A0A5K4EZJ5_SCHMA Loading...

ENT domain-containing protein

AlphaFold DB , UniProt , Accession A0A5K4EZJ5, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,006 aa.

						>A0A5K4EZJ5_SCHMA|A0A5K4EZJ5
MSNVVVRTNEFSTIWPLLLDYNQRECLQILRRLELEAYSKIVAVLRAQGPLTEEKKKLLHKLQRLLSISIDRHKAEVRKALNDEELATISEAVCGKEVDEEWILEGKRISPIFQRPSPETIFISQANKASFEQLIRNSRLPCPAETATFSETFIKLAKLNDDKVDVKQPSVEQKCPPIVVTNDKVCDESKTDIHTVKESIHFSQNKNESNIKLDNSNKLTEKCSPVKTQNNPLVKSLLEPKTASIQSPSIKDNNFVVDKNSLDVMLPQKMEISSSLQMDIQQENPALPTSFSSSSSSSYTEVICAKNQVLSNQLTSLPIVTRESSSSGNSCPLKSENTSLVNCISDTILNRPSKVHESVSLNEINTSTSVDGQFTTPATTTANVVTYAISESRTIQPVFSQVNRIPITTTITSGKVLNSSNYPTVHGVNLSSLPSSSSAHTSQHLVVQMHRNPDDLLDSSQQVLTTTQRCSLINPTNSVYVCEHLTPTVTRLCSSSSPSHTNNFITNSNKLYQPISRSNLDNVIGIKRHHHQQQPRTLSSITPSVLSIQSLYNSTTSSQRFRAPQSQPSVISTNETPRQLSSITQIQNPKILKATLPVCSNVVGSTTYASNMFCSSVINITADNLPMNSNIDQSNRTSLLPQNTFIPSSSVVQFPSSISGNNVIVLHKGVARKTFTPTPSIRIGSTVPVNNNTQAIVSGSYSNASVAFPSRQFRIIGLSNTPVCSNSSTVETSIYNSEPSHVIRNINELVSIQNTPTMMTTTNVISTSSANHLLHHTSRLGSILEVDLDSDNYNDQANYYTDCHNATIHSNKLTSHCSTIVTIPQVSLSIDVSKLTPIHHNKPTVLTDESSVVNLLRTTTSTTNSIHDLHNTSSGLYTIINEQSLNNNQLPMYSEGGNVIYQREQSKTAGAAAMSTATTDSSQKCIELTSWNNDTIGSSCFSATTTTTTTTTTSSSSSSGSKTIGRLQGNPTSSSVVLFNNPPNAKRPRFELSSSTSSTASIESSH
					

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	42	Very low	47.9	Very low	231 Å²	231	147.7 Å²	147.7	100%	1.138	78%	0.777	S	S	*	*				0	109.5	0	-67.6	160.5	73.8	0	0	106.4
2	S	45.4	Very low	48.2	Very low	114 Å²	114	143.5 Å²	143.5	80%	0.797	77%	0.769	S	S	*	*			trans	-113.5	111.5	-171.7	-54.2	0	0	0	0	108.7	V4	S2-V4 PolarHBondContact O-N 3.01Å
3	N	46	Very low	48.7	Very low	153 Å²	153	141.7 Å²	141.7	82%	0.818	77%	0.766	S	S	*	*			trans	-72.7	92	-177.5	-69.5	-9.9	0	0	0	109.8	V5	N3-V5 PolarHBondContact O-N 2.92Å
4	V	51.3	Low	50.1	Low	127 Å²	127	141.1 Å²	141.1	77%	0.77	76%	0.76	S	S	*	*			trans	-67.1	100	166.8	178.5	0	0	0	0	107.2	S2 V6	S2-V4 PolarHBondContact O-N 3.01Å; V4-V6 VanDerWaalsContact C-N 3.34Å; V4-V6 PolarHBondContact O-N 2.94Å
5	V	53.2	Low	51.4	Low	110 Å²	110	146.7 Å²	146.7	67%	0.667	77%	0.767	S	S	*	*			trans	-70	94.4	174	178.7	0	0	0	0	108.1	N3 R7	N3-V5 PolarHBondContact O-N 2.92Å; V5-R7 PolarHBondContact O-N 3.42Å
6	V	46.2	Very low	52.4	Low	95 Å²	95	142.5 Å²	142.5	58%	0.576	75%	0.751	S	S	*	*			trans	-60.3	107.1	167.3	178	0	0	0	0	107.2	V4 T8	V4-V6 VanDerWaalsContact C-N 3.34Å; V4-V6 PolarHBondContact O-N 2.94Å; V6-T8 PolarHBondContact O-N 3.06Å
7	R	47.8	Very low	53.6	Low	204 Å²	204	144.1 Å²	144.1	77%	0.77	76%	0.759	S	S	*	*			trans	-79.6	114.9	174	-68.9	-169.9	-175.9	88.2	-4.2	108	V5 N9	V5-R7 PolarHBondContact O-N 3.42Å; R7-N9 PolarHBondContact O-N 3.21Å
8	T	50.4	Low	55.1	Low	130 Å²	130	143.8 Å²	143.8	80%	0.798	76%	0.757	S	S	*	*	S	Bend	trans	-69.8	70.9	179.7	52.8	0	0	0	0	112.1	V6	V6-T8 PolarHBondContact O-N 3.06Å
9	N	48.9	Very low	56.7	Low	162 Å²	162	142 Å²	142	87%	0.866	75%	0.747	S	S	*	*			trans	-123.7	29.1	173.3	-102.4	32.4	0	0	0	110.5	R7	R7-N9 PolarHBondContact O-N 3.21Å
10	E	44.8	Very low	58.2	Low	121 Å²	121	143 Å²	143	57%	0.565	75%	0.753	S	S	*	*			trans	-94.2	137.5	-169.5	-53.5	-170.1	-174.3	0	0	112	S12	E10-S12 PolarHBondContact O-N 3.12Å
11	F	51.4	Low	59.8	Low	178 Å²	178	142 Å²	142	78%	0.781	74%	0.74	S	S	*	*			trans	65.2	30.7	166.1	-48.9	-66.3	0	0	0	119.5	T13	F11-T13 VanDerWaalsContact C-N 3.34Å; F11-T13 PolarHBondContact O-N 3.3Å
12	S	50.9	Low	62.1	Low	97 Å²	97	136.2 Å²	136.2	68%	0.678	71%	0.714	S	S	*	*			trans	-81	88.2	149.2	-156.9	0	0	0	0	108.8	E10 I14	E10-S12 PolarHBondContact O-N 3.12Å; S12-I14 PolarHBondContact O-N 2.78Å
13	T	54.7	Low	64.4	Low	120 Å²	120	138.6 Å²	138.6	74%	0.736	71%	0.713	S	S	*	*			trans	-76.2	60.8	-176.8	-21.8	0	0	0	0	111.4	F11 W15	F11-T13 VanDerWaalsContact C-N 3.34Å; F11-T13 PolarHBondContact O-N 3.3Å; T13-W15 PolarHBondContact O-N 3.37Å; T13-W15 VanDerWaalsContact O-N 3.14Å
14	I	68.2	Low	66.7	Low	134 Å²	134	140.4 Å²	140.4	69%	0.687	71%	0.708	S	S	*	*			trans	-70.2	106.5	178.2	-61.7	169.7	0	0	0	107.8	S12	S12-I14 PolarHBondContact O-N 2.78Å
15	W	70.1	Confident	68.8	Low	225 Å²	225	137.9 Å²	137.9	85%	0.852	69%	0.688	S	S	*	*			trans	-57.7	132.9	161.3	-66.4	90.8	0	0	0	108.2	T13 L17	T13-W15 PolarHBondContact O-N 3.37Å; T13-W15 VanDerWaalsContact O-N 3.14Å; W15-L17 PolarHBondContact O-N 2.61Å; W15-L17 VanDerWaalsContact O-N 3.15Å
16	P	66.5	Low	70.8	Confident	79 Å²	79	135.6 Å²	135.6	51%	0.513	68%	0.676	S	S	.	*			trans	-61.4	122.1	179.6	27.2	-34.7	0	0	0	109.1	L18	P16-L18 PolarHBondContact O-N 3.33Å
17	L	73	Confident	73.2	Confident	170 Å²	170	135.3 Å²	135.3	89%	0.89	67%	0.671	S	S	*	*	S	Bend	trans	-64.3	-25.9	-172	-178.8	63	0	0	0	112.6	W15	W15-L17 PolarHBondContact O-N 2.61Å; W15-L17 VanDerWaalsContact O-N 3.15Å
18	L	82.1	Confident	75.5	Confident	138 Å²	138	131.6 Å²	131.6	72%	0.723	66%	0.662	S	S	*	*	S	Bend	trans	-122	145.1	167.3	-63.4	92.3	0	0	0	108.1	P16	P16-L18 PolarHBondContact O-N 3.33Å
19	L	85.1	Confident	77.7	Confident	110 Å²	110	128.6 Å²	128.6	58%	0.576	64%	0.64	S	S	*	*			trans	-86.7	149.3	172.6	-65.8	168.9	0	0	0	109.9	Y21	L19-Y21 HydrophobicContact CB-CD2 3.78Å; L19-Y21 HydrophobicContact CB-CE2 3.69Å; L19-Y21 HydrophobicContact CD1-CD2 4.47Å; L19-Y21 HydrophobicContact CD1-CE2 3.6Å; L19-Y21 HydrophobicContact CG-CE2 4.3Å; L19-Y21 PolarHBondContact O-N 3.05Å
20	D	86.6	Confident	79.9	Confident	162 Å²	162	124 Å²	124	87%	0.866	62%	0.616	S	S	*	*			trans	-74	54.5	-177.1	-60.9	-55.3	0	0	0	113.4
