Very low	114 Å²	114	144.6 Å²	144.6	74%	0.74	78%	0.778	S	S	*	*			trans	-91.6	126.7	167.1	34.7	-29.9	0	0	0	111.9
698	N	28.6	Very low	27.2	Very low	159 Å²	159	144 Å²	144	85%	0.85	78%	0.781	S	S	*	*			trans	163.3	146.9	166	-103.3	-58.1	0	0	0	108.8
699	I	26.9	Very low	27.4	Very low	134 Å²	134	139.4 Å²	139.4	69%	0.687	77%	0.765	S	S	*	*			cis	-132.6	150.9	-14.5	-67.7	157.4	0	0	0	105.5	E701	I699-E701 HydrophobicContact CG2-CG 4.35Å
700	H	30.3	Very low	27.5	Very low	177 Å²	177	137.2 Å²	137.2	82%	0.819	76%	0.76	S	S	*	*			trans	-145.8	102	151.5	-146.7	-52.6	0	0	0	111
701	E	34.2	Very low	28	Very low	168 Å²	168	136 Å²	136	79%	0.785	75%	0.749	S	S	*	*			trans	-74.8	151.6	163.8	-67.3	-165	138.5	0	0	109.9	I699	I699-E701 HydrophobicContact CG2-CG 4.35Å
702	N	28.7	Very low	28.4	Very low	156 Å²	156	137.5 Å²	137.5	83%	0.834	76%	0.759	S	S	*	*			trans	-91.6	109.1	173.6	-76.4	-59.4	0	0	0	110
703	R	31.6	Very low	29.1	Very low	246 Å²	246	135.3 Å²	135.3	93%	0.928	76%	0.758	S	S	*	*			trans	-152.4	144.1	158.8	-116.5	164.7	-173.9	177	1.3	113.7
704	S	31.8	Very low	29.6	Very low	112 Å²	112	131.4 Å²	131.4	78%	0.783	74%	0.742	S	S	*	*			trans	-22.6	134.9	-174.8	-49.4	0	0	0	0	119.4	P706	S704-P706 WeakPolarHBondContact O-CD 3.45Å
705	L	24.5	Very low	30.2	Very low	178 Å²	178	130.6 Å²	130.6	93%	0.932	73%	0.734	S	S	*	*			trans	-60.6	135	172.3	-64.8	162.5	0	0	0	113.6
706	P	25.4	Very low	31	Very low	108 Å²	108	126.2 Å²	126.2	70%	0.701	71%	0.711	S	S	*	*			trans	-104.9	158.1	144.9	28.7	-15.4	0	0	0	111.4	S704 V708	S704-P706 WeakPolarHBondContact O-CD 3.45Å; P706-V708 PolarHBondContact O-N 3.3Å
707	L	23.9	Very low	31.9	Very low	171 Å²	171	124.6 Å²	124.6	90%	0.895	69%	0.693	S	S	*	*			trans	-74.5	120	-177.2	-65	165.3	0	0	0	111.6
708	V	30.3	Very low	32.9	Very low	122 Å²	122	126.7 Å²	126.7	74%	0.739	69%	0.691	S	S	*	*			trans	-137.4	144.3	176.4	-175.3	0	0	0	0	111.2	P706	P706-V708 PolarHBondContact O-N 3.3Å
709	V	26.3	Very low	33.6	Very low	79 Å²	79	120.1 Å²	120.1	48%	0.479	66%	0.657	S	S	.	*			trans	-62.6	128.3	-179.3	-174.1	0	0	0	0	111.6	N711	V709-N711 PolarHBondContact O-N 3.39Å; V709-N711 VanDerWaalsContact O-N 3.08Å
710	P	31	Very low	34.2	Very low	96 Å²	96	118.9 Å²	118.9	62%	0.623	65%	0.646	S	S	*	*			trans	-81.2	85.3	172.1	32.6	-33.3	0	0	0	111.5
711	N	30.8	Very low	34.7	Very low	105 Å²	105	113.4 Å²	113.4	56%	0.561	62%	0.623	S	S	*	*			trans	-65.7	167.2	162.3	-78.8	-14.7	0	0	0	111.1	V709 S713	V709-N711 PolarHBondContact O-N 3.39Å; V709-N711 VanDerWaalsContact O-N 3.08Å; N711-S713 PolarHBondContact O-N 3.39Å
712	S	37.6	Very low	34.8	Very low	130 Å²	130	109.5 Å²	109.5	91%	0.909	61%	0.607	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.9	5.2	-164	-155.7	0	0	0	0	117.9
713	S	39.5	Very low	34.9	Very low	82 Å²	82	106.9 Å²	106.9	57%	0.573	60%	0.597	S	S	*	*	T	Hydrogen-bonded Turn	trans	-112.3	6.2	-158.3	46.7	0	0	0	0	116.2	N711 P715	N711-S713 PolarHBondContact O-N 3.39Å; S713-P715 WeakPolarHBondContact O-CD 3.4Å
714	V	36.1	Very low	34.7	Very low	80 Å²	80	99.3 Å²	99.3	49%	0.485	59%	0.586	S	S	.	*	P	Polyproline II helix	trans	-61.3	120	179.9	-177.5	0	0	0	0	111.5	L716 M759	V714-L716 PolarHBondContact O-N 3.34Å; V714-M759 HydrophobicContact CG1-CE 4.17Å
715	P	36.8	Very low	34.6	Very low	94 Å²	94	97.8 Å²	97.8	61%	0.61	58%	0.576	S	S	*	*	P	Polyproline II helix	trans	-67	122.8	-179.8	-21.3	33.9	0	0	0	112.6	S713	S713-P715 WeakPolarHBondContact O-CD 3.4Å
716	L	45.4	Very low	34.7	Very low	49 Å²	49	99.6 Å²	99.6	26%	0.257	57%	0.57	S	S	.	*	P	Polyproline II helix	trans	-80.7	141.1	176.1	-62.2	174.1	0	0	0	111.2	V714 K718 H752 M759 V761	V714-L716 PolarHBondContact O-N 3.34Å; L716-K718 PolarHBondContact O-N 3.31Å; L716-H752 WeakPolarHBondContact CD1-CE1 3.33Å; L716-H752 WeakPolarHBondContact CD1-NE2 3.33Å; L716-M759 HydrophobicContact CD2-CE 3.84Å; L716-M759 HydrophobicContact CD2-SD 3.51Å; L716-M759 VanDerWaalsContact CD2-SD 3.51Å; L716-V761 HydrophobicContact CD2-CG2 4.41Å
717	P	45	Very low	35	Very low	56 Å²	56	100.6 Å²	100.6	36%	0.364	57%	0.57	S	S	.	*	P	Polyproline II helix	trans	-52.8	133.7	177.2	-29	34.8	0	0	0	113.4	P719 P737 V755 M759	P717-P719 VanDerWaalsContact O-CD 3.31Å; P717-P719 WeakPolarHBondContact O-CD 3.48Å; P717-P737 HydrophobicContact CB-CG 4.17Å; P717-V755 HydrophobicContact CG-CG1 4.35Å; P717-M759 WeakPolarHBondContact CD-SD 3.39Å; P717-M759 HydrophobicContact CG-SD 4.17Å
718	K	45.8	Very low	35.5	Very low	159 Å²	159	97.8 Å²	97.8	69%	0.691	56%	0.564	S	S	*	*	P	Polyproline II helix	trans	-68.2	122.7	177.7	-71.7	-177.3	176.5	-179.4	0	109.6	E520 L716 F720	E520-K718 IonicContact OE1-NZ 3.98Å; L716-K718 PolarHBondContact O-N 3.31Å; K718-F720 PolarHBondContact O-N 3.29Å
719	P	42.7	Very low	35.9	Very low	20 Å²	20	99.2 Å²	99.2	13%	0.13	56%	0.563	C	S	.	*	P	Polyproline II helix	trans	-50	126.4	177.6	-37.1	41	0	0	0	115.1	P717 Y734 R748 L751	P717-P719 VanDerWaalsContact O-CD 3.31Å; P717-P719 WeakPolarHBondContact O-CD 3.48Å; P719-Y734 HydrophobicContact CB-CD1 4.1Å; P719-R748 HydrophobicContact CB-CG 4.06Å; P719-R748 HydrophobicContact CG-CG 3.83Å; P719-L751 HydrophobicContact CB-CD2 3.85Å; P719-L751 HydrophobicContact CG-CD2 4.31Å
720	F	41.5	Very low	36.7	Very low	108 Å²	108	99.6 Å²	99.6	47%	0.474	56%	0.561	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-74.5	145.6	172.9	-164.7	-107.6	0	0	0	111.3	K718 L722	K718-F720 PolarHBondContact O-N 3.29Å; F720-L722 HydrophobicContact CD1-CG 4.49Å; F720-L722 HydrophobicContact CE1-CD2 3.75Å; F720-L722 HydrophobicContact CE1-CG 4.11Å
721	I	39.5	Very low	37.8	Very low	63 Å²	63	97.8 Å²	97.8	32%	0.323	54%	0.543	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	123.4	179.6	-46.2	-179.5	0	0	0	108.2	T723 Y734	I721-T723 HydrophobicContact CB-CG2 4.38Å; I721-T723 HydrophobicContact CG2-CG2 3.91Å; I721-Y734 HydrophobicContact CD1-CD1 4.44Å; I721-Y734 HydrophobicContact CD1-CE1 3.65Å; I721-Y734 HydrophobicContact CG1-CD1 3.94Å; I721-Y734 HydrophobicContact CG1-CE1 3.64Å
722	L	35.7	Very low	39.1	Very low	86 Å²	86	96.1 Å²	96.1	45%	0.45	53%	0.534	S	S	.	.			trans	-81.8	133.2	172.8	-70.7	165	0	0	0	110.4	F720 K731 V735	F720-L722 HydrophobicContact CD1-CG 4.49Å; F720-L722 HydrophobicContact CE1-CD2 3.75Å; F720-L722 HydrophobicContact CE1-CG 4.11Å; L722-K731 CarbonylContact O-C 3.57Å; L722-V735 HydrophobicContact CD1-CG2 4.2Å
723	T	31.5	Very low	40.9	Very low	101 Å²	101	91.2 Å²	91.2	62%	0.62	50%	0.497	S	S	*	.			trans	-136	30.9	-163.7	51.4	0	0	0	0	117.5	I721 K731	I721-T723 HydrophobicContact CB-CG2 4.38Å; I721-T723 HydrophobicContact CG2-CG2 3.91Å; T723-K731 VanDerWaalsContact C-CE 3.48Å; T723-K731 VanDerWaalsContact C-NZ 3.27Å; T723-K731 VanDerWaalsContact O-CE 3.29Å; T723-K731 WeakPolarHBondContact O-CE 3.4Å; T723-K731 PolarHBondContact O-NZ 3.13Å
724	A	27.8	Very low	42.4	Very low	86 Å²	86	89.4 Å²	89.4	71%	0.711	48%	0.478	S	S	*	.			trans	-86.6	111.9	-178.8	0	0	0	0	0	116.3	K731	A724-K731 WeakPolarHBondContact O-CG 3.38Å
725	S	29.4	Very low	44.3	Very low	80 Å²	80	87.3 Å²	87.3	56%	0.559	47%	0.465	S	S	*	.			trans	48.5	174.7	-179.8	-153	0	0	0	0	118.4	K731	S725-K731 VanDerWaalsContact C-NZ 3.31Å; S725-K731 VanDerWaalsContact N-NZ 3.17Å; S725-K731 WeakPolarHBondContact O-CD 3.36Å; S725-K731 WeakPolarHBondContact O-CE 3.13Å; S725-K731 VanDerWaalsContact O-CG 3.29Å; S725-K731 WeakPolarHBondContact O-CG 3.49Å; S725-K731 PolarHBondContact O-NZ 3.33Å
726	W	27.4	Very low	46.2	Very low	216 Å²	216	83.2 Å²	83.2	82%	0.818	44%	0.439	S	S	*	.	S	Bend	trans	-101.2	-6.3	176.4	-92.6	-14.8	0	0	0	114.6
727	D	30.1	Very low	47.6	Very low	130 Å²	130	84 Å²	84	70%	0.695	45%	0.447	S	S	*	.	S	Bend	trans	-106.1	142.2	176.4	-48.6	-65.6	0	0	0	109.5
728	S	34.4	Very low	49.1	Very low	111 Å²	111	84.7 Å²	84.7	78%	0.776	44%	0.444	S	S	*	.	S	Bend	trans	77.5	76	-177.4	-48.1	0	0	0	0	118	M730	S728-M730 PolarHBondContact O-N 3.5Å
729	E	38.9	Very low	50.4	Low	153 Å²	153	84.9 Å²	84.9	72%	0.715	45%	0.445	S	S	*	.	S	Bend	trans	70.5	-27.2	130.7	-152	164.2	-141.3	0	0	122.2
730	M	44	Very low	52	Low	87 Å²	87	93 Å²	93	43%	0.429	48%	0.481	S	S	.	.			trans	-125.5	-0.5	-169.3	-71.4	-72.4	154.5	0	0	117.4	I632 S728 L732	I632-M730 HydrophobicContact CG2-CE 4.03Å; S728-M730 PolarHBondContact O-N 3.5Å; M730-L732 PolarHBondContact O-N 3.04Å; M730-L732 VanDerWaalsContact O-N 3.1Å
731	K	55.1	Low	53.7	Low	58 Å²	58	89 Å²	89	25%	0.252	47%	0.467	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.5	19.1	-158.9	-168.1	-113.6	-175.7	68.8	0	118.7	L722 T723 A724 S725	L722-K731 CarbonylContact O-C 3.57Å; T723-K731 VanDerWaalsContact C-CE 3.48Å; T723-K731 VanDerWaalsContact C-NZ 3.27Å; T723-K731 VanDerWaalsContact O-CE 3.29Å; T723-K731 WeakPolarHBondContact O-CE 3.4Å; T723-K731 PolarHBondContact O-NZ 3.13Å; A724-K731 WeakPolarHBondContact O-CG 3.38Å; S725-K731 VanDerWaalsContact C-NZ 3.31Å; S725-K731 VanDerWaalsContact N-NZ 3.17Å; S725-K731 WeakPolarHBondContact O-CD 3.36Å; S725-K731 WeakPolarHBondContact O-CE 3.13Å; S725-K731 VanDerWaalsContact O-CG 3.29Å; S725-K731 WeakPolarHBondContact O-CG 3.49Å; S725-K731 PolarHBondContact O-NZ 3.33Å