21	Y	90.4	Very high	82.4	Confident	123 Å²	123	120.3 Å²	120.3	48%	0.482	60%	0.596	S	S	.	*			trans	-92	137.7	175.3	-66.1	-51.3	0	0	0	111.9	L19 E25 C26 I29	L19-Y21 HydrophobicContact CB-CD2 3.78Å; L19-Y21 HydrophobicContact CB-CE2 3.69Å; L19-Y21 HydrophobicContact CD1-CD2 4.47Å; L19-Y21 HydrophobicContact CD1-CE2 3.6Å; L19-Y21 HydrophobicContact CG-CE2 4.3Å; L19-Y21 PolarHBondContact O-N 3.05Å; Y21-E25 HydrophobicContact CD1-CB 4.41Å; Y21-C26 VanDerWaalsContact CB-SG 3.54Å; Y21-I29 HydrophobicContact CD1-CD1 4.22Å; Y21-I29 HydrophobicContact CD2-CD1 4.05Å; Y21-I29 HydrophobicContact CE1-CD1 4.05Å; Y21-I29 HydrophobicContact CE2-CD1 3.85Å; Y21-I29 HydrophobicContact CG-CD1 4.23Å
22	N	91.6	Very high	84.6	Confident	109 Å²	109	120.1 Å²	120.1	58%	0.583	59%	0.59	S	S	*	*			trans	-71.4	153.8	169.1	-63.9	-90.3	0	0	0	110.4	R24 E25 C26	N22-R24 PolarHBondContact O-N 3.45Å; N22-E25 HydrophobicContact CB-CG 4.36Å; N22-E25 VanDerWaalsContact CB-OE2 3.28Å; N22-E25 WeakPolarHBondContact CB-OE2 3.26Å; N22-E25 PolarHBondContact N-OE2 2.82Å; N22-E25 PolarHBondContact ND2-OE2 3.48Å; N22-E25 WeakPolarHBondContact O-CA 3.41Å; N22-E25 WeakPolarHBondContact O-CB 3.28Å; N22-E25 PolarHBondContact O-N 3.03Å; N22-C26 PolarHBondContact O-N 3.35Å
23	Q	93.8	Very high	86.8	Confident	164 Å²	164	120.2 Å²	120.2	77%	0.766	58%	0.583	S	S	*	*	H	α-helix	trans	-50.9	-37.9	177.6	-171.6	-173.1	15.9	0	0	113.1	C26 L27	Q23-C26 PolarHBondContact O-N 3.34Å; Q23-L27 HydrophobicContact CG-CD1 4.38Å; Q23-L27 WeakPolarHBondContact O-CG 3.34Å; Q23-L27 PolarHBondContact O-N 3.27Å
24	R	94	Very high	88.9	Confident	191 Å²	191	115.5 Å²	115.5	72%	0.721	55%	0.552	S	S	*	*	H	α-helix	trans	-63.2	-39.2	175.8	-177.9	-179.7	-67.9	-92.9	-0.2	112.7	N22 L27 Q28	N22-R24 PolarHBondContact O-N 3.45Å; R24-L27 PolarHBondContact O-N 3.27Å; R24-Q28 WeakPolarHBondContact O-CG 3.47Å; R24-Q28 PolarHBondContact O-N 3.24Å
25	E	95.5	Very high	90.2	Very high	74 Å²	74	110.1 Å²	110.1	35%	0.346	53%	0.525	S	S	.	.	H	α-helix	trans	-73.2	-41.8	179.2	-63.8	170.1	123	0	0	110.2	Y21 N22 L27 Q28 I29	Y21-E25 HydrophobicContact CD1-CB 4.41Å; N22-E25 HydrophobicContact CB-CG 4.36Å; N22-E25 VanDerWaalsContact CB-OE2 3.28Å; N22-E25 WeakPolarHBondContact CB-OE2 3.26Å; N22-E25 PolarHBondContact N-OE2 2.82Å; N22-E25 PolarHBondContact ND2-OE2 3.48Å; N22-E25 WeakPolarHBondContact O-CA 3.41Å; N22-E25 WeakPolarHBondContact O-CB 3.28Å; N22-E25 PolarHBondContact O-N 3.03Å; E25-L27 VanDerWaalsContact C-N 3.29Å; E25-L27 PolarHBondContact O-N 3.31Å; E25-Q28 PolarHBondContact O-N 3.42Å; E25-Q28 VanDerWaalsContact O-N 3.14Å; E25-I29 WeakPolarHBondContact O-CB 3.44Å; E25-I29 VanDerWaalsContact O-CG1 3.26Å; E25-I29 WeakPolarHBondContact O-CG1 3.46Å; E25-I29 PolarHBondContact O-N 3.23Å
26	C	95.6	Very high	91.5	Very high	62 Å²	62	103.6 Å²	103.6	42%	0.419	50%	0.504	S	S	.	.	H	α-helix	trans	-55.9	-42.5	171	-65.8	0	0	0	0	112.3	Y21 N22 Q23 I29 L30	Y21-C26 VanDerWaalsContact CB-SG 3.54Å; N22-C26 PolarHBondContact O-N 3.35Å; Q23-C26 PolarHBondContact O-N 3.34Å; C26-I29 PolarHBondContact O-N 3.19Å; C26-L30 VanDerWaalsContact O-CB 3.32Å; C26-L30 WeakPolarHBondContact O-CB 3.46Å; C26-L30 PolarHBondContact O-N 3.09Å
27	L	96	Very high	93	Very high	89 Å²	89	102 Å²	102	47%	0.466	50%	0.497	S	S	.	.	H	α-helix	trans	-68.5	-36.2	176.1	-71.9	169.1	0	0	0	112.8	Q23 R24 E25 R31	Q23-L27 HydrophobicContact CG-CD1 4.38Å; Q23-L27 WeakPolarHBondContact O-CG 3.34Å; Q23-L27 PolarHBondContact O-N 3.27Å; R24-L27 PolarHBondContact O-N 3.27Å; E25-L27 VanDerWaalsContact C-N 3.29Å; E25-L27 PolarHBondContact O-N 3.31Å; L27-R31 WeakPolarHBondContact O-CB 3.45Å; L27-R31 PolarHBondContact O-N 3.16Å
28	Q	95.9	Very high	94.2	Very high	125 Å²	125	94 Å²	94	58%	0.584	46%	0.455	S	S	*	.	H	α-helix	trans	-67.9	-40.5	173.8	-75	172.8	-19.4	0	0	112.1	R24 E25 R31 R32	R24-Q28 WeakPolarHBondContact O-CG 3.47Å; R24-Q28 PolarHBondContact O-N 3.24Å; E25-Q28 PolarHBondContact O-N 3.42Å; E25-Q28 VanDerWaalsContact O-N 3.14Å; Q28-R31 PolarHBondContact O-N 3.15Å; Q28-R32 PolarHBondContact O-N 3.14Å
29	I	96.5	Very high	94.9	Very high	67 Å²	67	88.3 Å²	88.3	34%	0.344	43%	0.427	S	S	.	.	H	α-helix	trans	-64.9	-45.1	174.6	-67.6	163.8	0	0	0	110	Y21 E25 C26 R31 R32 L33	Y21-I29 HydrophobicContact CD1-CD1 4.22Å; Y21-I29 HydrophobicContact CD2-CD1 4.05Å; Y21-I29 HydrophobicContact CE1-CD1 4.05Å; Y21-I29 HydrophobicContact CE2-CD1 3.85Å; Y21-I29 HydrophobicContact CG-CD1 4.23Å; E25-I29 WeakPolarHBondContact O-CB 3.44Å; E25-I29 VanDerWaalsContact O-CG1 3.26Å; E25-I29 WeakPolarHBondContact O-CG1 3.46Å; E25-I29 PolarHBondContact O-N 3.23Å; C26-I29 PolarHBondContact O-N 3.19Å; I29-R31 PolarHBondContact O-N 3.37Å; I29-R32 PolarHBondContact O-N 3.08Å; I29-L33 HydrophobicContact CG2-CD1 4.02Å; I29-L33 WeakPolarHBondContact O-CG 3.33Å; I29-L33 PolarHBondContact O-N 2.88Å
30	L	96.5	Very high	95.5	Very high	67 Å²	67	89.5 Å²	89.5	35%	0.351	43%	0.428	S	S	.	.	H	α-helix	trans	-56.7	-50.7	173.8	177.3	60.9	0	0	0	111	C26 R32 L33 E34	C26-L30 VanDerWaalsContact O-CB 3.32Å; C26-L30 WeakPolarHBondContact O-CB 3.46Å; C26-L30 PolarHBondContact O-N 3.09Å; L30-R32 VanDerWaalsContact C-N 3.3Å; L30-R32 PolarHBondContact O-N 3.42Å; L30-L33 PolarHBondContact O-N 3.17Å; L30-E34 HydrophobicContact CD1-CG 4.43Å; L30-E34 WeakPolarHBondContact O-CG 3.33Å; L30-E34 PolarHBondContact O-N 2.95Å