732	L	57.5	Low	55.4	Low	70 Å²	70	86.5 Å²	86.5	37%	0.366	46%	0.456	S	S	.	.	T	Hydrogen-bonded Turn	trans	-150.1	22.4	-172	-112.9	167.9	0	0	0	116.8	L629 M730	L629-L732 HydrophobicContact CD1-CB 3.97Å; L629-L732 HydrophobicContact CD2-CB 3.66Å; L629-L732 HydrophobicContact CG-CB 4.42Å; M730-L732 PolarHBondContact O-N 3.04Å; M730-L732 VanDerWaalsContact O-N 3.1Å
733	L	74	Confident	57.3	Low	27 Å²	27	88.3 Å²	88.3	14%	0.141	46%	0.46	C	S	.	.			trans	-93	144.1	175.1	-63.8	175	0	0	0	112.3	A744 T746	L733-A744 HydrophobicContact CB-CB 4.19Å; L733-A744 HydrophobicContact CD1-CB 4.13Å; L733-T746 HydrophobicContact CD2-CG2 4.06Å
734	Y	72.5	Confident	59.5	Low	43 Å²	43	85.9 Å²	85.9	17%	0.169	45%	0.45	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	109.6	174.3	-65.5	-85.8	0	0	0	109.4	P719 I721 A744 F745 R748	P719-Y734 HydrophobicContact CB-CD1 4.1Å; I721-Y734 HydrophobicContact CD1-CD1 4.44Å; I721-Y734 HydrophobicContact CD1-CE1 3.65Å; I721-Y734 HydrophobicContact CG1-CD1 3.94Å; I721-Y734 HydrophobicContact CG1-CE1 3.64Å; Y734-A744 CarbonylContact O-C 3.15Å; Y734-A744 WeakPolarHBondContact O-CA 3.4Å; Y734-F745 PolarHBondContact N-O 3.15Å; Y734-F745 PolarHBondContact O-N 3.46Å; Y734-R748 HydrophobicContact CD1-CB 4.1Å; Y734-R748 HydrophobicContact CD1-CG 4.29Å; Y734-R748 HydrophobicContact CD2-CB 4.45Å; Y734-R748 HydrophobicContact CE1-CB 3.74Å; Y734-R748 HydrophobicContact CE1-CG 4.02Å; Y734-R748 HydrophobicContact CE2-CB 4.13Å; Y734-R748 HydrophobicContact CG-CB 4.44Å
735	V	74.4	Confident	61.6	Low	37 Å²	37	83.9 Å²	83.9	22%	0.224	43%	0.426	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	143.7	-173.7	-176	0	0	0	0	111.5	L722 A744 L751	L722-V735 HydrophobicContact CD1-CG2 4.2Å; V735-A744 HydrophobicContact CG2-CB 4.31Å; V735-L751 VanDerWaalsContact O-CD2 3.24Å; V735-L751 WeakPolarHBondContact O-CD2 3.33Å
736	C	78.6	Confident	63.7	Low	7 Å²	7	81.8 Å²	81.8	5%	0.047	41%	0.409	C	S	.	.			trans	-63.3	126.1	175.4	-166.8	0	0	0	0	111.8	F738 C741 K743 L751 H754	C736-F738 PolarHBondContact O-N 3.3Å; C736-C741 HydrophobicContact CB-CB 4.32Å; C736-K743 WeakPolarHBondContact CB-O 3.42Å; C736-K743 PolarHBondContact N-O 2.79Å; C736-L751 HydrophobicContact CB-CD1 4.14Å; C736-H754 PolarHBondContact SG-CD2 3.45Å; C736-H754 PolarHBondContact SG-NE2 2.91Å
737	P	73.9	Confident	65.7	Low	65 Å²	65	75.1 Å²	75.1	42%	0.422	39%	0.386	S	S	.	.	S	Bend	trans	-71	-12.3	179.3	29.7	-35.9	0	0	0	113.4	P717 K739 V755	P717-P737 HydrophobicContact CB-CG 4.17Å; P737-K739 PolarHBondContact O-N 3.28Å; P737-V755 HydrophobicContact CG-CG2 4Å
738	F	77.5	Confident	67.8	Low	72 Å²	72	74.9 Å²	74.9	32%	0.316	38%	0.376	S	S	.	.	S	Bend	trans	-78.8	110.7	174.1	-67.3	-85.3	0	0	0	109.9	C736 E740 C741 G742 V755 H758 M759	C736-F738 PolarHBondContact O-N 3.3Å; F738-E740 VanDerWaalsContact C-N 3.27Å; F738-E740 PolarHBondContact O-N 2.79Å; F738-C741 HydrophobicContact CB-CB 4.23Å; F738-C741 WeakPolarHBondContact O-CB 3.37Å; F738-C741 PolarHBondContact O-N 3.13Å; F738-G742 PolarHBondContact O-N 3.34Å; F738-V755 HydrophobicContact CE2-CG1 4.34Å; F738-H758 HydrophobicContact CD1-CB 4.37Å; F738-H758 HydrophobicContact CD2-CB 3.59Å; F738-H758 AromaticContact CD2-CD2 3.87Å; F738-H758 AromaticContact CD2-CG 3.59Å; F738-H758 HydrophobicContact CE1-CB 4.19Å; F738-H758 HydrophobicContact CE2-CB 3.37Å; F738-H758 AromaticContact CE2-CG 3.94Å; F738-H758 HydrophobicContact CG-CB 4.1Å; F738-H758 AromaticContact CG-CG 3.88Å; F738-H758 AromaticContact CG-ND1 3.94Å; F738-H758 HydrophobicContact CZ-CB 3.71Å; F738-M759 HydrophobicContact CE2-CG 4.32Å; F738-M759 HydrophobicContact CZ-CG 3.81Å
739	K	71.3	Confident	69.7	Low	163 Å²	163	73.3 Å²	73.3	71%	0.709	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.4	-41.3	-173.6	-172.3	174.7	-178.9	175.7	0	113.8	P737 C741	P737-K739 PolarHBondContact O-N 3.28Å; K739-C741 PolarHBondContact O-N 3.22Å
740	E	77.7	Confident	71.7	Confident	191 Å²	191	70.3 Å²	70.3	89%	0.893	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.6	-19	179	-61	178.4	179	0	0	114.3	F738	F738-E740 VanDerWaalsContact C-N 3.27Å; F738-E740 PolarHBondContact O-N 2.79Å
741	C	76.6	Confident	73.4	Confident	24 Å²	24	66.2 Å²	66.2	16%	0.162	33%	0.329	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.6	-47	-171.6	-167.7	0	0	0	0	112.7	C736 F738 K739 K743 H754 H758	C736-C741 HydrophobicContact CB-CB 4.32Å; F738-C741 HydrophobicContact CB-CB 4.23Å; F738-C741 WeakPolarHBondContact O-CB 3.37Å; F738-C741 PolarHBondContact O-N 3.13Å; K739-C741 PolarHBondContact O-N 3.22Å; C741-K743 PolarHBondContact O-N 2.81Å; C741-H754 PolarHBondContact SG-CE1 3.41Å; C741-H754 PolarHBondContact SG-NE2 3.44Å; C741-H758 PolarHBondContact SG-NE2 3.03Å
742	G	74.9	Confident	74.5	Confident	10 Å²	10	67.8 Å²	67.8	10%	0.103	34%	0.337	C	S	.	.			trans	62.4	-10	179.2	0	0	0	0	0	117.1	L641 F738 A744	L641-G742 WeakPolarHBondContact CD1-O 3.26Å; F738-G742 PolarHBondContact O-N 3.34Å; G742-A744 PolarHBondContact O-N 3.11Å
743	K	76.2	Confident	75.5	Confident	124 Å²	124	65.7 Å²	65.7	54%	0.539	33%	0.326	S	S	.	.			trans	-58.4	130.3	-169.4	-71.5	176	-171.2	175.3	0	112.4	C736 C741 F745	C736-K743 WeakPolarHBondContact CB-O 3.42Å; C736-K743 PolarHBondContact N-O 2.79Å; C741-K743 PolarHBondContact O-N 2.81Å; K743-F745 HydrophobicContact CB-CE2 3.76Å; K743-F745 HydrophobicContact CB-CZ 3.9Å; K743-F745 WeakPolarHBondContact O-CD2 3.41Å; K743-F745 VanDerWaalsContact O-CE2 3.27Å; K743-F745 WeakPolarHBondContact O-CE2 3.4Å
744	A	76.6	Confident	75.9	Confident	50 Å²	50	65.1 Å²	65.1	41%	0.413	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	142	-177.8	0	0	0	0	0	111.4	L733 Y734 V735 G742	L733-A744 HydrophobicContact CB-CB 4.19Å; L733-A744 HydrophobicContact CD1-CB 4.13Å; Y734-A744 CarbonylContact O-C 3.15Å; Y734-A744 WeakPolarHBondContact O-CA 3.4Å; V735-A744 HydrophobicContact CG2-CB 4.31Å; G742-A744 PolarHBondContact O-N 3.11Å
745	F	73.3	Confident	76.1	Confident	44 Å²	44	63.3 Å²	63.3	19%	0.193	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	141.5	-174.1	-59.7	-91.1	0	0	0	111.4	Y734 K743 K747 K750 L751 H754	Y734-F745 PolarHBondContact N-O 3.15Å; Y734-F745 PolarHBondContact O-N 3.46Å; K743-F745 HydrophobicContact CB-CE2 3.76Å; K743-F745 HydrophobicContact CB-CZ 3.9Å; K743-F745 WeakPolarHBondContact O-CD2 3.41Å; K743-F745 VanDerWaalsContact O-CE2 3.27Å; K743-F745 WeakPolarHBondContact O-CE2 3.4Å; F745-K747 VanDerWaalsContact C-N 3.26Å; F745-K747 PolarHBondContact O-N 3.33Å; F745-K750 HydrophobicContact CB-CB 4.3Å; F745-K750 HydrophobicContact CD1-CB 3.88Å; F745-K750 HydrophobicContact CG-CB 4.38Å; F745-L751 HydrophobicContact CB-CB 4.21Å; F745-L751 HydrophobicContact CD2-CB 3.86Å; F745-L751 HydrophobicContact CD2-CD1 3.94Å; F745-L751 HydrophobicContact CD2-CG 4.47Å; F745-L751 HydrophobicContact CE2-CD1 4.09Å; F745-L751 HydrophobicContact CG-CB 4.19Å; F745-H754 HydrophobicContact CE1-CB 4.13Å; F745-H754 HydrophobicContact CE2-CB 3.95Å; F745-H754 AromaticContact CE2-CD2 3.23Å; F745-H754 WeakPolarHBondContact CE2-CD2 3.47Å; F745-H754 AromaticContact CE2-CG 3.72Å; F745-H754 HydrophobicContact CZ-CB 3.55Å; F745-H754 AromaticContact CZ-CD2 3.36Å; F745-H754 WeakPolarHBondContact CZ-CD2 3.22Å; F745-H754 AromaticContact CZ-CG 3.37Å
746	T	72	Confident	76.3	Confident	35 Å²	35	61.6 Å²	61.6	22%	0.215	31%	0.305	C	S	.	.	S	Bend	trans	-74	-13.9	177.5	56.9	0	0	0	0	114.1	L629 S633 L733	L629-T746 HydrophobicContact CB-CG2 3.79Å; S633-T746 WeakPolarHBondContact OG-CG2 3.26Å; L733-T746 HydrophobicContact CD2-CG2 4.06Å
747	K	70.9	Confident	76.4	Confident	77 Å²	77	67.5 Å²	67.5	34%	0.335	33%	0.327	S	S	.	.	S	Bend	trans	-136.3	132.3	-176.2	-65.4	-177.4	179.8	-179.8	0	110.8	F745 S749 K750 L751	F745-K747 VanDerWaalsContact C-N 3.26Å; F745-K747 PolarHBondContact O-N 3.33Å; K747-S749 PolarHBondContact O-N 3.33Å; K747-S749 VanDerWaalsContact O-N 3.14Å; K747-K750 PolarHBondContact O-N 3.1Å; K747-L751 PolarHBondContact O-N 3.04Å
748	R	74.5	Confident	76.5	Confident	124 Å²	124	68.2 Å²	68.2	47%	0.468	32%	0.324	S	S	.	.	H	α-helix	trans	-50.3	-38.7	177.2	-170.8	179.2	169.2	101.2	-6.5	113.3	P719 Y734 L751 H752	P719-R748 HydrophobicContact CB-CG 4.06Å; P719-R748 HydrophobicContact CG-CG 3.83Å; Y734-R748 HydrophobicContact CD1-CB 4.1Å; Y734-R748 HydrophobicContact CD1-CG 4.29Å; Y734-R748 HydrophobicContact CD2-CB 4.45Å; Y734-R748 HydrophobicContact CE1-CB 3.74Å; Y734-R748 HydrophobicContact CE1-CG 4.02Å; Y734-R748 HydrophobicContact CE2-CB 4.13Å; Y734-R748 HydrophobicContact CG-CB 4.44Å; R748-L751 PolarHBondContact O-N 2.91Å; R748-H752 WeakPolarHBondContact O-CB 3.14Å; R748-H752 PolarHBondContact O-N 2.81Å
749	S	74.3	Confident	76.3	Confident	79 Å²	79	67.8 Å²	67.8	55%	0.552	32%	0.324	S	S	*	.	H	α-helix	trans	-66.8	-32.4	178.5	50.8	0	0	0	0	113.9	K747 H752 E753	K747-S749 PolarHBondContact O-N 3.33Å; K747-S749 VanDerWaalsContact O-N 3.14Å; S749-H752 PolarHBondContact O-N 3.5Å; S749-E753 PolarHBondContact O-N 2.8Å