31	R	96.9	Very high	96	Very high	43 Å²	43	84.3 Å²	84.3	16%	0.162	40%	0.399	C	S	.	.	H	α-helix	trans	-61	-38.6	179.5	-175.4	52.7	175.4	179.6	-1.9	112.5	L27 Q28 I29 E34 L35 L66 S67 D791	L27-R31 WeakPolarHBondContact O-CB 3.45Å; L27-R31 PolarHBondContact O-N 3.16Å; Q28-R31 PolarHBondContact O-N 3.15Å; I29-R31 PolarHBondContact O-N 3.37Å; R31-E34 WeakPolarHBondContact CD-OE2 3.34Å; R31-E34 IonicContact CZ-OE2 3.99Å; R31-E34 IonicContact NE-OE2 3.57Å; R31-E34 IonicContact NH1-OE2 3.58Å; R31-E34 PolarHBondContact NH1-OE2 2.8Å; R31-E34 PolarHBondContact O-N 2.77Å; R31-L35 HydrophobicContact CG-CD1 4.13Å; R31-L35 VanDerWaalsContact O-CG 3.25Å; R31-L35 WeakPolarHBondContact O-CG 3.32Å; R31-L35 PolarHBondContact O-N 2.82Å; R31-L35 VanDerWaalsContact O-N 3.13Å; R31-L66 PolarHBondContact NH1-O 3.24Å; R31-S67 PolarHBondContact NH1-O 3.32Å; R31-S67 PolarHBondContact NH2-O 3.27Å; R31-D791 IonicContact CZ-OD2 3.83Å; R31-D791 IonicContact NE-OD2 3.83Å; R31-D791 IonicContact NH2-OD2 1.77Å; R31-D791 PolarHBondContact NH2-OD2 3.09Å
32	R	97.1	Very high	96.3	Very high	173 Å²	173	78.5 Å²	78.5	65%	0.653	38%	0.376	S	S	*	.	H	α-helix	trans	-60.2	-45.8	172.3	176	179.3	167.2	172.9	-2.8	111.4	Q28 I29 L30 L35 E36	Q28-R32 PolarHBondContact O-N 3.14Å; I29-R32 PolarHBondContact O-N 3.08Å; L30-R32 VanDerWaalsContact C-N 3.3Å; L30-R32 PolarHBondContact O-N 3.42Å; R32-L35 PolarHBondContact O-N 2.86Å; R32-E36 IonicContact NE-OE2 3.77Å; R32-E36 VanDerWaalsContact O-CB 3.29Å; R32-E36 WeakPolarHBondContact O-CB 3.05Å; R32-E36 PolarHBondContact O-N 3.06Å
33	L	97.4	Very high	96.6	Very high	99 Å²	99	74.4 Å²	74.4	52%	0.518	36%	0.358	S	S	.	.	H	α-helix	trans	-66.7	-38	-179.8	-68.9	170	0	0	0	112.5	I29 L30 A37	I29-L33 HydrophobicContact CG2-CD1 4.02Å; I29-L33 WeakPolarHBondContact O-CG 3.33Å; I29-L33 PolarHBondContact O-N 2.88Å; L30-L33 PolarHBondContact O-N 3.17Å; L33-A37 WeakPolarHBondContact O-CB 3.22Å; L33-A37 PolarHBondContact O-N 2.99Å
34	E	97.4	Very high	96.7	Very high	21 Å²	21	70.5 Å²	70.5	10%	0.098	35%	0.345	C	S	.	.	H	α-helix	trans	-57.7	-51.5	172	-70.7	176	155.1	0	0	111.6	L30 R31 Y38 L66	L30-E34 HydrophobicContact CD1-CG 4.43Å; L30-E34 WeakPolarHBondContact O-CG 3.33Å; L30-E34 PolarHBondContact O-N 2.95Å; R31-E34 WeakPolarHBondContact CD-OE2 3.34Å; R31-E34 IonicContact CZ-OE2 3.99Å; R31-E34 IonicContact NE-OE2 3.57Å; R31-E34 IonicContact NH1-OE2 3.58Å; R31-E34 PolarHBondContact NH1-OE2 2.8Å; R31-E34 PolarHBondContact O-N 2.77Å; E34-Y38 WeakPolarHBondContact O-CB 3.43Å; E34-Y38 PolarHBondContact O-N 2.78Å; E34-L66 HydrophobicContact CB-CB 4.34Å; E34-L66 HydrophobicContact CG-CD2 4.29Å
35	L	96.9	Very high	96.8	Very high	22 Å²	22	62 Å²	62	12%	0.115	31%	0.314	C	S	.	.	H	α-helix	trans	-65.3	-42.3	-179	-67.8	170.3	0	0	0	111.6	R31 R32 S39 I68 R72	R31-L35 HydrophobicContact CG-CD1 4.13Å; R31-L35 VanDerWaalsContact O-CG 3.25Å; R31-L35 WeakPolarHBondContact O-CG 3.32Å; R31-L35 PolarHBondContact O-N 2.82Å; R31-L35 VanDerWaalsContact O-N 3.13Å; R32-L35 PolarHBondContact O-N 2.86Å; L35-S39 VanDerWaalsContact O-CB 3.27Å; L35-S39 WeakPolarHBondContact O-CB 3.17Å; L35-S39 PolarHBondContact O-N 3.15Å; L35-I68 HydrophobicContact CD2-CD1 3.87Å; L35-R72 HydrophobicContact CD2-CG 3.97Å
36	E	97.1	Very high	96.8	Very high	88 Å²	88	58.7 Å²	58.7	41%	0.411	30%	0.298	S	S	.	.	H	α-helix	trans	-66.3	-46.9	178.2	-171.9	166.2	171.1	0	0	111.3	R32 Y38 S39 K40	R32-E36 IonicContact NE-OE2 3.77Å; R32-E36 VanDerWaalsContact O-CB 3.29Å; R32-E36 WeakPolarHBondContact O-CB 3.05Å; R32-E36 PolarHBondContact O-N 3.06Å; E36-Y38 PolarHBondContact O-N 2.85Å; E36-S39 PolarHBondContact O-N 3.32Å; E36-K40 WeakPolarHBondContact O-CG 3.25Å; E36-K40 PolarHBondContact O-N 3.14Å
37	A	97.4	Very high	96.7	Very high	44 Å²	44	56.6 Å²	56.6	36%	0.364	29%	0.285	S	S	.	.	H	α-helix	trans	-60.2	-46.2	176.3	0	0	0	0	0	112.1	L33 S39 K40 I41	L33-A37 WeakPolarHBondContact O-CB 3.22Å; L33-A37 PolarHBondContact O-N 2.99Å; A37-S39 PolarHBondContact O-N 2.83Å; A37-K40 PolarHBondContact O-N 2.93Å; A37-I41 VanDerWaalsContact O-CG1 3.31Å; A37-I41 WeakPolarHBondContact O-CG1 3.45Å; A37-I41 PolarHBondContact O-N 3.11Å
38	Y	98.2	Very high	96.6	Very high	2 Å²	2	56.9 Å²	56.9	1%	0.008	28%	0.284	C	S	.	.	H	α-helix	trans	-61.6	-44.3	177.3	-167.4	-96.7	0	0	0	111.7	E34 E36 K40 I41 V42 L59 L62 Q63 L66 I68 H73 E76	E34-Y38 WeakPolarHBondContact O-CB 3.43Å; E34-Y38 PolarHBondContact O-N 2.78Å; E36-Y38 PolarHBondContact O-N 2.85Å; Y38-K40 PolarHBondContact O-N 3.06Å; Y38-I41 PolarHBondContact O-N 2.99Å; Y38-V42 HydrophobicContact CD1-CG2 3.97Å; Y38-V42 HydrophobicContact CE1-CG2 3.64Å; Y38-V42 WeakPolarHBondContact O-CG2 3.29Å; Y38-V42 PolarHBondContact O-N 2.86Å; Y38-L59 HydrophobicContact CE2-CD2 4.39Å; Y38-L59 PolarHBondContact OH-O 2.98Å; Y38-L62 HydrophobicContact CD2-CB 4.15Å; Y38-L62 HydrophobicContact CE2-CB 3.88Å; Y38-Q63 HydrophobicContact CE2-CB 4.14Å; Y38-L66 HydrophobicContact CD2-CD1 4.29Å; Y38-I68 HydrophobicContact CD1-CG1 4.22Å; Y38-I68 HydrophobicContact CD1-CG2 4.03Å; Y38-I68 HydrophobicContact CD2-CG1 3.88Å; Y38-I68 HydrophobicContact CE1-CG2 4.06Å; Y38-I68 HydrophobicContact CE2-CG1 4.36Å; Y38-I68 HydrophobicContact CG-CD1 4.14Å; Y38-I68 HydrophobicContact CG-CG1 3.79Å; Y38-I68 HydrophobicContact CG-CG2 4.46Å; Y38-H73 HydrophobicContact CE1-CB 4.23Å; Y38-H73 AromaticContact CE1-ND1 3.9Å; Y38-H73 AromaticContact CZ-ND1 3.79Å; Y38-H73 PolarHBondContact OH-ND1 2.67Å; Y38-E76 HydrophobicContact CD1-CG 4.34Å
39	S	97	Very high	96.5	Very high	19 Å²	19	51 Å²	51	13%	0.133	26%	0.257	C	S	.	.	H	α-helix	trans	-58.9	-44.5	177.3	-167.5	0	0	0	0	112.4	L35 E36 A37 V42 A43 E76 K79	L35-S39 VanDerWaalsContact O-CB 3.27Å; L35-S39 WeakPolarHBondContact O-CB 3.17Å; L35-S39 PolarHBondContact O-N 3.15Å; E36-S39 PolarHBondContact O-N 3.32Å; A37-S39 PolarHBondContact O-N 2.83Å; S39-V42 PolarHBondContact O-N 3.33Å; S39-A43 PolarHBondContact O-N 3.01Å; S39-A43 VanDerWaalsContact O-N 3.07Å; S39-E76 VanDerWaalsContact CB-OE2 3.31Å; S39-E76 WeakPolarHBondContact CB-OE2 3.26Å; S39-E76 PolarHBondContact OG-OE2 3.49Å; S39-K79 PolarHBondContact OG-NZ 2.89Å