750	K	79	Confident	76.6	Confident	90 Å²	90	62.3 Å²	62.3	39%	0.391	31%	0.314	S	S	.	.	H	α-helix	trans	-77.2	-33.6	176.9	-75.4	-75.6	155	-165.8	0	112.1	F745 K747 E753 H754	F745-K750 HydrophobicContact CB-CB 4.3Å; F745-K750 HydrophobicContact CD1-CB 3.88Å; F745-K750 HydrophobicContact CG-CB 4.38Å; K747-K750 PolarHBondContact O-N 3.1Å; K750-E753 VanDerWaalsContact CD-OE2 3.3Å; K750-E753 WeakPolarHBondContact CD-OE2 3.13Å; K750-E753 WeakPolarHBondContact CE-OE2 3.41Å; K750-E753 IonicContact NZ-OE2 2.71Å; K750-E753 PolarHBondContact NZ-OE2 2.76Å; K750-H754 WeakPolarHBondContact O-CB 3.39Å; K750-H754 PolarHBondContact O-N 3.25Å; K750-H754 VanDerWaalsContact O-N 3.14Å
751	L	80.9	Confident	76.7	Confident	0 Å²	0	55.3 Å²	55.3	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-63.7	-44	165.8	172.8	58.5	0	0	0	111.4	P719 V735 C736 F745 K747 R748 E753 H754 V755	P719-L751 HydrophobicContact CB-CD2 3.85Å; P719-L751 HydrophobicContact CG-CD2 4.31Å; V735-L751 VanDerWaalsContact O-CD2 3.24Å; V735-L751 WeakPolarHBondContact O-CD2 3.33Å; C736-L751 HydrophobicContact CB-CD1 4.14Å; F745-L751 HydrophobicContact CB-CB 4.21Å; F745-L751 HydrophobicContact CD2-CB 3.86Å; F745-L751 HydrophobicContact CD2-CD1 3.94Å; F745-L751 HydrophobicContact CD2-CG 4.47Å; F745-L751 HydrophobicContact CE2-CD1 4.09Å; F745-L751 HydrophobicContact CG-CB 4.19Å; K747-L751 PolarHBondContact O-N 3.04Å; R748-L751 PolarHBondContact O-N 2.91Å; L751-E753 PolarHBondContact O-N 2.81Å; L751-H754 CarbonylContact O-C 3.44Å; L751-H754 WeakPolarHBondContact O-CB 3.49Å; L751-H754 PolarHBondContact O-N 3.1Å; L751-H754 VanDerWaalsContact O-N 3.11Å; L751-V755 HydrophobicContact CD1-CG2 3.74Å; L751-V755 HydrophobicContact CG-CG2 4.22Å; L751-V755 WeakPolarHBondContact O-CG2 3.44Å; L751-V755 PolarHBondContact O-N 2.78Å
752	H	77.7	Confident	77	Confident	91 Å²	91	58.4 Å²	58.4	42%	0.421	29%	0.292	S	S	.	.	H	α-helix	trans	-59.3	-48.1	179.4	-175.4	-65.8	0	0	0	112.4	L716 R748 S749 H754 V755 C756	L716-H752 WeakPolarHBondContact CD1-CE1 3.33Å; L716-H752 WeakPolarHBondContact CD1-NE2 3.33Å; R748-H752 WeakPolarHBondContact O-CB 3.14Å; R748-H752 PolarHBondContact O-N 2.81Å; S749-H752 PolarHBondContact O-N 3.5Å; H752-H754 VanDerWaalsContact C-N 3.27Å; H752-H754 PolarHBondContact O-N 3.1Å; H752-V755 PolarHBondContact O-N 2.76Å; H752-C756 PolarHBondContact O-N 3.14Å; H752-C756 PolarHBondContact O-SG 2.74Å; H752-C756 VanDerWaalsContact O-SG 3.32Å
753	E	78.6	Confident	77.2	Confident	27 Å²	27	60.7 Å²	60.7	13%	0.126	31%	0.305	C	S	.	.	H	α-helix	trans	-53.6	-44.4	171.7	179.9	-145.2	129.5	0	0	112.1	S749 K750 L751 C756 R757 V774 Q775	S749-E753 PolarHBondContact O-N 2.8Å; K750-E753 VanDerWaalsContact CD-OE2 3.3Å; K750-E753 WeakPolarHBondContact CD-OE2 3.13Å; K750-E753 WeakPolarHBondContact CE-OE2 3.41Å; K750-E753 IonicContact NZ-OE2 2.71Å; K750-E753 PolarHBondContact NZ-OE2 2.76Å; L751-E753 PolarHBondContact O-N 2.81Å; E753-C756 WeakPolarHBondContact O-CB 3.28Å; E753-C756 PolarHBondContact O-N 2.79Å; E753-R757 PolarHBondContact O-N 3.35Å; E753-R757 IonicContact OE1-CZ 3.46Å; E753-R757 IonicContact OE1-NH1 3.27Å; E753-R757 PolarHBondContact OE1-NH1 3.29Å; E753-R757 IonicContact OE1-NH2 2.71Å; E753-R757 PolarHBondContact OE1-NH2 3.49Å; E753-V774 HydrophobicContact CG-CG1 3.99Å; E753-Q775 VanDerWaalsContact CD-CD 3.49Å; E753-Q775 HydrophobicContact CG-CG 3.76Å; E753-Q775 PolarHBondContact OE2-OE1 2.88Å; E753-Q775 VanDerWaalsContact OE2-OE1 3.08Å
754	H	82.4	Confident	77.6	Confident	14 Å²	14	58 Å²	58	7%	0.065	29%	0.294	C	S	.	.	H	α-helix	trans	-68.2	-37.9	180	174	53	0	0	0	113.1	C736 C741 F745 K750 L751 H752 R757 H758	C736-H754 PolarHBondContact SG-CD2 3.45Å; C736-H754 PolarHBondContact SG-NE2 2.91Å; C741-H754 PolarHBondContact SG-CE1 3.41Å; C741-H754 PolarHBondContact SG-NE2 3.44Å; F745-H754 HydrophobicContact CE1-CB 4.13Å; F745-H754 HydrophobicContact CE2-CB 3.95Å; F745-H754 AromaticContact CE2-CD2 3.23Å; F745-H754 WeakPolarHBondContact CE2-CD2 3.47Å; F745-H754 AromaticContact CE2-CG 3.72Å; F745-H754 HydrophobicContact CZ-CB 3.55Å; F745-H754 AromaticContact CZ-CD2 3.36Å; F745-H754 WeakPolarHBondContact CZ-CD2 3.22Å; F745-H754 AromaticContact CZ-CG 3.37Å; K750-H754 WeakPolarHBondContact O-CB 3.39Å; K750-H754 PolarHBondContact O-N 3.25Å; K750-H754 VanDerWaalsContact O-N 3.14Å; L751-H754 CarbonylContact O-C 3.44Å; L751-H754 WeakPolarHBondContact O-CB 3.49Å; L751-H754 PolarHBondContact O-N 3.1Å; L751-H754 VanDerWaalsContact O-N 3.11Å; H752-H754 VanDerWaalsContact C-N 3.27Å; H752-H754 PolarHBondContact O-N 3.1Å; H754-R757 WeakPolarHBondContact O-CB 3.48Å; H754-R757 PolarHBondContact O-N 2.89Å; H754-H758 AromaticContact CE1-CD2 3.42Å; H754-H758 PolarHBondContact CE1-CD2 2.88Å; H754-H758 VanDerWaalsContact CE1-CD2 3.42Å; H754-H758 AromaticContact CE1-NE2 3.11Å; H754-H758 PolarHBondContact CE1-NE2 2.87Å; H754-H758 AromaticContact ND1-CD2 3.98Å; H754-H758 AromaticContact NE2-CD2 3.63Å; H754-H758 AromaticContact NE2-NE2 3.36Å; H754-H758 PolarHBondContact NE2-NE2 3Å; H754-H758 PolarHBondContact O-N 2.98Å
755	V	76.6	Confident	78	Confident	5 Å²	5	58.8 Å²	58.8	3%	0.03	29%	0.293	C	S	.	.	H	α-helix	trans	-64.5	-42.3	174.1	163.7	0	0	0	0	111.1	P717 P737 F738 L751 H752 R757 H758 M759	P717-V755 HydrophobicContact CG-CG1 4.35Å; P737-V755 HydrophobicContact CG-CG2 4Å; F738-V755 HydrophobicContact CE2-CG1 4.34Å; L751-V755 HydrophobicContact CD1-CG2 3.74Å; L751-V755 HydrophobicContact CG-CG2 4.22Å; L751-V755 WeakPolarHBondContact O-CG2 3.44Å; L751-V755 PolarHBondContact O-N 2.78Å; H752-V755 PolarHBondContact O-N 2.76Å; V755-R757 PolarHBondContact O-N 3.39Å; V755-H758 PolarHBondContact O-N 3.05Å; V755-M759 HydrophobicContact CG1-SD 3.84Å; V755-M759 PolarHBondContact O-N 3.39Å
756	C	78.1	Confident	78.8	Confident	2 Å²	2	57 Å²	57	1%	0.014	29%	0.286	C	S	.	.	H	α-helix	trans	-55.9	-38.3	172.1	-66.6	0	0	0	0	112	H752 E753 H758 M759 G760 V761 V774	H752-C756 PolarHBondContact O-N 3.14Å; H752-C756 PolarHBondContact O-SG 2.74Å; H752-C756 VanDerWaalsContact O-SG 3.32Å; E753-C756 WeakPolarHBondContact O-CB 3.28Å; E753-C756 PolarHBondContact O-N 2.79Å; C756-H758 PolarHBondContact O-N 3.14Å; C756-M759 PolarHBondContact O-N 3.19Å; C756-G760 CarbonylContact O-C 3.53Å; C756-G760 PolarHBondContact O-N 3.46Å; C756-V761 PolarHBondContact O-N 3.26Å; C756-V774 HydrophobicContact CB-CG1 3.87Å
757	R	80.6	Confident	79.5	Confident	131 Å²	131	61.6 Å²	61.6	49%	0.494	31%	0.309	S	S	.	.	H	α-helix	trans	-66.3	-32.6	177	-169.3	176.6	-65.8	117.5	10.2	113.3	E753 H754 V755	E753-R757 PolarHBondContact O-N 3.35Å; E753-R757 IonicContact OE1-CZ 3.46Å; E753-R757 IonicContact OE1-NH1 3.27Å; E753-R757 PolarHBondContact OE1-NH1 3.29Å; E753-R757 IonicContact OE1-NH2 2.71Å; E753-R757 PolarHBondContact OE1-NH2 3.49Å; H754-R757 WeakPolarHBondContact O-CB 3.48Å; H754-R757 PolarHBondContact O-N 2.89Å; V755-R757 PolarHBondContact O-N 3.39Å
758	H	76.7	Confident	80.1	Confident	80 Å²	80	65.2 Å²	65.2	37%	0.37	33%	0.325	S	S	.	.	H	α-helix	trans	-72.6	-41.1	171.9	-84.1	-81	0	0	0	112.5	F738 C741 H754 V755 C756 G760	F738-H758 HydrophobicContact CD1-CB 4.37Å; F738-H758 HydrophobicContact CD2-CB 3.59Å; F738-H758 AromaticContact CD2-CD2 3.87Å; F738-H758 AromaticContact CD2-CG 3.59Å; F738-H758 HydrophobicContact CE1-CB 4.19Å; F738-H758 HydrophobicContact CE2-CB 3.37Å; F738-H758 AromaticContact CE2-CG 3.94Å; F738-H758 HydrophobicContact CG-CB 4.1Å; F738-H758 AromaticContact CG-CG 3.88Å; F738-H758 AromaticContact CG-ND1 3.94Å; F738-H758 HydrophobicContact CZ-CB 3.71Å; C741-H758 PolarHBondContact SG-NE2 3.03Å; H754-H758 AromaticContact CE1-CD2 3.42Å; H754-H758 PolarHBondContact CE1-CD2 2.88Å; H754-H758 VanDerWaalsContact CE1-CD2 3.42Å; H754-H758 AromaticContact CE1-NE2 3.11Å; H754-H758 PolarHBondContact CE1-NE2 2.87Å; H754-H758 AromaticContact ND1-CD2 3.98Å; H754-H758 AromaticContact NE2-CD2 3.63Å; H754-H758 AromaticContact NE2-NE2 3.36Å; H754-H758 PolarHBondContact NE2-NE2 3Å; H754-H758 PolarHBondContact O-N 2.98Å; V755-H758 PolarHBondContact O-N 3.05Å; C756-H758 PolarHBondContact O-N 3.14Å; H758-G760 PolarHBondContact O-N 3.24Å
759	M	73	Confident	80.8	Confident	63 Å²	63	61.4 Å²	61.4	31%	0.31	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.3	-0.7	-178.6	-62.4	176.9	67.4	0	0	113.6	V714 L716 P717 F738 V755 C756 V761	V714-M759 HydrophobicContact CG1-CE 4.17Å; L716-M759 HydrophobicContact CD2-CE 3.84Å; L716-M759 HydrophobicContact CD2-SD 3.51Å; L716-M759 VanDerWaalsContact CD2-SD 3.51Å; P717-M759 WeakPolarHBondContact CD-SD 3.39Å; P717-M759 HydrophobicContact CG-SD 4.17Å; F738-M759 HydrophobicContact CE2-CG 4.32Å; F738-M759 HydrophobicContact CZ-CG 3.81Å; V755-M759 HydrophobicContact CG1-SD 3.84Å; V755-M759 PolarHBondContact O-N 3.39Å; C756-M759 PolarHBondContact O-N 3.19Å; M759-V761 HydrophobicContact CB-CB 4.46Å; M759-V761 HydrophobicContact CB-CG2 3.78Å; M759-V761 PolarHBondContact O-N 3.21Å
760	G	79	Confident	81.5	Confident	48 Å²	48	63.7 Å²	63.7	50%	0.495	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	68.8	-4.4	-173	0	0	0	0	0	115.1	C756 H758 R762	C756-G760 CarbonylContact O-C 3.53Å; C756-G760 PolarHBondContact O-N 3.46Å; H758-G760 PolarHBondContact O-N 3.24Å; G760-R762 PolarHBondContact O-N 3.14Å
761	V	78.9	Confident	81.8	Confident	44 Å²	44	60 Å²	60	27%	0.267	30%	0.303	S	S	.	.			trans	-66	128.2	-173	177.3	0	0	0	0	110.9	L716 C756 M759 P763	L716-V761 HydrophobicContact CD2-CG2 4.41Å; C756-V761 PolarHBondContact O-N 3.26Å; M759-V761 HydrophobicContact CB-CB 4.46Å; M759-V761 HydrophobicContact CB-CG2 3.78Å; M759-V761 PolarHBondContact O-N 3.21Å; V761-P763 HydrophobicContact CG1-CG 4.02Å
762	R	82.7	Confident	82	Confident	88 Å²	88	61.9 Å²	61.9	33%	0.332	32%	0.317	S	S	.	.			trans	-126.8	82.3	-178.8	-76	171.3	138.3	89.9	-1.6	110.1	G760 F764 S772 F773 V774 F798	G760-R762 PolarHBondContact O-N 3.14Å; R762-F764 PolarHBondContact O-N 2.78Å; R762-S772 VanDerWaalsContact CD-O 3.24Å; R762-S772 WeakPolarHBondContact CD-O 3.42Å; R762-S772 WeakPolarHBondContact CD-OG 3.39Å; R762-S772 PolarHBondContact NE-O 3.03Å; R762-F773 CarbonylContact C-O 3.35Å; R762-F773 VanDerWaalsContact CA-O 3.27Å; R762-F773 WeakPolarHBondContact CA-O 3.35Å; R762-V774 HydrophobicContact CG-CG2 3.99Å; R762-F798 VanDerWaalsContact NH2-CD1 3.33Å
763	P	78.9	Confident	82.3	Confident	59 Å²	59	59.6 Å²	59.6	38%	0.383	31%	0.305	S	S	.	.			trans	-65.7	-21.8	-169.6	-21.1	33	0	0	0	114.7	V761	V761-P763 HydrophobicContact CG1-CG 4.02Å
764	F	84.1	Confident	82.3	Confident	67 Å²	67	59 Å²	59	29%	0.294	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	91	-169.1	-58.3	-76.1	0	0	0	110.2	R762 F773 V774 Q775 K776 L779	R762-F764 PolarHBondContact O-N 2.78Å; F764-F773 HydrophobicContact CB-CB 4.23Å; F764-F773 PolarHBondContact N-O 2.86Å; F764-F773 VanDerWaalsContact N-O 3.13Å; F764-F773 WeakPolarHBondContact O-CD2 3.37Å; F764-F773 PolarHBondContact O-N 3.49Å; F764-V774 WeakPolarHBondContact CD2-O 3.43Å; F764-V774 WeakPolarHBondContact CE2-O 3.46Å; F764-Q775 VanDerWaalsContact CD2-C 3.41Å; F764-K776 HydrophobicContact CD1-CB 3.81Å; F764-K776 HydrophobicContact CD1-CG 4.19Å; F764-K776 HydrophobicContact CE1-CB 3.68Å; F764-K776 HydrophobicContact CE1-CD 4.24Å; F764-K776 HydrophobicContact CE1-CG 4.22Å; F764-K776 HydrophobicContact CG-CB 4.34Å; F764-K776 HydrophobicContact CZ-CB 4.08Å; F764-L779 HydrophobicContact CB-CB 4.03Å; F764-L779 HydrophobicContact CB-CD2 3.87Å
765	V	85.8	Confident	82.2	Confident	66 Å²	66	59.6 Å²	59.6	40%	0.4	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	142.8	178.5	-174	0	0	0	0	110.5	K770 L779	V765-K770 HydrophobicContact CG1-CB 4.38Å; V765-K770 HydrophobicContact CG1-CD 4.27Å; V765-L779 WeakPolarHBondContact O-CD2 3.44Å
766	C	89.2	Confident	82.5	Confident	6 Å²	6	63.1 Å²	63.1	4%	0.041	32%	0.321	C	S	.	.			trans	-89	121.3	170.9	-178	0	0	0	0	111.7	K768 C769 K770 A771 F773 L779 H782 H786	C766-K768 VanDerWaalsContact C-N 3.27Å; C766-K768 PolarHBondContact O-N 3.36Å; C766-C769 PolarHBondContact O-N 2.81Å; C766-K770 WeakPolarHBondContact O-CA 3.31Å; C766-K770 PolarHBondContact O-N 2.69Å; C766-A771 PolarHBondContact N-O 3.49Å; C766-F773 HydrophobicContact CB-CE2 4.38Å; C766-L779 HydrophobicContact CB-CD1 3.57Å; C766-H782 VanDerWaalsContact SG-CD2 3.56Å; C766-H782 PolarHBondContact SG-NE2 2.6Å; C766-H782 VanDerWaalsContact SG-NE2 3.44Å; C766-H786 PolarHBondContact SG-NE2 2.9Å
767	D	87	Confident	82.6	Confident	132 Å²	132	69.1 Å²	69.1	71%	0.706	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.8	-36.7	-176.3	-56.6	-65.8	0	0	0	114	K770	D767-K770 WeakPolarHBondContact O-CE 3.43Å; D767-K770 PolarHBondContact O-NZ 3.09Å
768	K	85	Confident	82.7	Confident	153 Å²	153	64.3 Å²	64.3	67%	0.665	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.1	-27.4	-175.1	-73.8	-173.5	170.4	-169.8	0	115.2	C766 H786	C766-K768 VanDerWaalsContact C-N 3.27Å; C766-K768 PolarHBondContact O-N 3.36Å; K768-H786 HydrophobicContact CD-CB 3.5Å; K768-H786 PolarHBondContact NZ-O 3.34Å
769	C	89	Confident	83.3	Confident	45 Å²	45	62 Å²	62	30%	0.304	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	-143	6	-176.3	71.8	0	0	0	0	115.1	C766 A771 H782 H786	C766-C769 PolarHBondContact O-N 2.81Å; C769-A771 PolarHBondContact O-N 3.16Å; C769-H782 VanDerWaalsContact SG-CE1 3.53Å; C769-H782 PolarHBondContact SG-NE2 3.27Å; C769-H786 VanDerWaalsContact SG-CE1 3.58Å; C769-H786 PolarHBondContact SG-NE2 3.48Å; C769-H786 VanDerWaalsContact SG-NE2 3.36Å
770	K	88	Confident	83.8	Confident	127 Å²	127	66.1 Å²	66.1	55%	0.552	33%	0.33	S	S	*	.			trans	55.8	8.5	179.8	-49.2	-50	-173.5	-163	0	116.6	V765 C766 D767 S772	V765-K770 HydrophobicContact CG1-CB 4.38Å; V765-K770 HydrophobicContact CG1-CD 4.27Å; C766-K770 WeakPolarHBondContact O-CA 3.31Å; C766-K770 PolarHBondContact O-N 2.69Å; D767-K770 WeakPolarHBondContact O-CE 3.43Å; D767-K770 PolarHBondContact O-NZ 3.09Å; K770-S772 PolarHBondContact O-N 3.4Å
771	A	85.9	Confident	84	Confident	11 Å²	11	71.7 Å²	71.7	9%	0.091	34%	0.336	C	S	.	.			trans	-56.3	132.8	166.8	0	0	0	0	0	110.6	C766 C769 F773 F799	C766-A771 PolarHBondContact N-O 3.49Å; C769-A771 PolarHBondContact O-N 3.16Å; A771-F773 HydrophobicContact CB-CE2 3.91Å; A771-F773 HydrophobicContact CB-CZ 3.93Å; A771-F773 WeakPolarHBondContact O-CE2 3.45Å; A771-F799 HydrophobicContact CB-CZ 3.93Å
772	S	85.1	Confident	84.4	Confident	41 Å²	41	70.5 Å²	70.5	29%	0.287	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	139.7	-172.6	58.4	0	0	0	0	113	R762 K770	R762-S772 VanDerWaalsContact CD-O 3.24Å; R762-S772 WeakPolarHBondContact CD-O 3.42Å; R762-S772 WeakPolarHBondContact CD-OG 3.39Å; R762-S772 PolarHBondContact NE-O 3.03Å; K770-S772 PolarHBondContact O-N 3.4Å
773	F	83.5	Confident	84.4	Confident	42 Å²	42	69 Å²	69	18%	0.184	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	155.5	-167.6	-59.8	-79.8	0	0	0	112	R762 F764 C766 A771 E778 L779 H782	R762-F773 CarbonylContact C-O 3.35Å; R762-F773 VanDerWaalsContact CA-O 3.27Å; R762-F773 WeakPolarHBondContact CA-O 3.35Å; F764-F773 HydrophobicContact CB-CB 4.23Å; F764-F773 PolarHBondContact N-O 2.86Å; F764-F773 VanDerWaalsContact N-O 3.13Å; F764-F773 WeakPolarHBondContact O-CD2 3.37Å; F764-F773 PolarHBondContact O-N 3.49Å; C766-F773 HydrophobicContact CB-CE2 4.38Å; A771-F773 HydrophobicContact CB-CE2 3.91Å; A771-F773 HydrophobicContact CB-CZ 3.93Å; A771-F773 WeakPolarHBondContact O-CE2 3.45Å; F773-E778 HydrophobicContact CB-CB 3.85Å; F773-E778 HydrophobicContact CD1-CB 3.77Å; F773-E778 HydrophobicContact CG-CB 4.01Å; F773-L779 HydrophobicContact CB-CB 4.46Å; F773-L779 HydrophobicContact CD2-CB 3.98Å; F773-L779 HydrophobicContact CD2-CD1 4.12Å; F773-L779 HydrophobicContact CE2-CD1 4.32Å; F773-L779 HydrophobicContact CG-CB 4.44Å; F773-H782 HydrophobicContact CE1-CB 4.21Å; F773-H782 HydrophobicContact CE2-CB 3.91Å; F773-H782 AromaticContact CE2-CD2 3.5Å; F773-H782 AromaticContact CE2-CG 3.63Å; F773-H782 HydrophobicContact CZ-CB 3.59Å; F773-H782 AromaticContact CZ-CD2 3.7Å; F773-H782 AromaticContact CZ-CG 3.35Å; F773-H782 AromaticContact CZ-ND1 3.65Å
774	V	79.4	Confident	84.7	Confident	16 Å²	16	71.1 Å²	71.1	10%	0.097	34%	0.338	C	S	.	.	S	Bend	trans	-83.8	-23.5	179.8	-177.8	0	0	0	0	110.7	E753 C756 R762 F764 E778	E753-V774 HydrophobicContact CG-CG1 3.99Å; C756-V774 HydrophobicContact CB-CG1 3.87Å; R762-V774 HydrophobicContact CG-CG2 3.99Å; F764-V774 WeakPolarHBondContact CD2-O 3.43Å; F764-V774 WeakPolarHBondContact CE2-O 3.46Å; V774-E778 PolarHBondContact N-OE2 3.27Å
775	Q	79.2	Confident	84.5	Confident	26 Å²	26	71.1 Å²	71.1	12%	0.121	34%	0.34	C	S	.	.	S	Bend	trans	-133	142.9	-176.5	-61.2	175.6	91.3	0	0	113.4	E753 F764 Y777 E778 L779	E753-Q775 VanDerWaalsContact CD-CD 3.49Å; E753-Q775 HydrophobicContact CG-CG 3.76Å; E753-Q775 PolarHBondContact OE2-OE1 2.88Å; E753-Q775 VanDerWaalsContact OE2-OE1 3.08Å; F764-Q775 VanDerWaalsContact CD2-C 3.41Å; Q775-Y777 HydrophobicContact CB-CD1 3.81Å; Q775-Y777 HydrophobicContact CB-CE1 3.98Å; Q775-Y777 HydrophobicContact CG-CE1 4.29Å; Q775-Y777 VanDerWaalsContact NE2-CE1 3.29Å; Q775-Y777 PolarHBondContact O-N 3.16Å; Q775-Y777 VanDerWaalsContact O-N 3.15Å; Q775-E778 HydrophobicContact CB-CG 4.03Å; Q775-E778 PolarHBondContact N-OE2 3.46Å; Q775-E778 VanDerWaalsContact N-OE2 3.08Å; Q775-E778 PolarHBondContact NE2-OE1 3.3Å; Q775-E778 WeakPolarHBondContact O-CB 3.39Å; Q775-E778 PolarHBondContact O-N 2.97Å; Q775-L779 PolarHBondContact O-N 3.48Å
776	K	82.9	Confident	84.4	Confident	79 Å²	79	69.4 Å²	69.4	34%	0.343	33%	0.328	S	S	.	.	H	α-helix	trans	-58.9	-27.3	177	-166.3	162.7	-179	168.4	0	113.6	E513 F764 R780	E513-K776 VanDerWaalsContact OE1-CE 3.31Å; E513-K776 WeakPolarHBondContact OE1-CE 3.33Å; E513-K776 IonicContact OE1-NZ 3.36Å; E513-K776 PolarHBondContact OE1-NZ 2.92Å; E513-K776 IonicContact OE2-NZ 2.63Å; E513-K776 PolarHBondContact OE2-NZ 3.15Å; F764-K776 HydrophobicContact CD1-CB 3.81Å; F764-K776 HydrophobicContact CD1-CG 4.19Å; F764-K776 HydrophobicContact CE1-CB 3.68Å; F764-K776 HydrophobicContact CE1-CD 4.24Å; F764-K776 HydrophobicContact CE1-CG 4.22Å; F764-K776 HydrophobicContact CG-CB 4.34Å; F764-K776 HydrophobicContact CZ-CB 4.08Å; K776-R780 WeakPolarHBondContact O-CG 3.46Å; K776-R780 PolarHBondContact O-N 3.28Å