40	K	97.3	Very high	96.3	Very high	136 Å²	136	50.3 Å²	50.3	59%	0.591	26%	0.257	S	S	*	.	H	α-helix	trans	-64.9	-37.9	176.2	-65	-64.7	-179.1	-179.1	0	112.2	E36 A37 Y38 A43 V44	E36-K40 WeakPolarHBondContact O-CG 3.25Å; E36-K40 PolarHBondContact O-N 3.14Å; A37-K40 PolarHBondContact O-N 2.93Å; Y38-K40 PolarHBondContact O-N 3.06Å; K40-A43 PolarHBondContact O-N 2.81Å; K40-V44 WeakPolarHBondContact O-CG2 3.28Å; K40-V44 PolarHBondContact O-N 3Å
41	I	97.4	Very high	96.2	Very high	53 Å²	53	47.6 Å²	47.6	27%	0.272	24%	0.242	S	C	.	.	H	α-helix	trans	-66.8	-43.2	177.1	-65	162.8	0	0	0	111.2	A37 Y38 A43 V44 L45 L62	A37-I41 VanDerWaalsContact O-CG1 3.31Å; A37-I41 WeakPolarHBondContact O-CG1 3.45Å; A37-I41 PolarHBondContact O-N 3.11Å; Y38-I41 PolarHBondContact O-N 2.99Å; I41-A43 VanDerWaalsContact C-N 3.31Å; I41-A43 PolarHBondContact O-N 3.29Å; I41-V44 PolarHBondContact O-N 2.76Å; I41-L45 HydrophobicContact CG2-CD1 4.09Å; I41-L45 HydrophobicContact CG2-CG 4.25Å; I41-L45 WeakPolarHBondContact O-CG 3.2Å; I41-L45 PolarHBondContact O-N 2.91Å; I41-L62 HydrophobicContact CD1-CD1 4.07Å; I41-L62 HydrophobicContact CD1-CD2 4.45Å; I41-L62 HydrophobicContact CG2-CD1 3.74Å
42	V	97.1	Very high	96.1	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-58.9	-44.1	174.9	175.6	0	0	0	0	110.8	Y38 S39 L45 R46 L59 E76 V77 A80	Y38-V42 HydrophobicContact CD1-CG2 3.97Å; Y38-V42 HydrophobicContact CE1-CG2 3.64Å; Y38-V42 WeakPolarHBondContact O-CG2 3.29Å; Y38-V42 PolarHBondContact O-N 2.86Å; S39-V42 PolarHBondContact O-N 3.33Å; V42-L45 PolarHBondContact O-N 3Å; V42-R46 WeakPolarHBondContact O-CB 3.31Å; V42-R46 PolarHBondContact O-N 3.03Å; V42-L59 HydrophobicContact CG2-CD2 3.71Å; V42-E76 HydrophobicContact CB-CB 4.47Å; V42-E76 HydrophobicContact CG1-CB 4.45Å; V42-E76 HydrophobicContact CG2-CB 4.23Å; V42-V77 HydrophobicContact CG1-CG2 4.21Å; V42-A80 HydrophobicContact CG1-CB 3.94Å
43	A	96.9	Very high	95.9	Very high	24 Å²	24	45.2 Å²	45.2	20%	0.198	25%	0.245	C	C	.	.	H	α-helix	trans	-61.4	-43.9	176.5	0	0	0	0	0	112.9	S39 K40 I41 R46 A47 L86	S39-A43 PolarHBondContact O-N 3.01Å; S39-A43 VanDerWaalsContact O-N 3.07Å; K40-A43 PolarHBondContact O-N 2.81Å; I41-A43 VanDerWaalsContact C-N 3.31Å; I41-A43 PolarHBondContact O-N 3.29Å; A43-R46 PolarHBondContact O-N 3.14Å; A43-A47 PolarHBondContact O-N 3.02Å; A43-L86 HydrophobicContact CB-CD1 3.65Å; A43-L86 HydrophobicContact CB-CD2 4.29Å
44	V	96.4	Very high	95.8	Very high	82 Å²	82	48 Å²	48	50%	0.497	26%	0.255	S	S	.	.	H	α-helix	trans	-63.5	-44.5	176.3	168.4	0	0	0	0	111.6	K40 I41 R46 A47 Q48	K40-V44 WeakPolarHBondContact O-CG2 3.28Å; K40-V44 PolarHBondContact O-N 3Å; I41-V44 PolarHBondContact O-N 2.76Å; V44-R46 VanDerWaalsContact C-N 3.27Å; V44-R46 PolarHBondContact O-N 2.93Å; V44-A47 PolarHBondContact O-N 3.47Å; V44-Q48 WeakPolarHBondContact O-CG 3.45Å; V44-Q48 PolarHBondContact O-N 3.44Å; V44-Q48 VanDerWaalsContact O-N 3.09Å
45	L	96	Very high	95.7	Very high	13 Å²	13	48.2 Å²	48.2	7%	0.068	26%	0.256	C	S	.	.	H	α-helix	trans	-65.9	-30.4	179.8	-68.6	-177.8	0	0	0	112.7	I41 V42 K55 L58 L59 W102	I41-L45 HydrophobicContact CG2-CD1 4.09Å; I41-L45 HydrophobicContact CG2-CG 4.25Å; I41-L45 WeakPolarHBondContact O-CG 3.2Å; I41-L45 PolarHBondContact O-N 2.91Å; V42-L45 PolarHBondContact O-N 3Å; L45-K55 HydrophobicContact CB-CD 4.43Å; L45-K55 HydrophobicContact CD2-CD 4.41Å; L45-K55 HydrophobicContact CD2-CG 4.19Å; L45-K55 PolarHBondContact O-NZ 3.1Å; L45-L58 HydrophobicContact CD1-CD2 4.48Å; L45-L59 HydrophobicContact CD1-CD1 4.2Å; L45-L59 HydrophobicContact CD1-CD2 3.81Å; L45-L59 HydrophobicContact CD1-CG 3.74Å; L45-W102 HydrophobicContact CB-CH2 3.96Å; L45-W102 HydrophobicContact CB-CZ2 4.37Å; L45-W102 WeakPolarHBondContact O-CZ2 3.46Å
46	R	95.2	Very high	95.7	Very high	4 Å²	4	49.2 Å²	49.2	2%	0.015	26%	0.259	C	S	.	.	H	α-helix	trans	-71.8	-43.2	171.8	173	58.1	177.9	179.5	1.5	112.4	V42 A43 V44 Q48 G49 A80 L86 E97 D99 W102	V42-R46 WeakPolarHBondContact O-CB 3.31Å; V42-R46 PolarHBondContact O-N 3.03Å; A43-R46 PolarHBondContact O-N 3.14Å; V44-R46 VanDerWaalsContact C-N 3.27Å; V44-R46 PolarHBondContact O-N 2.93Å; R46-Q48 PolarHBondContact O-N 2.86Å; R46-G49 PolarHBondContact O-N 3.48Å; R46-A80 HydrophobicContact CB-CB 4.07Å; R46-A80 HydrophobicContact CG-CB 4.16Å; R46-L86 HydrophobicContact CG-CB 4.11Å; R46-L86 HydrophobicContact CG-CD1 4.5Å; R46-E97 IonicContact CZ-OE1 2.76Å; R46-E97 IonicContact CZ-OE2 3.92Å; R46-E97 IonicContact NE-OE2 2.76Å; R46-E97 IonicContact NH1-OE1 3.83Å; R46-E97 PolarHBondContact NH1-OE1 3.07Å; R46-E97 IonicContact NH1-OE2 3.84Å; R46-E97 PolarHBondContact NH1-OE2 3.35Å; R46-E97 IonicContact NH2-OE2 3.7Å; R46-D99 IonicContact CZ-OD1 3.68Å; R46-D99 IonicContact NH1-OD1 3.73Å; R46-D99 PolarHBondContact NH1-OD1 3.42Å; R46-D99 IonicContact NH2-OD1 2.74Å; R46-D99 PolarHBondContact NH2-OD1 2.99Å; R46-D99 IonicContact NH2-OD2 2.89Å; R46-W102 HydrophobicContact CB-CH2 4.27Å; R46-W102 HydrophobicContact CB-CZ2 4Å
47	A	95	Very high	95.6	Very high	17 Å²	17	51 Å²	51	14%	0.14	27%	0.266	C	S	.	.	H	α-helix	trans	-63.4	-19.8	173.5	0	0	0	0	0	113.3	A43 V44 G49 L86 I89	A43-A47 PolarHBondContact O-N 3.02Å; V44-A47 PolarHBondContact O-N 3.47Å; A47-G49 VanDerWaalsContact C-N 3.25Å; A47-G49 PolarHBondContact O-N 2.98Å; A47-L86 HydrophobicContact CB-CD2 4.25Å; A47-I89 HydrophobicContact CB-CB 4.42Å; A47-I89 HydrophobicContact CB-CG2 3.89Å