777	Y	81.1	Confident	83.7	Confident	128 Å²	128	76.2 Å²	76.2	50%	0.502	36%	0.363	S	S	.	.	H	α-helix	trans	-71.5	-34.3	173.9	90.5	-106.7	0	0	0	112.4	Q775 R780 R781	Q775-Y777 HydrophobicContact CB-CD1 3.81Å; Q775-Y777 HydrophobicContact CB-CE1 3.98Å; Q775-Y777 HydrophobicContact CG-CE1 4.29Å; Q775-Y777 VanDerWaalsContact NE2-CE1 3.29Å; Q775-Y777 PolarHBondContact O-N 3.16Å; Q775-Y777 VanDerWaalsContact O-N 3.15Å; Y777-R780 PolarHBondContact O-N 3.09Å; Y777-R781 WeakPolarHBondContact O-CB 3.4Å; Y777-R781 PolarHBondContact O-N 2.82Å
778	E	83.6	Confident	82.9	Confident	30 Å²	30	80.5 Å²	80.5	14%	0.14	37%	0.369	C	S	.	.	H	α-helix	trans	-65.5	-45	178.2	-65.5	163.2	-178.4	0	0	109.2	F773 V774 Q775 R781 H782	F773-E778 HydrophobicContact CB-CB 3.85Å; F773-E778 HydrophobicContact CD1-CB 3.77Å; F773-E778 HydrophobicContact CG-CB 4.01Å; V774-E778 PolarHBondContact N-OE2 3.27Å; Q775-E778 HydrophobicContact CB-CG 4.03Å; Q775-E778 PolarHBondContact N-OE2 3.46Å; Q775-E778 VanDerWaalsContact N-OE2 3.08Å; Q775-E778 PolarHBondContact NE2-OE1 3.3Å; Q775-E778 WeakPolarHBondContact O-CB 3.39Å; Q775-E778 PolarHBondContact O-N 2.97Å; E778-R781 PolarHBondContact O-N 3.46Å; E778-H782 VanDerWaalsContact O-CB 3.26Å; E778-H782 WeakPolarHBondContact O-CB 3.25Å; E778-H782 PolarHBondContact O-N 2.99Å
779	L	87.7	Confident	81.6	Confident	32 Å²	32	76.6 Å²	76.6	17%	0.168	37%	0.372	C	S	.	.	H	α-helix	trans	-59	-46.9	171.7	172.8	59.2	0	0	0	112.2	F764 V765 C766 F773 Q775 H782 S783	F764-L779 HydrophobicContact CB-CB 4.03Å; F764-L779 HydrophobicContact CB-CD2 3.87Å; V765-L779 WeakPolarHBondContact O-CD2 3.44Å; C766-L779 HydrophobicContact CB-CD1 3.57Å; F773-L779 HydrophobicContact CB-CB 4.46Å; F773-L779 HydrophobicContact CD2-CB 3.98Å; F773-L779 HydrophobicContact CD2-CD1 4.12Å; F773-L779 HydrophobicContact CE2-CD1 4.32Å; F773-L779 HydrophobicContact CG-CB 4.44Å; Q775-L779 PolarHBondContact O-N 3.48Å; L779-H782 CarbonylContact O-C 3.57Å; L779-H782 PolarHBondContact O-N 2.91Å; L779-S783 PolarHBondContact O-N 2.73Å
780	R	84.6	Confident	79.8	Confident	149 Å²	149	76.9 Å²	76.9	56%	0.562	38%	0.378	S	S	*	.	H	α-helix	trans	-63.7	-41	176.8	-77.9	-177	174.6	-178.1	-0.2	112.8	E513 K776 Y777 H782 S783 I784	E513-R780 IonicContact OE2-NH2 2.64Å; E513-R780 PolarHBondContact OE2-NH2 2.84Å; K776-R780 WeakPolarHBondContact O-CG 3.46Å; K776-R780 PolarHBondContact O-N 3.28Å; Y777-R780 PolarHBondContact O-N 3.09Å; R780-H782 VanDerWaalsContact C-N 3.3Å; R780-H782 PolarHBondContact O-N 3.3Å; R780-S783 PolarHBondContact O-N 3.01Å; R780-S783 PolarHBondContact O-OG 3.33Å; R780-I784 PolarHBondContact O-N 3.3Å
781	R	83.3	Confident	78	Confident	165 Å²	165	78.9 Å²	78.9	62%	0.623	39%	0.39	S	S	*	.	H	α-helix	trans	-64.8	-37.3	174.6	-175.4	180	63.8	-178.7	-0.4	111.3	Y777 E778	Y777-R781 WeakPolarHBondContact O-CB 3.4Å; Y777-R781 PolarHBondContact O-N 2.82Å; E778-R781 PolarHBondContact O-N 3.46Å
782	H	85.7	Confident	76.2	Confident	18 Å²	18	80.9 Å²	80.9	8%	0.083	40%	0.401	C	S	.	.	H	α-helix	trans	-69.6	-36	174.7	168.8	79.3	0	0	0	112.7	C766 C769 F773 E778 L779 R780 I784 I785 H786	C766-H782 VanDerWaalsContact SG-CD2 3.56Å; C766-H782 PolarHBondContact SG-NE2 2.6Å; C766-H782 VanDerWaalsContact SG-NE2 3.44Å; C769-H782 VanDerWaalsContact SG-CE1 3.53Å; C769-H782 PolarHBondContact SG-NE2 3.27Å; F773-H782 HydrophobicContact CE1-CB 4.21Å; F773-H782 HydrophobicContact CE2-CB 3.91Å; F773-H782 AromaticContact CE2-CD2 3.5Å; F773-H782 AromaticContact CE2-CG 3.63Å; F773-H782 HydrophobicContact CZ-CB 3.59Å; F773-H782 AromaticContact CZ-CD2 3.7Å; F773-H782 AromaticContact CZ-CG 3.35Å; F773-H782 AromaticContact CZ-ND1 3.65Å; E778-H782 VanDerWaalsContact O-CB 3.26Å; E778-H782 WeakPolarHBondContact O-CB 3.25Å; E778-H782 PolarHBondContact O-N 2.99Å; L779-H782 CarbonylContact O-C 3.57Å; L779-H782 PolarHBondContact O-N 2.91Å; R780-H782 VanDerWaalsContact C-N 3.3Å; R780-H782 PolarHBondContact O-N 3.3Å; H782-I784 PolarHBondContact O-N 3.22Å; H782-I785 WeakPolarHBondContact O-CB 3.48Å; H782-I785 WeakPolarHBondContact O-CG1 3.31Å; H782-I785 PolarHBondContact O-N 3.19Å; H782-H786 AromaticContact CD2-NE2 3.76Å; H782-H786 AromaticContact CE1-NE2 3.4Å; H782-H786 PolarHBondContact CE1-NE2 2.85Å; H782-H786 AromaticContact NE2-CD2 3.68Å; H782-H786 AromaticContact NE2-CE1 4Å; H782-H786 AromaticContact NE2-NE2 2.94Å; H782-H786 PolarHBondContact NE2-NE2 3.08Å
783	S	82.9	Confident	74.3	Confident	57 Å²	57	90.2 Å²	90.2	40%	0.399	43%	0.43	S	S	.	.	H	α-helix	trans	-66.7	-24.5	179.8	69.5	0	0	0	0	113.7	L779 R780 I785 H786 L787	L779-S783 PolarHBondContact O-N 2.73Å; R780-S783 PolarHBondContact O-N 3.01Å; R780-S783 PolarHBondContact O-OG 3.33Å; S783-I785 PolarHBondContact O-N 3.27Å; S783-H786 PolarHBondContact O-N 3.31Å; S783-L787 PolarHBondContact O-N 2.79Å
784	I	85	Confident	71.9	Confident	104 Å²	104	92.9 Å²	92.9	53%	0.533	45%	0.454	S	S	.	.	H	α-helix	trans	-61.4	-33	170.3	-61.4	167.7	0	0	0	111.5	R780 H782 H786 L787 R788	R780-I784 PolarHBondContact O-N 3.3Å; H782-I784 PolarHBondContact O-N 3.22Å; I784-H786 VanDerWaalsContact C-N 3.29Å; I784-H786 PolarHBondContact O-N 2.98Å; I784-L787 WeakPolarHBondContact O-CB 3.32Å; I784-L787 PolarHBondContact O-N 2.95Å; I784-R788 PolarHBondContact O-N 3.38Å
785	I	81.1	Confident	69.8	Low	66 Å²	66	98 Å²	98	34%	0.338	48%	0.48	S	S	.	.	H	α-helix	trans	-60.9	-42.9	177.6	-55.3	175.6	0	0	0	109.8	H782 S783 L787 R788 A790	H782-I785 WeakPolarHBondContact O-CB 3.48Å; H782-I785 WeakPolarHBondContact O-CG1 3.31Å; H782-I785 PolarHBondContact O-N 3.19Å; S783-I785 PolarHBondContact O-N 3.27Å; I785-L787 PolarHBondContact O-N 3.2Å; I785-R788 PolarHBondContact O-N 3.09Å; I785-A790 HydrophobicContact CG2-CB 4.14Å; I785-A790 VanDerWaalsContact CG2-O 3.28Å; I785-A790 WeakPolarHBondContact CG2-O 3.27Å
786	H	83	Confident	67.7	Low	31 Å²	31	101 Å²	101	14%	0.144	50%	0.504	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.9	-9	175.4	-61.2	-63.3	0	0	0	115.2	C766 K768 C769 H782 S783 I784	C766-H786 PolarHBondContact SG-NE2 2.9Å; K768-H786 HydrophobicContact CD-CB 3.5Å; K768-H786 PolarHBondContact NZ-O 3.34Å; C769-H786 VanDerWaalsContact SG-CE1 3.58Å; C769-H786 PolarHBondContact SG-NE2 3.48Å; C769-H786 VanDerWaalsContact SG-NE2 3.36Å; H782-H786 AromaticContact CD2-NE2 3.76Å; H782-H786 AromaticContact CE1-NE2 3.4Å; H782-H786 PolarHBondContact CE1-NE2 2.85Å; H782-H786 AromaticContact NE2-CD2 3.68Å; H782-H786 AromaticContact NE2-CE1 4Å; H782-H786 AromaticContact NE2-NE2 2.94Å; H782-H786 PolarHBondContact NE2-NE2 3.08Å; S783-H786 PolarHBondContact O-N 3.31Å; I784-H786 VanDerWaalsContact C-N 3.29Å; I784-H786 PolarHBondContact O-N 2.98Å
787	L	74.5	Confident	65.7	Low	149 Å²	149	108.3 Å²	108.3	78%	0.78	53%	0.529	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.1	-29.7	170.6	-173.5	63.1	0	0	0	110.9	S783 I784 I785 G789	S783-L787 PolarHBondContact O-N 2.79Å; I784-L787 WeakPolarHBondContact O-CB 3.32Å; I784-L787 PolarHBondContact O-N 2.95Å; I785-L787 PolarHBondContact O-N 3.2Å; L787-G789 VanDerWaalsContact C-N 3.27Å; L787-G789 PolarHBondContact O-N 3.15Å
788	R	69.8	Low	63.4	Low	221 Å²	221	108.2 Å²	108.2	83%	0.834	53%	0.532	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.8	12	-179.4	-143.9	179.6	-158.7	-177.4	6.8	114.5	I784 I785 A790	I784-R788 PolarHBondContact O-N 3.38Å; I785-R788 PolarHBondContact O-N 3.09Å; R788-A790 PolarHBondContact O-N 3.34Å
789	G	57.7	Low	60.9	Low	71 Å²	71	111.7 Å²	111.7	73%	0.732	55%	0.547	S	S	*	.	T	Hydrogen-bonded Turn	trans	66	-0.9	-179.2	0	0	0	0	0	115.8	L787 Q791	L787-G789 VanDerWaalsContact C-N 3.27Å; L787-G789 PolarHBondContact O-N 3.15Å; G789-Q791 PolarHBondContact O-N 3.11Å
790	A	51.9	Low	58.5	Low	52 Å²	52	116.1 Å²	116.1	43%	0.43	58%	0.576	S	S	.	*			trans	-79.3	107.7	-177.5	0	0	0	0	0	110.2	I785 R788	I785-A790 HydrophobicContact CG2-CB 4.14Å; I785-A790 VanDerWaalsContact CG2-O 3.28Å; I785-A790 WeakPolarHBondContact CG2-O 3.27Å; R788-A790 PolarHBondContact O-N 3.34Å
791	Q	50.9	Low	56.1	Low	169 Å²	169	112.6 Å²	112.6	79%	0.79	57%	0.571	S	S	*	*			trans	-57	124.9	167.7	-75.4	-69.7	-0.8	0	0	109.3	G789 R793	G789-Q791 PolarHBondContact O-N 3.11Å; Q791-R793 PolarHBondContact O-N 3.35Å
792	P	48.4	Very low	53.6	Low	52 Å²	52	109.3 Å²	109.3	34%	0.338	57%	0.571	S	S	.	*			trans	-68.6	101.6	-179.4	27.3	-33.2	0	0	0	109.6	S794	P792-S794 PolarHBondContact O-N 3.42Å
793	R	44.6	Very low	51.3	Low	238 Å²	238	111.7 Å²	111.7	90%	0.898	58%	0.582	S	S	*	*			trans	-51.9	128.4	173.4	-81.8	-175.1	170	137.1	-1.6	109.6	Q791 L795	Q791-R793 PolarHBondContact O-N 3.35Å; R793-L795 PolarHBondContact O-N 3.35Å; R793-L795 VanDerWaalsContact O-N 3.08Å
794	S	32.4	Very low	49.1	Very low	98 Å²	98	114.4 Å²	114.4	69%	0.685	59%	0.588	S	S	*	*			trans	-49.8	112.8	-172.2	-177.8	0	0	0	0	112.5	P792	P792-S794 PolarHBondContact O-N 3.42Å