48	Q	93.9	Very high	95.6	Very high	96 Å²	96	52.8 Å²	52.8	45%	0.449	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.6	17.6	169.1	-66.4	172.2	-1.8	0	0	113.5	V44 R46 K55	V44-Q48 WeakPolarHBondContact O-CG 3.45Å; V44-Q48 PolarHBondContact O-N 3.44Å; V44-Q48 VanDerWaalsContact O-N 3.09Å; R46-Q48 PolarHBondContact O-N 2.86Å; Q48-K55 VanDerWaalsContact C-NZ 3.34Å; Q48-K55 PolarHBondContact O-NZ 3.5Å
49	G	92.2	Very high	95.5	Very high	0 Å²	0	52.7 Å²	52.7	0%	0	27%	0.268	C	S	.	.			trans	69	-148.4	-179.9	0	0	0	0	0	115.3	R46 A47 K55 S90 E97 W102	R46-G49 PolarHBondContact O-N 3.48Å; A47-G49 VanDerWaalsContact C-N 3.25Å; A47-G49 PolarHBondContact O-N 2.98Å; G49-K55 PolarHBondContact O-NZ 3.28Å; G49-S90 VanDerWaalsContact CA-OG 3.23Å; G49-S90 WeakPolarHBondContact CA-OG 3.32Å; G49-E97 WeakPolarHBondContact CA-OE1 3.42Å; G49-W102 PolarHBondContact O-NE1 3.26Å
50	P	93.5	Very high	95.5	Very high	53 Å²	53	54.7 Å²	54.7	34%	0.344	28%	0.275	S	S	.	.	S	Bend	trans	-61.4	149.5	-156	22.6	-33.5	0	0	0	113.8	T52 K55 E97	P50-T52 PolarHBondContact O-N 2.96Å; P50-T52 VanDerWaalsContact O-N 3.09Å; P50-K55 WeakPolarHBondContact O-CD 3.31Å; P50-K55 WeakPolarHBondContact O-CE 3.27Å; P50-K55 PolarHBondContact O-NZ 3.47Å; P50-E97 WeakPolarHBondContact CA-OE1 3.39Å; P50-E97 HydrophobicContact CB-CG 4.41Å
51	L	94.3	Very high	95.4	Very high	10 Å²	10	54.9 Å²	54.9	5%	0.052	28%	0.276	C	S	.	.			trans	-74.2	96.5	178.5	-177.7	61.5	0	0	0	110.4	K55 K56 L59 E101 W102 E105	L51-K55 HydrophobicContact CD1-CB 3.85Å; L51-K56 HydrophobicContact CD1-CB 4.14Å; L51-K56 HydrophobicContact CD2-CD 4.49Å; L51-K56 HydrophobicContact CG-CB 4.35Å; L51-L59 HydrophobicContact CD1-CD1 4.12Å; L51-E101 HydrophobicContact CB-CB 3.96Å; L51-E101 HydrophobicContact CD2-CB 4.44Å; L51-W102 HydrophobicContact CB-CD2 3.73Å; L51-W102 HydrophobicContact CB-CE3 4.2Å; L51-W102 HydrophobicContact CB-CG 3.97Å; L51-W102 HydrophobicContact CB-CZ2 4.16Å; L51-W102 HydrophobicContact CD1-CE3 4.27Å; L51-W102 HydrophobicContact CD1-CH2 3.93Å; L51-W102 HydrophobicContact CD1-CZ2 4.18Å; L51-W102 HydrophobicContact CD1-CZ3 3.98Å; L51-W102 HydrophobicContact CD2-CD2 4.3Å; L51-W102 HydrophobicContact CD2-CE3 4.02Å; L51-W102 HydrophobicContact CD2-CZ3 4.43Å; L51-W102 HydrophobicContact CG-CD2 4.41Å; L51-W102 HydrophobicContact CG-CE3 4.4Å; L51-E105 HydrophobicContact CD2-CB 3.74Å; L51-E105 HydrophobicContact CD2-CG 4.06Å
52	T	93.6	Very high	95.4	Very high	63 Å²	63	54 Å²	54	39%	0.387	27%	0.272	S	S	.	.			trans	-75.8	156.9	171.1	69.3	0	0	0	0	111.3	P50 E54 K55 K56	P50-T52 PolarHBondContact O-N 2.96Å; P50-T52 VanDerWaalsContact O-N 3.09Å; T52-E54 PolarHBondContact O-N 3.01Å; T52-E54 VanDerWaalsContact O-N 3.11Å; T52-K55 WeakPolarHBondContact O-CB 3.33Å; T52-K55 PolarHBondContact O-N 3.02Å; T52-K55 VanDerWaalsContact O-N 3.1Å; T52-K55 PolarHBondContact OG1-N 2.64Å; T52-K56 WeakPolarHBondContact O-CB 3.17Å; T52-K56 PolarHBondContact O-N 3.46Å
53	E	93.9	Very high	95.3	Very high	104 Å²	104	55 Å²	55	49%	0.486	28%	0.276	S	S	.	.	H	α-helix	trans	-53.6	-28.8	171.8	-92.3	-69.5	111.5	0	0	113.5	K57	E53-K57 WeakPolarHBondContact O-CB 3.3Å; E53-K57 VanDerWaalsContact O-CD 3.28Å; E53-K57 WeakPolarHBondContact O-CD 3.46Å; E53-K57 WeakPolarHBondContact O-CG 3.16Å; E53-K57 PolarHBondContact O-N 2.71Å; E53-K57 WeakPolarHBondContact OE2-CE 3.36Å; E53-K57 IonicContact OE2-NZ 3.34Å; E53-K57 PolarHBondContact OE2-NZ 3.45Å
54	E	95.6	Very high	95.2	Very high	157 Å²	157	64 Å²	64	73%	0.734	31%	0.305	S	S	*	.	H	α-helix	trans	-74.4	-47.7	175.7	-61.8	-179.6	165.9	0	0	111.7	T52 K56 K57 L58	T52-E54 PolarHBondContact O-N 3.01Å; T52-E54 VanDerWaalsContact O-N 3.11Å; E54-K56 PolarHBondContact O-N 2.9Å; E54-K57 PolarHBondContact O-N 2.75Å; E54-L58 WeakPolarHBondContact O-CB 3.43Å; E54-L58 PolarHBondContact O-N 3.06Å
55	K	95.6	Very high	95.2	Very high	25 Å²	25	65.7 Å²	65.7	11%	0.109	31%	0.311	C	S	.	.	H	α-helix	trans	-56.3	-40.7	171.7	-72.2	-176.4	-178.7	177.1	0	111	L45 Q48 G49 P50 L51 T52 L58 L59	L45-K55 HydrophobicContact CB-CD 4.43Å; L45-K55 HydrophobicContact CD2-CD 4.41Å; L45-K55 HydrophobicContact CD2-CG 4.19Å; L45-K55 PolarHBondContact O-NZ 3.1Å; Q48-K55 VanDerWaalsContact C-NZ 3.34Å; Q48-K55 PolarHBondContact O-NZ 3.5Å; G49-K55 PolarHBondContact O-NZ 3.28Å; P50-K55 WeakPolarHBondContact O-CD 3.31Å; P50-K55 WeakPolarHBondContact O-CE 3.27Å; P50-K55 PolarHBondContact O-NZ 3.47Å; L51-K55 HydrophobicContact CD1-CB 3.85Å; T52-K55 WeakPolarHBondContact O-CB 3.33Å; T52-K55 PolarHBondContact O-N 3.02Å; T52-K55 VanDerWaalsContact O-N 3.1Å; T52-K55 PolarHBondContact OG1-N 2.64Å; K55-L58 WeakPolarHBondContact O-CB 3.41Å; K55-L58 PolarHBondContact O-N 2.72Å; K55-L59 WeakPolarHBondContact O-CG 3.42Å; K55-L59 PolarHBondContact O-N 3.49Å
56	K	95.3	Very high	95.2	Very high	44 Å²	44	67 Å²	67	19%	0.191	32%	0.318	C	S	.	.	H	α-helix	trans	-66	-46	177.8	-178.7	161.3	171.8	147.1	0	113	L51 T52 E54 L58 L59 H60 E105	L51-K56 HydrophobicContact CD1-CB 4.14Å; L51-K56 HydrophobicContact CD2-CD 4.49Å; L51-K56 HydrophobicContact CG-CB 4.35Å; T52-K56 WeakPolarHBondContact O-CB 3.17Å; T52-K56 PolarHBondContact O-N 3.46Å; E54-K56 PolarHBondContact O-N 2.9Å; K56-L58 VanDerWaalsContact C-N 3.31Å; K56-L58 PolarHBondContact O-N 3.29Å; K56-L59 PolarHBondContact O-N 3.03Å; K56-H60 PolarHBondContact O-CD2 3.49Å; K56-H60 VanDerWaalsContact O-CD2 3.29Å; K56-H60 PolarHBondContact O-N 3.33Å; K56-E105 WeakPolarHBondContact CE-OE2 3.43Å; K56-E105 IonicContact NZ-OE2 2.68Å; K56-E105 PolarHBondContact NZ-OE2 3.22Å