795	L	35.1	Very low	46.8	Very low	122 Å²	122	113.2 Å²	113.2	64%	0.639	59%	0.586	S	S	*	*			trans	-101.7	79.7	161.9	-70	-177.1	0	0	0	108.4	R793 R797 F798	R793-L795 PolarHBondContact O-N 3.35Å; R793-L795 VanDerWaalsContact O-N 3.08Å; L795-R797 PolarHBondContact O-N 3.17Å; L795-F798 HydrophobicContact CB-CD2 4.36Å; L795-F798 PolarHBondContact O-N 3.15Å
796	S	35.4	Very low	44.8	Very low	89 Å²	89	114.1 Å²	114.1	62%	0.622	59%	0.591	S	S	*	*	G	3₁₀ helix	trans	-54.9	-10.6	177.7	49.8	0	0	0	0	115	F798 F799	S796-F798 PolarHBondContact O-N 3.29Å; S796-F798 VanDerWaalsContact O-N 3.12Å; S796-F799 PolarHBondContact O-N 2.88Å
797	R	40.4	Very low	42.8	Very low	233 Å²	233	119.1 Å²	119.1	88%	0.879	62%	0.615	S	S	*	*	G	3₁₀ helix	trans	-66.9	-1.5	171.9	-71.3	-174.1	176.5	168.6	0.1	115.1	L795	L795-R797 PolarHBondContact O-N 3.17Å
798	F	33.5	Very low	41.5	Very low	126 Å²	126	115.8 Å²	115.8	55%	0.553	60%	0.601	S	S	*	*	G	3₁₀ helix	trans	-122.9	5.5	177.9	-58.3	-59.1	0	0	0	114.8	R762 L795 S796	R762-F798 VanDerWaalsContact NH2-CD1 3.33Å; L795-F798 HydrophobicContact CB-CD2 4.36Å; L795-F798 PolarHBondContact O-N 3.15Å; S796-F798 PolarHBondContact O-N 3.29Å; S796-F798 VanDerWaalsContact O-N 3.12Å
799	F	32.3	Very low	40.1	Very low	103 Å²	103	110 Å²	110	45%	0.452	59%	0.586	S	S	.	*			trans	-126.4	102.5	-175.1	-69.7	-84	0	0	0	112.6	A771 S796	A771-F799 HydrophobicContact CB-CZ 3.93Å; S796-F799 PolarHBondContact O-N 2.88Å
800	T	35.9	Very low	39.3	Very low	126 Å²	126	113.3 Å²	113.3	77%	0.773	58%	0.582	S	S	*	*			trans	-153.1	91.1	144.2	49.5	0	0	0	0	108.9
801	T	33.5	Very low	39.2	Very low	75 Å²	75	113.7 Å²	113.7	46%	0.46	58%	0.582	S	S	.	*			trans	-75.9	132.4	147.2	42.4	0	0	0	0	106.8	Q803	T801-Q803 PolarHBondContact O-N 3.41Å
802	P	32.8	Very low	39	Very low	96 Å²	96	110.3 Å²	110.3	62%	0.623	57%	0.568	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.4	28	-173.4	-23.3	35.6	0	0	0	116.7	N806	P802-N806 PolarHBondContact O-ND2 3.42Å; P802-N806 VanDerWaalsContact O-ND2 3.12Å
803	Q	36.7	Very low	39.2	Very low	67 Å²	67	112.9 Å²	112.9	31%	0.313	58%	0.578	S	S	.	*	T	Hydrogen-bonded Turn	trans	-130.3	-45.4	-165.7	-73	171.8	-31.1	0	0	112.7	T801 T805 N806 E807	T801-Q803 PolarHBondContact O-N 3.41Å; Q803-T805 VanDerWaalsContact C-N 3.26Å; Q803-T805 PolarHBondContact O-N 2.82Å; Q803-N806 WeakPolarHBondContact O-CB 3.44Å; Q803-N806 PolarHBondContact O-N 3.31Å; Q803-E807 PolarHBondContact O-N 3.28Å
804	Q	37.2	Very low	39.4	Very low	115 Å²	115	105.5 Å²	105.5	54%	0.537	57%	0.568	S	S	.	*	H	α-helix	trans	-66.7	-26.6	178	-69.4	-171.7	-47.1	0	0	113.3	N806 T808	Q804-N806 PolarHBondContact O-N 3.47Å; Q804-T808 WeakPolarHBondContact O-CB 3.44Å; Q804-T808 PolarHBondContact O-N 3.3Å; Q804-T808 PolarHBondContact O-OG1 3.35Å
805	T	36.1	Very low	40.2	Very low	78 Å²	78	107 Å²	107	48%	0.479	57%	0.568	S	S	.	*	H	α-helix	trans	-62.1	-34.1	169.7	44.9	0	0	0	0	112	Q803 L809	Q803-T805 VanDerWaalsContact C-N 3.26Å; Q803-T805 PolarHBondContact O-N 2.82Å; T805-L809 WeakPolarHBondContact O-CB 3.49Å; T805-L809 PolarHBondContact O-N 2.82Å
806	N	37.9	Very low	40.6	Very low	85 Å²	85	104 Å²	104	46%	0.455	56%	0.557	S	S	.	*	H	α-helix	trans	-82.2	-43	-171.5	-53.4	2.1	0	0	0	109.6	P802 Q803 Q804 T808 L809 E810	P802-N806 PolarHBondContact O-ND2 3.42Å; P802-N806 VanDerWaalsContact O-ND2 3.12Å; Q803-N806 WeakPolarHBondContact O-CB 3.44Å; Q803-N806 PolarHBondContact O-N 3.31Å; Q804-N806 PolarHBondContact O-N 3.47Å; N806-T808 PolarHBondContact O-N 3.31Å; N806-L809 PolarHBondContact O-N 2.86Å; N806-L809 VanDerWaalsContact O-N 3.15Å; N806-E810 VanDerWaalsContact O-CB 3.29Å; N806-E810 WeakPolarHBondContact O-CB 3.49Å; N806-E810 WeakPolarHBondContact O-CG 3.37Å; N806-E810 PolarHBondContact O-N 2.96Å
807	E	41.7	Very low	40.8	Very low	136 Å²	136	108.8 Å²	108.8	64%	0.636	57%	0.57	S	S	*	*	H	α-helix	trans	-59.4	-36.3	172.5	-63.9	171.6	155.5	0	0	112	Q803 S811	Q803-E807 PolarHBondContact O-N 3.28Å; E807-S811 WeakPolarHBondContact O-CB 3.46Å; E807-S811 PolarHBondContact O-N 2.83Å; E807-S811 PolarHBondContact O-OG 3.09Å
808	T	47.3	Very low	40.8	Very low	80 Å²	80	103.7 Å²	103.7	49%	0.491	56%	0.559	S	S	.	*	H	α-helix	trans	-75.3	-36.1	175.2	-44.7	0	0	0	0	112.1	Q804 N806 S811 I812	Q804-T808 WeakPolarHBondContact O-CB 3.44Å; Q804-T808 PolarHBondContact O-N 3.3Å; Q804-T808 PolarHBondContact O-OG1 3.35Å; N806-T808 PolarHBondContact O-N 3.31Å; T808-S811 WeakPolarHBondContact CA-OG 3.35Å; T808-S811 PolarHBondContact O-OG 3.5Å; T808-I812 HydrophobicContact CG2-CD1 4.06Å; T808-I812 WeakPolarHBondContact O-CB 3.39Å; T808-I812 WeakPolarHBondContact O-CD1 3.25Å; T808-I812 VanDerWaalsContact O-CG1 3.23Å; T808-I812 WeakPolarHBondContact O-CG1 3.43Å; T808-I812 PolarHBondContact O-N 2.83Å; T808-I812 VanDerWaalsContact O-N 3.07Å
809	L	39.6	Very low	40.6	Very low	100 Å²	100	103.9 Å²	103.9	52%	0.524	57%	0.572	S	S	.	*	H	α-helix	trans	-75.2	-42.5	179.9	-171.4	66.4	0	0	0	112.1	T805 N806 S811 I812 I813	T805-L809 WeakPolarHBondContact O-CB 3.49Å; T805-L809 PolarHBondContact O-N 2.82Å; N806-L809 PolarHBondContact O-N 2.86Å; N806-L809 VanDerWaalsContact O-N 3.15Å; L809-S811 VanDerWaalsContact C-N 3.32Å; L809-S811 PolarHBondContact O-N 3.12Å; L809-I812 PolarHBondContact O-N 2.79Å; L809-I813 HydrophobicContact CD1-CD1 4.27Å; L809-I813 HydrophobicContact CD2-CD1 4.44Å; L809-I813 HydrophobicContact CG-CD1 3.85Å; L809-I813 HydrophobicContact CG-CG1 4.46Å; L809-I813 WeakPolarHBondContact O-CB 3.22Å; L809-I813 VanDerWaalsContact O-CG1 3.28Å; L809-I813 WeakPolarHBondContact O-CG1 3.35Å; L809-I813 PolarHBondContact O-N 3.27Å
810	E	42.3	Very low	40.8	Very low	140 Å²	140	104.9 Å²	104.9	65%	0.654	59%	0.587	S	S	*	*	H	α-helix	trans	-56.9	-45.2	172.4	-71.8	-80.1	131.6	0	0	110.7	N806 I812 I813 A814	N806-E810 VanDerWaalsContact O-CB 3.29Å; N806-E810 WeakPolarHBondContact O-CB 3.49Å; N806-E810 WeakPolarHBondContact O-CG 3.37Å; N806-E810 PolarHBondContact O-N 2.96Å; E810-I812 PolarHBondContact O-N 2.92Å; E810-I813 PolarHBondContact O-N 2.9Å; E810-A814 WeakPolarHBondContact O-CB 3.34Å; E810-A814 PolarHBondContact O-N 3.01Å
811	S	49.8	Very low	40.7	Very low	60 Å²	60	104.2 Å²	104.2	42%	0.42	59%	0.587	S	S	.	*	H	α-helix	trans	-73	-23.7	178.4	54.3	0	0	0	0	114.2	E807 T808 L809 N815	E807-S811 WeakPolarHBondContact O-CB 3.46Å; E807-S811 PolarHBondContact O-N 2.83Å; E807-S811 PolarHBondContact O-OG 3.09Å; T808-S811 WeakPolarHBondContact CA-OG 3.35Å; T808-S811 PolarHBondContact O-OG 3.5Å; L809-S811 VanDerWaalsContact C-N 3.32Å; L809-S811 PolarHBondContact O-N 3.12Å; S811-N815 PolarHBondContact O-ND2 3.07Å
812	I	45.7	Very low	40.6	Very low	98 Å²	98	107.1 Å²	107.1	50%	0.503	61%	0.605	S	S	.	*	H	α-helix	trans	-76.9	-41.2	169.6	-72.5	167.4	0	0	0	111.1	T808 L809 E810 N815 S816	T808-I812 HydrophobicContact CG2-CD1 4.06Å; T808-I812 WeakPolarHBondContact O-CB 3.39Å; T808-I812 WeakPolarHBondContact O-CD1 3.25Å; T808-I812 VanDerWaalsContact O-CG1 3.23Å; T808-I812 WeakPolarHBondContact O-CG1 3.43Å; T808-I812 PolarHBondContact O-N 2.83Å; T808-I812 VanDerWaalsContact O-N 3.07Å; L809-I812 PolarHBondContact O-N 2.79Å; E810-I812 PolarHBondContact O-N 2.92Å; I812-N815 PolarHBondContact O-N 3.49Å; I812-S816 WeakPolarHBondContact O-CB 3.2Å; I812-S816 PolarHBondContact O-N 2.79Å; I812-S816 PolarHBondContact O-OG 3.33Å
813	I	52.4	Low	40.7	Very low	106 Å²	106	108.1 Å²	108.1	54%	0.544	61%	0.609	S	S	.	*	H	α-helix	trans	-67	-44.9	178	-70.6	170.8	0	0	0	110.7	L809 E810 N815 S816	L809-I813 HydrophobicContact CD1-CD1 4.27Å; L809-I813 HydrophobicContact CD2-CD1 4.44Å; L809-I813 HydrophobicContact CG-CD1 3.85Å; L809-I813 HydrophobicContact CG-CG1 4.46Å; L809-I813 WeakPolarHBondContact O-CB 3.22Å; L809-I813 VanDerWaalsContact O-CG1 3.28Å; L809-I813 WeakPolarHBondContact O-CG1 3.35Å; L809-I813 PolarHBondContact O-N 3.27Å; E810-I813 PolarHBondContact O-N 2.9Å; I813-N815 PolarHBondContact O-N 2.78Å; I813-S816 PolarHBondContact O-N 3.02Å; I813-S816 VanDerWaalsContact O-N 3.07Å
814	A	48.7	Very low	40.6	Very low	82 Å²	82	110.9 Å²	110.9	68%	0.678	63%	0.633	S	S	*	*	H	α-helix	trans	-63.3	-23	179.8	0	0	0	0	0	114.1	E810	E810-A814 WeakPolarHBondContact O-CB 3.34Å; E810-A814 PolarHBondContact O-N 3.01Å
815	N	49.1	Very low	40.4	Very low	131 Å²	131	112.5 Å²	112.5	70%	0.701	64%	0.644	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.5	8.9	177	-72.5	-66.4	0	0	0	113.6	S811 I812 I813	S811-N815 PolarHBondContact O-ND2 3.07Å; I812-N815 PolarHBondContact O-N 3.49Å; I813-N815 PolarHBondContact O-N 2.78Å
816	S	44.7	Very low	40	Very low	58 Å²	58	115.1 Å²	115.1	41%	0.406	66%	0.66	S	S	.	*			trans	-114.4	100.4	-178.2	-63.6	0	0	0	0	111.4	I812 I813 I818	I812-S816 WeakPolarHBondContact O-CB 3.2Å; I812-S816 PolarHBondContact O-N 2.79Å; I812-S816 PolarHBondContact O-OG 3.33Å; I813-S816 PolarHBondContact O-N 3.02Å; I813-S816 VanDerWaalsContact O-N 3.07Å; S816-I818 PolarHBondContact O-N 2.87Å
817	Q	40	Very low	39.7	Very low	190 Å²	190	116 Å²	116	89%	0.888	67%	0.668	S	S	*	*			trans	-69.1	75.5	167.2	-85.1	91.6	6.4	0	0	111.7
818	I	38.6	Very low	39.2	Very low	126 Å²	126	115.6 Å²	115.6	65%	0.646	68%	0.676	S	S	*	*			trans	-134.5	110.6	172.6	-53.1	-179.8	0	0	0	108.8	S816 V820	S816-I818 PolarHBondContact O-N 2.87Å; I818-V820 HydrophobicContact CG2-CG2 4.15Å
819	P	31.2	Very low	38.4	Very low	129 Å²	129	122.3 Å²	122.3	84%	0.838	69%	0.694	S	S	*	*			trans	-79.1	123	179.1	30.9	-32.6	0	0	0	111
820	V	35.5	Very low	37.9	Very low	125 Å²	125	120.8 Å²	120.8	76%	0.758	70%	0.695	S	S	*	*			trans	-130.5	135.3	175.3	-173.6	0	0	0	0	110.1	I818	I818-V820 HydrophobicContact CG2-CG2 4.15Å
821	S	32.9	Very low	37.2	Very low	112 Å²	112	120.9 Å²	120.9	78%	0.783	71%	0.705	S	S	*	*			trans	-74.1	141.3	-175.5	-171.8	0	0	0	0	112.7
822	T	31.6	Very low	36.3	Very low	136 Å²	136	128.1 Å²	128.1	83%	0.834	73%	0.725	S	S	*	*			trans	-84.8	119.6	-179.3	41	0	0	0	0	112.3
823	T	35.9	Very low	35.6	Very low	116 Å²	116	128.6 Å²	128.6	71%	0.712	73%	0.733	S	S	*	*			trans	-132.3	134.4	160.4	50.5	0	0	0	0	109.3
824	P	34.2	Very low	34.8	Very low	126 Å²	126	129.8 Å²	129.8	82%	0.818	75%	0.745	S	S	*	*			trans	-82.4	121.4	-174.5	31	-33.2	0	0	0	111.4
825	I	32.4	Very low	33.9	Very low	149 Å²	149	134 Å²	134	76%	0.764	76%	0.757	S	S	*	*			trans	-91.9	116	172.8	-59.7	178.1	0	0	0	109.2	T827	I825-T827 PolarHBondContact O-N 2.93Å
826	T	28.5	Very low	33.1	Very low	133 Å²	133	134 Å²	134	82%	0.816	76%	0.761	S	S	*	*			trans	-82.8	108.9	177.1	-47.9	0	0	0	0	110.5
827	T	32.3	Very low	32.5	Very low	102 Å²	102	138.7 Å²	138.7	63%	0.626	78%	0.78	S	S	*	*			trans	-105.6	112.9	-179.1	-55	0	0	0	0	111.5	I825	I825-T827 PolarHBondContact O-N 2.93Å
828	T	30.2	Very low	32.1	Very low	128 Å²	128	134.7 Å²	134.7	79%	0.785	77%	0.771	S	S	*	*			trans	-81.1	123.6	177.4	-44.1	0	0	0	0	110.9	A830	T828-A830 PolarHBondContact O-N 2.89Å
829	Y	30	Very low	31.5	Very low	222 Å²	222	134.6 Å²	134.6	87%	0.871	78%	0.776	S	S	*	*			trans	-79.2	106.9	176.4	-75.6	-90.9	0	0	0	111.4
830	A	29.6	Very low	31.5	Very low	67 Å²	67	134 Å²	134	55%	0.554	77%	0.769	S	S	*	*			trans	-91.5	131.3	169.5	0	0	0	0	0	111.1	T828 Y832	T828-A830 PolarHBondContact O-N 2.89Å; A830-Y832 HydrophobicContact CB-CD2 4.28Å; A830-Y832 HydrophobicContact CB-CE2 3.69Å
831	T	28.2	Very low	31.2	Very low	142 Å²	142	134 Å²	134	87%	0.871	77%	0.77	S	S	*	*			trans	-76.7	119.5	176.3	48.2	0	0	0	0	111
832	Y	30.7	Very low	31.2	Very low	212 Å²	212	133.8 Å²	133.8	83%	0.831	76%	0.764	S	S	*	*			trans	-115.1	120.9	175.1	-77.2	-77.4	0	0	0	112.2	A830	A830-Y832 HydrophobicContact CB-CD2 4.28Å; A830-Y832 HydrophobicContact CB-CE2 3.69Å
833	T	31.6	Very low	31.2	Very low	108 Å²	108	133.2 Å²	133.2	66%	0.663	76%	0.763	S	S	*	*			trans	-94.5	149.2	168.1	46.1	0	0	0	0	110.4
834	T	34.8	Very low	31	Very low	132 Å²	132	133.8 Å²	133.8	81%	0.81	77%	0.766	S	S	*	*	S	Bend	trans	65.3	154.5	170.5	60.9	0	0	0	0	118.8	T836	T834-T836 PolarHBondContact O-N 3.45Å
835	N	30.3	Very low	30.8	Very low	171 Å²	171	133.2 Å²	133.2	91%	0.914	77%	0.765	S	S	*	*			trans	-76.9	100.1	-166.5	-60.5	-27.4	0	0	0	113.5
836	T	32.3	Very low	30.8	Very low	129 Å²	129	130.7 Å²	130.7	79%	0.791	77%	0.766	S	S	*	*			trans	-140.5	137.5	154.1	44.6	0	0	0	0	110	T834 P838	T834-T836 PolarHBondContact O-N 3.45Å; T836-P838 WeakPolarHBondContact O-CD 3.49Å
837	I	31.9	Very low	31.1	Very low	158 Å²	158	130.5 Å²	130.5	81%	0.81	77%	0.765	S	S	*	*			trans	-77.7	121.5	177.1	-61	171.4	0	0	0	108.6	T839	I837-T839 PolarHBondContact O-N 3.23Å
838	P	31.4	Very low	31.1	Very low	106 Å²	106	130.5 Å²	130.5	69%	0.688	77%	0.77	S	S	*	*			trans	-81.8	104.5	173.9	31.7	-31.4	0	0	0	110.3	T836 V840	T836-P838 WeakPolarHBondContact O-CD 3.49Å; P838-V840 HydrophobicContact CB-CG2 4.41Å; P838-V840 PolarHBondContact O-N 2.89Å
839	T	26.4	Very low	31.1	Very low	124 Å²	124	131.6 Å²	131.6	76%	0.761	77%	0.77	S	S	*	*			trans	-73.5	93.1	171.9	-50	0	0	0	0	109.9	I837 T841	I837-T839 PolarHBondContact O-N 3.23Å; T839-T841 PolarHBondContact O-N 3.17Å
840	V	31.3	Very low	31.2	Very low	115 Å²	115	127.9 Å²	127.9	70%	0.697	76%	0.763	S	S	*	*			trans	-91	94.7	178.9	-178.1	0	0	0	0	110.4	P838 T842	P838-V840 HydrophobicContact CB-CG2 4.41Å; P838-V840 PolarHBondContact O-N 2.89Å; V840-T842 HydrophobicContact CG1-CG2 4.14Å; V840-T842 PolarHBondContact O-N 3.5Å
841	T	29.2	Very low	31.3	Very low	126 Å²	126	129.2 Å²	129.2	77%	0.773	77%	0.769	S	S	*	*			trans	-83.6	103.3	166.2	48.6	0	0	0	0	110.4	T839	T839-T841 PolarHBondContact O-N 3.17Å
842	T	32.8	Very low	31.5	Very low	108 Å²	108	129.6 Å²	129.6	66%	0.663	77%	0.765	S	S	*	*			trans	-98.2	129	165.9	40.1	0	0	0	0	110.4	V840	V840-T842 HydrophobicContact CG1-CG2 4.14Å; V840-T842 PolarHBondContact O-N 3.5Å
843	P	30.7	Very low	31.6	Very low	123 Å²	123	124.6 Å²	124.6	80%	0.799	76%	0.757	S	S	*	*			trans	-79.2	123	174	31	-31.7	0	0	0	110.1
844	V	32.6	Very low	31.9	Very low	129 Å²	129	125.7 Å²	125.7	78%	0.782	76%	0.764	S	S	*	*			trans	-113.9	105	169.7	-177.2	0	0	0	0	108.6	A846	V844-A846 PolarHBondContact O-N 2.75Å
845	S	29.2	Very low	31.8	Very low	113 Å²	113	126.5 Å²	126.5	79%	0.79	76%	0.763	S	S	*	*			trans	-73	91.8	-179.7	-60.1	0	0	0	0	111.6	T847	S845-T847 PolarHBondContact O-N 3.14Å
846	A	32.7	Very low	31.9	Very low	97 Å²	97	124.1 Å²	124.1	80%	0.802	76%	0.757	S	S	*	*			trans	-90.2	76.5	171.4	0	0	0	0	0	111.1	V844 S848	V844-A846 PolarHBondContact O-N 2.75Å; A846-S848 PolarHBondContact O-N 2.92Å
847	T	34.3	Very low	32	Very low	128 Å²	128	123.9 Å²	123.9	79%	0.785	76%	0.756	S	S	*	*			trans	-74.1	101.6	170.9	46.8	0	0	0	0	111	S845	S845-T847 PolarHBondContact O-N 3.14Å
848	S	32.5	Very low	31.9	Very low	103 Å²	103	123.9 Å²	123.9	72%	0.72	76%	0.756	S	S	*	*			trans	-178.8	139.1	135.9	36.1	0	0	0	0	114.4	A846	A846-S848 PolarHBondContact O-N 2.92Å
849	L	31	Very low	31.9	Very low	150 Å²	150	123.2 Å²	123.2	79%	0.785	75%	0.754	S	S	*	*			trans	73	117.5	150.5	-65.2	162.1	0	0	0	121
850	I	32.2	Very low	31.9	Very low	144 Å²	144	123.5 Å²	123.5	74%	0.738	76%	0.755	S	S	*	*			trans	68.3	93.8	145.3	-51.6	161.4	0	0	0	115.3
851	S	30.6	Very low	31.9	Very low	96 Å²	96	124.1 Å²	124.1	67%	0.671	76%	0.759	S	S	*	*			cis	81.3	90.4	48.3	85.4	0	0	0	0	115.6
852	D	33.7	Very low	31.8	Very low	149 Å²	149	124 Å²	124	80%	0.797	76%	0.76	S	S	*	*			trans	168.3	147.3	136.4	-89.9	-18.2	0	0	0	109.8
853	T	32.7	Very low	31.7	Very low	108 Å²	108	125.4 Å²	125.4	66%	0.663	77%	0.768	S	S	*	*			cis	-176.3	143.6	-34.6	18.7	0	0	0	0	106.9
854	T	37.1	Very low	31.5	Very low	131 Å²	131	124.3 Å²	124.3	80%	0.804	76%	0.764	S	S	*	*			trans	76.5	139.8	163.9	65.8	0	0	0	0	122.9
855	N	33.1	Very low	31.2	Very low	148 Å²	148	125.4 Å²	125.4	79%	0.791	76%	0.764	S	S	*	*			trans	64.8	105	154.4	-70.1	-0	0	0	0	123
856	P	32.6	Very low	31.3	Very low	122 Å²	122	125.6 Å²	125.6	79%	0.792	77%	0.765	S	S	*	*			trans	-109.5	123.7	155.4	35.3	-24.2	0	0	0	113.2
857	T	34.5	Very low	31	Very low	124 Å²	124	127.2 Å²	127.2	76%	0.761	77%	0.765	S	S	*	*			trans	-149	105.7	167.6	32.5	0	0	0	0	114
858	I	30	Very low	30.8	Very low	158 Å²	158	129.2 Å²	129.2	81%	0.81	77%	0.77	S	S	*	*				52.5	138.3	128.6	-57.4	172.2	0	0	0	120.7
859	S	30.2	Very low	30.6	Very low	92 Å²	92	132.1 Å²	132.1	64%	0.643	77%	0.77	S	S	*	*			trans	81.8	90.5	158.8	-84.6	0	0	0	0	121.9
860	T	26.6	Very low	30.8	Very low	130 Å²	130	131.6 Å²	131.6	80%	0.798	77%	0.772	S	S	*	*				38.9	97.4	114.1	59.9	0	0	0	0	120.3
861	V	31.3	Very low	30.6	Very low	128 Å²	128	131.1 Å²	131.1	78%	0.776	77%	0.767	S	S	*	*			trans	-144.2	133.4	140	-175.2	0	0	0	0	108.3
862	P	28.2	Very low	30.7	Very low	123 Å²	123	135.4 Å²	135.4	80%	0.799	78%	0.776	S	S	*	*			trans	-81.7	141	173.5	32.9	-33.6	0	0	0	111.6
863	V	29.5	Very low	30.7	Very low	137 Å²	137	136.2 Å²	136.2	83%	0.83	78%	0.775	S	S	*	*			trans	-125	133.9	175.1	-180	0	0	0	0	109.6
864	S	26.1	Very low	30.6	Very low	100 Å²	100	137.2 Å²	137.2	70%	0.699	78%	0.784	S	S	*	*			trans	-106.1	159	177	-57.5	0	0	0	0	110.7
865	I	26.4	Very low	30.5	Very low	153 Å²	153	136.6 Å²	136.6	79%	0.785	78%	0.78	S	S	*	*			trans	66.4	116.3	164.3	-54.5	158.4	0	0	0	115.7
866	S	32.3	Very low	30.1	Very low	116 Å²	116	137.2 Å²	137.2	81%	0.811	78%	0.782	S	S	*	*			trans	-156.4	124.8	130	-84.6	0	0	0	0	110
867	T	26.6	Very low	30.1	Very low	131 Å²	131	137.8 Å²	137.8	80%	0.804	78%	0.777	S	S	*	*			trans	-75	128.4	171.2	46.2	0	0	0	0	110
868	L	29	Very low	29.8	Very low	170 Å²	170	138.4 Å²	138.4	89%	0.89	77%	0.769	S	S	*	*			trans	-100.6	108.7	159	-71.7	175.8	0	0	0	108.6
869	K	29.4	Very low	29.9	Very low	165 Å²	165	139.4 Å²	139.4	72%	0.717	77%	0.772	S	S	*	*			trans	-66.9	138.6	156.8	-81.6	-172.3	167.7	-162.2	0	108.1	E871	K869-E871 WeakPolarHBondContact CD-OE1 2.94Å; K869-E871 VanDerWaalsContact CE-OE1 3.24Å; K869-E871 WeakPolarHBondContact CE-OE1 3.38Å; K869-E871 IonicContact NZ-OE1 2.64Å; K869-E871 PolarHBondContact NZ-OE1 3.23Å
870	V	34.2	Very low	29.9	Very low	138 Å²	138	142.5 Å²	142.5	84%	0.836	78%	0.777	S	S	*	*			trans	-124.4	101.9	151.7	-179.3	0	0	0	0	105.4
871	E	28	Very low	30.3	Very low	134 Å²	134	139.5 Å²	139.5	63%	0.626	77%	0.772	S	S	*	*			trans	-102.6	125.8	162.7	-72.8	174.8	-144.5	0	0	106	K869	K869-E871 WeakPolarHBondContact CD-OE1 2.94Å; K869-E871 VanDerWaalsContact CE-OE1 3.24Å; K869-E871 WeakPolarHBondContact CE-OE1 3.38Å; K869-E871 IonicContact NZ-OE1 2.64Å; K869-E871 PolarHBondContact NZ-OE1 3.23Å