57	K	96.3	Very high	95.2	Very high	125 Å²	125	69.2 Å²	69.2	54%	0.543	33%	0.334	S	S	.	.	H	α-helix	trans	-62	-38.4	173.3	-74.7	160.5	-169.6	147.2	0	112	E53 E54 K61	E53-K57 WeakPolarHBondContact O-CB 3.3Å; E53-K57 VanDerWaalsContact O-CD 3.28Å; E53-K57 WeakPolarHBondContact O-CD 3.46Å; E53-K57 WeakPolarHBondContact O-CG 3.16Å; E53-K57 PolarHBondContact O-N 2.71Å; E53-K57 WeakPolarHBondContact OE2-CE 3.36Å; E53-K57 IonicContact OE2-NZ 3.34Å; E53-K57 PolarHBondContact OE2-NZ 3.45Å; E54-K57 PolarHBondContact O-N 2.75Å; K57-K61 WeakPolarHBondContact O-CB 3.43Å; K57-K61 PolarHBondContact O-N 2.88Å
58	L	97	Very high	95.3	Very high	81 Å²	81	68.8 Å²	68.8	42%	0.424	33%	0.329	S	S	.	.	H	α-helix	trans	-63	-47.2	173	177	61.3	0	0	0	111.7	L45 E54 K55 K56 H60 K61 L62	L45-L58 HydrophobicContact CD1-CD2 4.48Å; E54-L58 WeakPolarHBondContact O-CB 3.43Å; E54-L58 PolarHBondContact O-N 3.06Å; K55-L58 WeakPolarHBondContact O-CB 3.41Å; K55-L58 PolarHBondContact O-N 2.72Å; K56-L58 VanDerWaalsContact C-N 3.31Å; K56-L58 PolarHBondContact O-N 3.29Å; L58-H60 PolarHBondContact O-N 3.13Å; L58-K61 WeakPolarHBondContact O-CB 3.35Å; L58-K61 PolarHBondContact O-N 3.03Å; L58-K61 VanDerWaalsContact O-N 3.17Å; L58-L62 HydrophobicContact CD1-CD1 3.98Å; L58-L62 HydrophobicContact CD1-CG 4.12Å; L58-L62 HydrophobicContact CG-CD1 3.92Å; L58-L62 HydrophobicContact CG-CG 4.49Å; L58-L62 WeakPolarHBondContact O-CG 3.36Å; L58-L62 PolarHBondContact O-N 2.88Å
59	L	96.7	Very high	95.3	Very high	0 Å²	0	66.1 Å²	66.1	0%	0	32%	0.321	C	S	.	.	H	α-helix	trans	-58.3	-47.8	176.6	-78.3	173.3	0	0	0	111.9	Y38 V42 L45 L51 K55 K56 K61 L62 Q63 H73 W102	Y38-L59 HydrophobicContact CE2-CD2 4.39Å; Y38-L59 PolarHBondContact OH-O 2.98Å; V42-L59 HydrophobicContact CG2-CD2 3.71Å; L45-L59 HydrophobicContact CD1-CD1 4.2Å; L45-L59 HydrophobicContact CD1-CD2 3.81Å; L45-L59 HydrophobicContact CD1-CG 3.74Å; L51-L59 HydrophobicContact CD1-CD1 4.12Å; K55-L59 WeakPolarHBondContact O-CG 3.42Å; K55-L59 PolarHBondContact O-N 3.49Å; K56-L59 PolarHBondContact O-N 3.03Å; L59-K61 VanDerWaalsContact C-N 3.31Å; L59-K61 PolarHBondContact O-N 2.9Å; L59-L62 PolarHBondContact O-N 2.7Å; L59-Q63 WeakPolarHBondContact O-CB 3.39Å; L59-Q63 PolarHBondContact O-N 2.87Å; L59-H73 VanDerWaalsContact CD1-CE1 3.47Å; L59-H73 WeakPolarHBondContact CD1-CE1 3.3Å; L59-W102 HydrophobicContact CD1-CH2 4.36Å; L59-W102 HydrophobicContact CD1-CZ3 4.14Å
60	H	95.5	Very high	95.4	Very high	61 Å²	61	71.3 Å²	71.3	28%	0.282	35%	0.348	S	S	.	.	H	α-helix	trans	-65.8	-29.9	176.2	-65.5	-47.4	0	0	0	113.8	K56 L58 Q63 R64 H73 E105	K56-H60 PolarHBondContact O-CD2 3.49Å; K56-H60 VanDerWaalsContact O-CD2 3.29Å; K56-H60 PolarHBondContact O-N 3.33Å; L58-H60 PolarHBondContact O-N 3.13Å; H60-Q63 PolarHBondContact ND1-OE1 2.76Å; H60-R64 WeakPolarHBondContact O-CG 3.33Å; H60-R64 PolarHBondContact O-N 3.41Å; H60-H73 AromaticContact CE1-NE2 3.55Å; H60-E105 IonicContact CE1-OE1 3.62Å; H60-E105 PolarHBondContact CE1-OE1 3.12Å; H60-E105 IonicContact NE2-OE1 3.15Å
61	K	96.6	Very high	95.5	Very high	141 Å²	141	73.9 Å²	73.9	61%	0.613	36%	0.359	S	S	*	.	H	α-helix	trans	-67.9	-48	172.6	-174.5	179.9	178.4	-177.5	0	110.9	K57 L58 L59 Q63 R64 L65	K57-K61 WeakPolarHBondContact O-CB 3.43Å; K57-K61 PolarHBondContact O-N 2.88Å; L58-K61 WeakPolarHBondContact O-CB 3.35Å; L58-K61 PolarHBondContact O-N 3.03Å; L58-K61 VanDerWaalsContact O-N 3.17Å; L59-K61 VanDerWaalsContact C-N 3.31Å; L59-K61 PolarHBondContact O-N 2.9Å; K61-Q63 VanDerWaalsContact C-N 3.34Å; K61-R64 PolarHBondContact O-N 2.95Å; K61-L65 HydrophobicContact CG-CD1 4.08Å; K61-L65 WeakPolarHBondContact O-CG 3.45Å; K61-L65 PolarHBondContact O-N 3.17Å; K61-L65 VanDerWaalsContact O-N 3.09Å
62	L	96.8	Very high	95.5	Very high	34 Å²	34	75 Å²	75	18%	0.178	36%	0.362	C	S	.	.	H	α-helix	trans	-63.4	-39.4	176.7	-70.8	168.4	0	0	0	112.1	Y38 I41 L58 L59 R64 L65 L66	Y38-L62 HydrophobicContact CD2-CB 4.15Å; Y38-L62 HydrophobicContact CE2-CB 3.88Å; I41-L62 HydrophobicContact CD1-CD1 4.07Å; I41-L62 HydrophobicContact CD1-CD2 4.45Å; I41-L62 HydrophobicContact CG2-CD1 3.74Å; L58-L62 HydrophobicContact CD1-CD1 3.98Å; L58-L62 HydrophobicContact CD1-CG 4.12Å; L58-L62 HydrophobicContact CG-CD1 3.92Å; L58-L62 HydrophobicContact CG-CG 4.49Å; L58-L62 WeakPolarHBondContact O-CG 3.36Å; L58-L62 PolarHBondContact O-N 2.88Å; L59-L62 PolarHBondContact O-N 2.7Å; L62-R64 VanDerWaalsContact C-N 3.26Å; L62-R64 PolarHBondContact O-N 3.49Å; L62-L65 PolarHBondContact O-N 3.21Å; L62-L65 VanDerWaalsContact O-N 3.12Å; L62-L66 PolarHBondContact O-N 2.82Å
63	Q	95.7	Very high	95.7	Very high	20 Å²	20	72 Å²	72	9%	0.093	34%	0.344	C	S	.	.	H	α-helix	trans	-55.4	-42.8	176.2	-174.1	-168.5	-0.9	0	0	111.3	Y38 L59 H60 K61 S67 I68 H73	Y38-Q63 HydrophobicContact CE2-CB 4.14Å; L59-Q63 WeakPolarHBondContact O-CB 3.39Å; L59-Q63 PolarHBondContact O-N 2.87Å; H60-Q63 PolarHBondContact ND1-OE1 2.76Å; K61-Q63 VanDerWaalsContact C-N 3.34Å; Q63-S67 PolarHBondContact O-N 3.28Å; Q63-I68 HydrophobicContact CG-CB 3.92Å; Q63-I68 HydrophobicContact CG-CG2 4.44Å; Q63-I68 WeakPolarHBondContact CG-O 3.3Å; Q63-I68 PolarHBondContact NE2-O 2.75Å; Q63-I68 PolarHBondContact O-N 3.22Å; Q63-H73 HydrophobicContact CG-CB 4.32Å
64	R	94.9	Very high	95.8	Very high	214 Å²	214	69.9 Å²	69.9	81%	0.808	33%	0.333	S	S	*	.	H	α-helix	trans	-73.2	-37.1	176.4	-68.1	175.6	-176.2	-169.6	0.7	112.9	H60 K61 L62	H60-R64 WeakPolarHBondContact O-CG 3.33Å; H60-R64 PolarHBondContact O-N 3.41Å; K61-R64 PolarHBondContact O-N 2.95Å; L62-R64 VanDerWaalsContact C-N 3.26Å; L62-R64 PolarHBondContact O-N 3.49Å
65	L	96.2	Very high	95.8	Very high	117 Å²	117	63.3 Å²	63.3	61%	0.613	31%	0.305	S	S	*	.	H	α-helix	trans	-71.4	-31.1	-179.5	-71.1	169.3	0	0	0	113.4	K61 L62	K61-L65 HydrophobicContact CG-CD1 4.08Å; K61-L65 WeakPolarHBondContact O-CG 3.45Å; K61-L65 PolarHBondContact O-N 3.17Å; K61-L65 VanDerWaalsContact O-N 3.09Å; L62-L65 PolarHBondContact O-N 3.21Å; L62-L65 VanDerWaalsContact O-N 3.12Å