872	E	33.7	Very low	30.2	Very low	187 Å²	187	139.9 Å²	139.9	87%	0.874	77%	0.774	S	S	*	*			trans	-163.4	130.3	149.5	-112.4	158.4	-150.5	0	0	111.4
873	E	33.6	Very low	30.2	Very low	165 Å²	165	139.5 Å²	139.5	77%	0.771	77%	0.77	S	S	*	*			trans	38.4	125.9	162.2	-52.7	-141.6	126.1	0	0	123.6
874	P	30.9	Very low	30.2	Very low	129 Å²	129	141.2 Å²	141.2	84%	0.838	77%	0.769	S	S	*	*			trans	-88.3	103.8	157.2	34.1	-27.7	0	0	0	111	L876	P874-L876 PolarHBondContact O-N 2.76Å; P874-L876 VanDerWaalsContact O-N 3.09Å
875	V	33.6	Very low	30.5	Very low	119 Å²	119	145.2 Å²	145.2	72%	0.721	78%	0.777	S	S	*	*			trans	-70.2	107.3	179.9	-178.8	0	0	0	0	111.3	I877	V875-I877 HydrophobicContact CG1-CD1 4.41Å; V875-I877 HydrophobicContact CG1-CG1 4.08Å
876	L	24.9	Very low	30.9	Very low	160 Å²	160	143.6 Å²	143.6	84%	0.838	78%	0.778	S	S	*	*			trans	-87.2	111.7	178.2	-168.8	94.2	0	0	0	110.8	P874	P874-L876 PolarHBondContact O-N 2.76Å; P874-L876 VanDerWaalsContact O-N 3.09Å
877	I	33	Very low	30.7	Very low	134 Å²	134	144.3 Å²	144.3	69%	0.687	78%	0.778	S	S	*	*			trans	-110.1	98.8	172.3	-54.2	-176.9	0	0	0	110	V875 M879	V875-I877 HydrophobicContact CG1-CD1 4.41Å; V875-I877 HydrophobicContact CG1-CG1 4.08Å; I877-M879 HydrophobicContact CG2-CE 4.43Å
878	K	29.1	Very low	30.8	Very low	137 Å²	137	145.1 Å²	145.1	60%	0.596	78%	0.778	S	S	*	*			trans	-82.3	134.9	156.3	-93.5	-166.6	165	-149.6	0	109.1	E880	K878-E880 WeakPolarHBondContact CE-OE1 3.48Å; K878-E880 IonicContact NZ-OE1 2.67Å; K878-E880 PolarHBondContact NZ-OE1 3.15Å; K878-E880 IonicContact NZ-OE2 3.02Å; K878-E880 PolarHBondContact NZ-OE2 3.31Å
879	M	31.9	Very low	30.9	Very low	179 Å²	179	143 Å²	143	88%	0.882	77%	0.772	S	S	*	*			trans	-136.8	124.6	148	-79.1	-168.4	-83.2	0	0	108.3	I877	I877-M879 HydrophobicContact CG2-CE 4.43Å
880	E	29.9	Very low	30.9	Very low	157 Å²	157	146.4 Å²	146.4	73%	0.734	78%	0.78	S	S	*	*			trans	-111.5	135	-177.7	-72.7	166.1	142.5	0	0	109.3	K878	K878-E880 WeakPolarHBondContact CE-OE1 3.48Å; K878-E880 IonicContact NZ-OE1 2.67Å; K878-E880 PolarHBondContact NZ-OE1 3.15Å; K878-E880 IonicContact NZ-OE2 3.02Å; K878-E880 PolarHBondContact NZ-OE2 3.31Å
881	G	34	Very low	30.8	Very low	68 Å²	68	144.7 Å²	144.7	70%	0.701	77%	0.771	S	S	*	*			trans	177.5	116.4	174.1	0	0	0	0	0	109.8
882	V	29.5	Very low	30.8	Very low	136 Å²	136	147.6 Å²	147.6	82%	0.824	78%	0.778	S	S	*	*				70.4	119.4	54.2	177.5	0	0	0	0	110.3
883	T	29.2	Very low	30.8	Very low	114 Å²	114	146.1 Å²	146.1	70%	0.699	78%	0.776	S	S	*	*			cis	-167.9	155.9	-2.6	22.1	0	0	0	0	107.3
884	E	29.3	Very low	30.6	Very low	174 Å²	174	143.2 Å²	143.2	81%	0.813	77%	0.77	S	S	*	*			cis	-161.8	-147.8	-15.4	-148.3	-175.1	102.4	0	0	108.8
885	E	32.9	Very low	30.8	Very low	184 Å²	184	143.8 Å²	143.8	86%	0.86	77%	0.766	S	S	*	*			trans	67.8	144.2	174.6	-61.9	-173.8	157.4	0	0	116.8
886	S	34	Very low	30.9	Very low	118 Å²	118	144 Å²	144	83%	0.825	76%	0.763	S	S	*	*			cis	-144.3	166.3	7.2	49.3	0	0	0	0	111.8
887	T	28.8	Very low	31.2	Very low	132 Å²	132	143.3 Å²	143.3	81%	0.81	76%	0.755	S	S	*	*			trans	-121.3	142	-170.1	54.6	0	0	0	0	113.9
888	N	27.4	Very low	31.1	Very low	147 Å²	147	143.3 Å²	143.3	79%	0.786	76%	0.757	S	S	*	*				-179.2	179.5	123.8	-122.4	-67.5	0	0	0	116.1
889	V	31.2	Very low	31.4	Very low	127 Å²	127	142.4 Å²	142.4	77%	0.77	77%	0.768	S	S	*	*			trans	82.4	76	163.6	-158	0	0	0	0	119
890	R	29.1	Very low	31.6	Very low	236 Å²	236	139 Å²	139	89%	0.891	76%	0.757	S	S	*	*				26.4	161.8	121.6	-75.9	-166.2	169.1	-143.4	-2.9	124.5
891	P	33.5	Very low	31.8	Very low	101 Å²	101	138.3 Å²	138.3	66%	0.656	75%	0.754	S	S	*	*			trans	-123.9	-168.6	-160.5	38.4	-18.5	0	0	0	116.1
892	Y	26.4	Very low	32.1	Very low	195 Å²	195	143.7 Å²	143.7	77%	0.765	76%	0.758	S	S	*	*			trans	76.9	153.7	-176.6	-70.4	-87	0	0	0	114.2	T894	Y892-T894 HydrophobicContact CD1-CG2 4.44Å
893	D	34	Very low	32.5	Very low	156 Å²	156	143.4 Å²	143.4	83%	0.834	75%	0.751	S	S	*	*			cis	-116.7	-176	21	-74	-60.4	0	0	0	116.7
894	T	29.4	Very low	32.8	Very low	104 Å²	104	143.1 Å²	143.1	64%	0.638	75%	0.745	S	S	*	*			trans	-108.2	-177.7	-171.2	51.4	0	0	0	0	114.3	Y892	Y892-T894 HydrophobicContact CD1-CG2 4.44Å
895	D	35.3	Very low	33.1	Very low	142 Å²	142	142.5 Å²	142.5	76%	0.759	74%	0.736	S	S	*	*			trans	130.4	128.3	146.1	-66.6	5.4	0	0	0	113.3
896	D	35.5	Very low	33.5	Very low	124 Å²	124	138.5 Å²	138.5	66%	0.663	72%	0.724	S	S	*	*			cis	-155.8	165.9	-13	-161.1	9.6	0	0	0	112.3
897	Q	31.2	Very low	33.7	Very low	144 Å²	144	138.4 Å²	138.4	67%	0.673	71%	0.714	S	S	*	*			trans	38.7	101.1	167	-55.8	-50.3	-54.9	0	0	120.9
898	N	30.7	Very low	34.2	Very low	134 Å²	134	137.2 Å²	137.2	72%	0.717	70%	0.702	S	S	*	*				173.6	-7.8	117.9	-121	-52.5	0	0	0	115.9	T900	N898-T900 PolarHBondContact O-N 2.83Å
899	S	36	Very low	34.9	Very low	118 Å²	118	136.2 Å²	136.2	83%	0.825	69%	0.693	S	S	*	*	G	3₁₀ helix	trans	-68.8	-6	-165.4	-152.2	0	0	0	0	116.2
900	T	36	Very low	35.2	Very low	107 Å²	107	134 Å²	134	66%	0.656	68%	0.683	S	S	*	*	G	3₁₀ helix	trans	-78.4	-26.1	-173.9	44.7	0	0	0	0	114.5	N898 K902	N898-T900 PolarHBondContact O-N 2.83Å; T900-K902 PolarHBondContact O-N 2.88Å; T900-K902 VanDerWaalsContact O-N 3.08Å
901	H	34.2	Very low	35.6	Very low	143 Å²	143	128 Å²	128	66%	0.662	67%	0.669	S	S	*	*	G	3₁₀ helix	trans	-77.1	3.9	-170.1	-140.9	-88.7	0	0	0	115.3
902	K	39.7	Very low	35.6	Very low	181 Å²	181	127.8 Å²	127.8	79%	0.787	67%	0.668	S	S	*	*	G	3₁₀ helix	trans	-112	-3.2	-173.2	-135	171.9	-171.7	171.8	0	115.4	T900	T900-K902 PolarHBondContact O-N 2.88Å; T900-K902 VanDerWaalsContact O-N 3.08Å
903	L	38.8	Very low	36.1	Very low	131 Å²	131	127.2 Å²	127.2	69%	0.686	67%	0.673	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110.8	-31.7	174.8	-82.6	163	0	0	0	113.1	Y905 T906	L903-Y905 PolarHBondContact O-N 2.91Å; L903-T906 PolarHBondContact O-N 2.62Å
904	L	35.6	Very low	36.2	Very low	107 Å²	107	124.8 Å²	124.8	56%	0.56	66%	0.664	S	S	*	*	H	α-helix	trans	-63	-40.2	175.3	-90.3	150.8	0	0	0	113	T906 L907 L908	L904-T906 PolarHBondContact O-N 3.42Å; L904-L907 PolarHBondContact O-N 3.42Å; L904-L908 HydrophobicContact CD2-CD1 4.46Å; L904-L908 PolarHBondContact O-N 2.93Å
905	Y	36.1	Very low	36.4	Very low	162 Å²	162	126.9 Å²	126.9	64%	0.635	67%	0.67	S	S	*	*	H	α-helix	trans	-63.7	-27.6	-179.3	-136.3	-88.7	0	0	0	113.1	L903 Q909	L903-Y905 PolarHBondContact O-N 2.91Å; Y905-Q909 PolarHBondContact O-N 3.47Å
906	T	40.7	Very low	36.4	Very low	100 Å²	100	129.5 Å²	129.5	61%	0.613	68%	0.678	S	S	*	*	H	α-helix	trans	-83.6	-24.8	-179.1	-37.3	0	0	0	0	112.6	L903 L904	L903-T906 PolarHBondContact O-N 2.62Å; L904-T906 PolarHBondContact O-N 3.42Å
907	L	37.9	Very low	36.2	Very low	115 Å²	115	128.9 Å²	128.9	60%	0.602	68%	0.683	S	S	*	*	H	α-helix	trans	-89.6	-35.2	176.9	-80.4	162.6	0	0	0	112.5	L904 S910	L904-L907 PolarHBondContact O-N 3.42Å; L907-S910 PolarHBondContact O-N 2.64Å
908	L	38.6	Very low	36.6	Very low	108 Å²	108	130.2 Å²	130.2	57%	0.565	71%	0.708	S	S	*	*	H	α-helix	trans	-66.5	-40.2	175.4	-76.2	163.2	0	0	0	112	L904 S910 N911	L904-L908 HydrophobicContact CD2-CD1 4.46Å; L904-L908 PolarHBondContact O-N 2.93Å; L908-S910 PolarHBondContact O-N 3.47Å; L908-N911 PolarHBondContact O-N 3.36Å
909	Q	42.4	Very low	36.9	Very low	126 Å²	126	130 Å²	130	59%	0.589	71%	0.708	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.8	-22.6	176.7	-155.2	72.5	41	0	0	113.2	Y905	Y905-Q909 PolarHBondContact O-N 3.47Å
910	S	38.6	Very low	36.9	Very low	81 Å²	81	130.6 Å²	130.6	57%	0.566	70%	0.701	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.1	-11.1	-178.5	-169.6	0	0	0	0	114.5	L907 L908	L907-S910 PolarHBondContact O-N 2.64Å; L908-S910 PolarHBondContact O-N 3.47Å
911	N	37.2	Very low	37	Very low	110 Å²	110	131.9 Å²	131.9	59%	0.588	70%	0.704	S	S	*	*	S	Bend	trans	-115	-0.4	-171.7	-74.1	-11.3	0	0	0	113.9	L908	L908-N911 PolarHBondContact O-N 3.36Å
912	C	34	Very low	37.2	Very low	96 Å²	96	131.3 Å²	131.3	65%	0.649	71%	0.706	S	S	*	*	S	Bend	trans	-95.3	-10.6	-177.9	-69.7	0	0	0	0	114.9	T914	C912-T914 VanDerWaalsContact C-N 3.34Å
913	E	35.9	Very low	37	Very low	183 Å²	183	128.2 Å²	128.2	86%	0.855	70%	0.701	S	S	*	*	S	Bend	trans	-90	5.4	-179.5	-62.5	-170.9	155.8	0	0	113.5
914	T	36.1	Very low	36.9	Very low	105 Å²	105	128 Å²	128	64%	0.644	70%	0.702	S	S	*	*	S	Bend	trans	-116.5	8.6	-169	-6.8	0	0	0	0	115.2	C912	C912-T914 VanDerWaalsContact C-N 3.34Å
915	L	34.9	Very low	37	Very low	148 Å²	148	129.5 Å²	129.5	78%	0.775	71%	0.713	S	S	*	*	S	Bend	trans	-131	19.3	-172.6	-81.9	169.5	0	0	0	115.2
916	Q	35.4	Very low	37	Very low	197 Å²	197	127 Å²	127	92%	0.921	72%	0.718	S	S	*	*	S	Bend	trans	-109.7	37.9	172.4	-75.9	-169.2	-33.3	0	0	113
917	S	30	Very low	36.7	Very low	110 Å²	110	129.3 Å²	129.3	77%	0.769	73%	0.727	S	S	*	*			trans	-139.1	63.1	176.4	67	0	0	0	0	112.5
918	S	39.8	Very low	36.6	Very low	172 Å²	172	130.5 Å²	130.5	100%	1.203	74%	0.739	S	S	*	*			trans	-149.8	0	167.3	63.2	0	0	0	0	109.9

Retrieved 918 of 918 residues in 729.5 ms (Link to these results)

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