66	L	95.8	Very high	95.8	Very high	40 Å²	40	62.5 Å²	62.5	21%	0.209	30%	0.302	C	S	.	.	T	Hydrogen-bonded Turn	trans	-106.3	18.1	-179.3	-59.3	177.6	0	0	0	112.7	R31 E34 Y38 L62 I68	R31-L66 PolarHBondContact NH1-O 3.24Å; E34-L66 HydrophobicContact CB-CB 4.34Å; E34-L66 HydrophobicContact CG-CD2 4.29Å; Y38-L66 HydrophobicContact CD2-CD1 4.29Å; L62-L66 PolarHBondContact O-N 2.82Å; L66-I68 VanDerWaalsContact C-N 3.29Å; L66-I68 HydrophobicContact CB-CD1 4.06Å; L66-I68 HydrophobicContact CB-CG1 3.84Å; L66-I68 VanDerWaalsContact O-CD1 3.28Å; L66-I68 WeakPolarHBondContact O-CD1 3.22Å; L66-I68 WeakPolarHBondContact O-CG1 3.42Å; L66-I68 PolarHBondContact O-N 3Å; L66-I68 VanDerWaalsContact O-N 3.16Å
67	S	95	Very high	95.8	Very high	51 Å²	51	60.4 Å²	60.4	36%	0.357	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	48.1	43.8	178.4	-55.6	0	0	0	0	114.3	R31 Q63	R31-S67 PolarHBondContact NH1-O 3.32Å; R31-S67 PolarHBondContact NH2-O 3.27Å; Q63-S67 PolarHBondContact O-N 3.28Å
68	I	96.7	Very high	95.8	Very high	9 Å²	9	55.9 Å²	55.9	5%	0.046	27%	0.272	C	S	.	.			trans	-89.5	121.3	-174.4	-52.3	-66.3	0	0	0	110	L35 Y38 Q63 L66 R72 H73	L35-I68 HydrophobicContact CD2-CD1 3.87Å; Y38-I68 HydrophobicContact CD1-CG1 4.22Å; Y38-I68 HydrophobicContact CD1-CG2 4.03Å; Y38-I68 HydrophobicContact CD2-CG1 3.88Å; Y38-I68 HydrophobicContact CE1-CG2 4.06Å; Y38-I68 HydrophobicContact CE2-CG1 4.36Å; Y38-I68 HydrophobicContact CG-CD1 4.14Å; Y38-I68 HydrophobicContact CG-CG1 3.79Å; Y38-I68 HydrophobicContact CG-CG2 4.46Å; Q63-I68 HydrophobicContact CG-CB 3.92Å; Q63-I68 HydrophobicContact CG-CG2 4.44Å; Q63-I68 WeakPolarHBondContact CG-O 3.3Å; Q63-I68 PolarHBondContact NE2-O 2.75Å; Q63-I68 PolarHBondContact O-N 3.22Å; L66-I68 VanDerWaalsContact C-N 3.29Å; L66-I68 HydrophobicContact CB-CD1 4.06Å; L66-I68 HydrophobicContact CB-CG1 3.84Å; L66-I68 VanDerWaalsContact O-CD1 3.28Å; L66-I68 WeakPolarHBondContact O-CD1 3.22Å; L66-I68 WeakPolarHBondContact O-CG1 3.42Å; L66-I68 PolarHBondContact O-N 3Å; L66-I68 VanDerWaalsContact O-N 3.16Å; I68-R72 HydrophobicContact CG2-CB 4.04Å; I68-R72 HydrophobicContact CG2-CG 3.97Å; I68-H73 HydrophobicContact CG2-CB 4.25Å
69	S	95	Very high	95.8	Very high	40 Å²	40	57.4 Å²	57.4	28%	0.28	28%	0.276	S	S	.	.			trans	-62.8	152.7	178.5	65.7	0	0	0	0	111.9	D71 R72 H73 D791	S69-D71 VanDerWaalsContact C-N 3.3Å; S69-D71 PolarHBondContact O-N 3.3Å; S69-R72 PolarHBondContact O-N 2.99Å; S69-R72 VanDerWaalsContact O-N 3.16Å; S69-R72 WeakPolarHBondContact OG-CB 3.48Å; S69-R72 PolarHBondContact OG-N 2.76Å; S69-H73 PolarHBondContact O-N 2.76Å; S69-D791 VanDerWaalsContact CB-OD1 3.26Å; S69-D791 WeakPolarHBondContact CB-OD1 3.15Å; S69-D791 PolarHBondContact OG-OD1 3.44Å
70	I	94	Very high	95.7	Very high	108 Å²	108	57.7 Å²	57.7	55%	0.554	28%	0.278	S	S	*	.	H	α-helix	trans	-61.4	-40.9	-176	-62.6	171.1	0	0	0	110.8	H73 K74	I70-H73 PolarHBondContact O-N 2.65Å; I70-K74 HydrophobicContact CG2-CD 4.43Å; I70-K74 WeakPolarHBondContact O-CG 3.37Å; I70-K74 PolarHBondContact O-N 2.8Å
71	D	93.8	Very high	95.6	Very high	107 Å²	107	56.1 Å²	56.1	57%	0.572	27%	0.271	S	S	*	.	H	α-helix	trans	-69.9	-32.1	177.4	-71.2	-67.4	0	0	0	113.2	S69 A75	S69-D71 VanDerWaalsContact C-N 3.3Å; S69-D71 PolarHBondContact O-N 3.3Å; D71-A75 VanDerWaalsContact O-CB 3.3Å; D71-A75 WeakPolarHBondContact O-CB 3.39Å; D71-A75 PolarHBondContact O-N 3.03Å
72	R	95.3	Very high	95.4	Very high	33 Å²	33	56 Å²	56	13%	0.125	28%	0.277	C	S	.	.	H	α-helix	trans	-67.6	-46.9	171.6	-175.7	58.6	-180	-115.7	12.3	111.8	L35 I68 S69 K74 A75 E76 D789	L35-R72 HydrophobicContact CD2-CG 3.97Å; I68-R72 HydrophobicContact CG2-CB 4.04Å; I68-R72 HydrophobicContact CG2-CG 3.97Å; S69-R72 PolarHBondContact O-N 2.99Å; S69-R72 VanDerWaalsContact O-N 3.16Å; S69-R72 WeakPolarHBondContact OG-CB 3.48Å; S69-R72 PolarHBondContact OG-N 2.76Å; R72-K74 PolarHBondContact O-N 3Å; R72-A75 WeakPolarHBondContact O-CA 3.48Å; R72-A75 WeakPolarHBondContact O-CB 3.42Å; R72-A75 PolarHBondContact O-N 2.81Å; R72-E76 IonicContact CZ-OE1 3.33Å; R72-E76 IonicContact NE-OE1 3.2Å; R72-E76 PolarHBondContact NE-OE1 3.35Å; R72-E76 IonicContact NH2-OE1 3.61Å; R72-E76 PolarHBondContact NH2-OE1 3.03Å; R72-E76 PolarHBondContact O-N 3.3Å; R72-D789 IonicContact CZ-OD1 3.93Å; R72-D789 IonicContact NH1-OD1 2.69Å; R72-D789 PolarHBondContact NH1-OD1 3.36Å; R72-D789 IonicContact NH2-OD1 3.69Å
73	H	97	Very high	95.4	Very high	2 Å²	2	57.5 Å²	57.5	1%	0.009	29%	0.286	C	S	.	.	H	α-helix	trans	-51.8	-54	172.8	159	56.1	0	0	0	111.1	Y38 L59 H60 Q63 I68 S69 I70 A75 E76 V77 E105	Y38-H73 HydrophobicContact CE1-CB 4.23Å; Y38-H73 AromaticContact CE1-ND1 3.9Å; Y38-H73 AromaticContact CZ-ND1 3.79Å; Y38-H73 PolarHBondContact OH-ND1 2.67Å; L59-H73 VanDerWaalsContact CD1-CE1 3.47Å; L59-H73 WeakPolarHBondContact CD1-CE1 3.3Å; H60-H73 AromaticContact CE1-NE2 3.55Å; Q63-H73 HydrophobicContact CG-CB 4.32Å; I68-H73 HydrophobicContact CG2-CB 4.25Å; S69-H73 PolarHBondContact O-N 2.76Å; I70-H73 PolarHBondContact O-N 2.65Å; H73-A75 PolarHBondContact O-N 2.6Å; H73-E76 PolarHBondContact O-N 2.98Å; H73-V77 WeakPolarHBondContact CE1-CG2 3.22Å; H73-V77 WeakPolarHBondContact O-CG2 3.47Å; H73-V77 PolarHBondContact O-N 3.41Å; H73-E105 IonicContact CD2-OE1 2.76Å; H73-E105 IonicContact CE1-OE1 3.74Å; H73-E105 WeakPolarHBondContact NE2-CG 3.12Å; H73-E105 CovalentContact NE2-OE1 1.77Å; H73-E105 IonicContact NE2-OE1 2.81Å; H73-E105 PolarHBondContact NE2-OE1 3.12Å; H73-E105 IonicContact NE2-OE2 3.74Å
74	K	96	Very high	95.3	Very high	59 Å²	59	64.5 Å²	64.5	26%	0.257	32%	0.318	S	S	.	.	H	α-helix	trans	-63.1	-27.3	177.6	-63.9	-177.2	164.9	-167.8	0	113.1	I70 R72 R78 E105 K107	I70-K74 HydrophobicContact CG2-CD 4.43Å; I70-K74 WeakPolarHBondContact O-CG 3.37Å; I70-K74 PolarHBondContact O-N 2.8Å; R72-K74 PolarHBondContact O-N 3Å; K74-R78 VanDerWaalsContact CB-NH1 3.29Å; K74-R78 VanDerWaalsContact O-CG 3.3Å; K74-R78 WeakPolarHBondContact O-CG 3.44Å; K74-R78 PolarHBondContact O-N 2.8Å; K74-R78 VanDerWaalsContact O-N 3.12Å; K74-R78 PolarHBondContact O-NE 2.67Å; K74-R78 VanDerWaalsContact O-NE 3.12Å; K74-R78 PolarHBondContact O-NH1 3.46Å; K74-R78 PolarHBondContact O-NH2 3.1Å; K74-E105 WeakPolarHBondContact CG-O 3.49Å; K74-K107 PolarHBondContact NZ-O 3.32Å
75	A	95.6	Very high	95.4	Very high	18 Å²	18	61 Å²	61	15%	0.149	31%	0.311	C	S	.	.	H	α-helix	trans	-71.4	-43.9	175.5	0	0	0	0	0	111.9	D71 R72 H73 R78 K79 L788	D71-A75 VanDerWaalsContact O-CB 3.3Å; D71-A75 WeakPolarHBondContact O-CB 3.39Å; D71-A75 PolarHBondContact O-N 3.03Å; R72-A75 WeakPolarHBondContact O-CA 3.48Å; R72-A75 WeakPolarHBondContact O-CB 3.42Å; R72-A75 PolarHBondContact O-N 2.81Å; H73-A75 PolarHBondContact O-N 2.6Å; A75-R78 VanDerWaalsContact N-NH2 3.13Å; A75-R78 PolarHBondContact O-N 3.48Å; A75-K79 WeakPolarHBondContact O-CB 3.38Å; A75-K79 PolarHBondContact O-N 2.97Å; A75-L788 HydrophobicContact CB-CD1 3.93Å
76	E	96.3	Very high	95.3	Very high	8 Å²	8	56.5 Å²	56.5	4%	0.037	29%	0.287	C	S	.	.	H	α-helix	trans	-63.2	-40.8	174.1	-60.7	-60.1	160.7	0	0	111.3	Y38 S39 V42 R72 H73 R78 K79 A80	Y38-E76 HydrophobicContact CD1-CG 4.34Å; S39-E76 VanDerWaalsContact CB-OE2 3.31Å; S39-E76 WeakPolarHBondContact CB-OE2 3.26Å; S39-E76 PolarHBondContact OG-OE2 3.49Å; V42-E76 HydrophobicContact CB-CB 4.47Å; V42-E76 HydrophobicContact CG1-CB 4.45Å; V42-E76 HydrophobicContact CG2-CB 4.23Å; R72-E76 IonicContact CZ-OE1 3.33Å; R72-E76 IonicContact NE-OE1 3.2Å; R72-E76 PolarHBondContact NE-OE1 3.35Å; R72-E76 IonicContact NH2-OE1 3.61Å; R72-E76 PolarHBondContact NH2-OE1 3.03Å; R72-E76 PolarHBondContact O-N 3.3Å; H73-E76 PolarHBondContact O-N 2.98Å; E76-R78 PolarHBondContact O-N 2.99Å; E76-K79 WeakPolarHBondContact O-CB 3.48Å; E76-K79 PolarHBondContact O-N 3.41Å; E76-K79 VanDerWaalsContact O-N 3.14Å; E76-K79 IonicContact OE1-NZ 2.81Å; E76-K79 WeakPolarHBondContact OE2-CE 3.37Å; E76-K79 IonicContact OE2-NZ 2.7Å; E76-K79 PolarHBondContact OE2-NZ 3.23Å; E76-A80 PolarHBondContact O-N 2.87Å
77	V	96.5	Very high	95.2	Very high	0 Å²	0	56.1 Å²	56.1	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-58.1	-47.9	173.4	169.9	0	0	0	0	111.8	V42 H73 K79 A80 L81 W102 E105	V42-V77 HydrophobicContact CG1-CG2 4.21Å; H73-V77 WeakPolarHBondContact CE1-CG2 3.22Å; H73-V77 WeakPolarHBondContact O-CG2 3.47Å; H73-V77 PolarHBondContact O-N 3.41Å; V77-K79 VanDerWaalsContact C-N 3.29Å; V77-K79 PolarHBondContact O-N 3.16Å; V77-A80 PolarHBondContact O-N 3.16Å; V77-L81 HydrophobicContact CG1-CD1 4.33Å; V77-L81 WeakPolarHBondContact O-CB 3.29Å; V77-L81 PolarHBondContact O-N 3.07Å; V77-W102 HydrophobicContact CG1-CE3 4.01Å; V77-W102 WeakPolarHBondContact CG1-O 3.49Å; V77-W102 HydrophobicContact CG2-CZ3 4.47Å; V77-E105 HydrophobicContact CG1-CB 4.46Å; V77-E105 HydrophobicContact CG2-CG 4.4Å
78	R	95.5	Very high	95.1	Very high	30 Å²	30	58.3 Å²	58.3	11%	0.113	30%	0.302	C	S	.	.	H	α-helix	trans	-65.7	-30.8	176.2	-70.9	176	-62.9	-106.3	3.9	112.9	K74 A75 E76 N82 G106	K74-R78 VanDerWaalsContact CB-NH1 3.29Å; K74-R78 VanDerWaalsContact O-CG 3.3Å; K74-R78 WeakPolarHBondContact O-CG 3.44Å; K74-R78 PolarHBondContact O-N 2.8Å; K74-R78 VanDerWaalsContact O-N 3.12Å; K74-R78 PolarHBondContact O-NE 2.67Å; K74-R78 VanDerWaalsContact O-NE 3.12Å; K74-R78 PolarHBondContact O-NH1 3.46Å; K74-R78 PolarHBondContact O-NH2 3.1Å; A75-R78 VanDerWaalsContact N-NH2 3.13Å; A75-R78 PolarHBondContact O-N 3.48Å; E76-R78 PolarHBondContact O-N 2.99Å; R78-N82 WeakPolarHBondContact O-CB 3.31Å; R78-N82 VanDerWaalsContact O-CG 3.23Å; R78-N82 PolarHBondContact O-N 3.32Å; R78-N82 VanDerWaalsContact O-N 3.11Å; R78-N82 PolarHBondContact O-OD1 2.91Å; R78-G106 VanDerWaalsContact CD-O 3.22Å; R78-G106 WeakPolarHBondContact CD-O 3.38Å; R78-G106 WeakPolarHBondContact CG-O 3.49Å; R78-G106 PolarHBondContact NH1-O 3.26Å
79	K	95.9	Very high	95	Very high	114 Å²	114	61.1 Å²	61.1	50%	0.496	32%	0.316	S	S	.	.	H	α-helix	trans	-67.1	-45.2	176.2	-164.1	177.4	76.8	-165.3	0	110.5	S39 A75 E76 V77 N82 D83	S39-K79 PolarHBondContact OG-NZ 2.89Å; A75-K79 WeakPolarHBondContact O-CB 3.38Å; A75-K79 PolarHBondContact O-N 2.97Å; E76-K79 WeakPolarHBondContact O-CB 3.48Å; E76-K79 PolarHBondContact O-N 3.41Å; E76-K79 VanDerWaalsContact O-N 3.14Å; E76-K79 IonicContact OE1-NZ 2.81Å; E76-K79 WeakPolarHBondContact OE2-CE 3.37Å; E76-K79 IonicContact OE2-NZ 2.7Å; E76-K79 PolarHBondContact OE2-NZ 3.23Å; V77-K79 VanDerWaalsContact C-N 3.29Å; V77-K79 PolarHBondContact O-N 3.16Å; K79-N82 PolarHBondContact O-N 2.93Å; K79-D83 PolarHBondContact O-N 3.36Å
80	A	95.3	Very high	95	Very high	5 Å²	5	59.2 Å²	59.2	4%	0.041	30%	0.303	C	S	.	.	H	α-helix	trans	-70.4	-32.5	177	0	0	0	0	0	113.6	V42 R46 E76 V77 D83 L86	V42-A80 HydrophobicContact CG1-CB 3.94Å; R46-A80 HydrophobicContact CB-CB 4.07Å; R46-A80 HydrophobicContact CG-CB 4.16Å; E76-A80 PolarHBondContact O-N 2.87Å; V77-A80 PolarHBondContact O-N 3.16Å; A80-D83 PolarHBondContact O-N 2.93Å; A80-L86 HydrophobicContact CB-CD1 3.92Å
81	L	93.1	Very high	94.9	Very high	29 Å²	29	59.4 Å²	59.4	15%	0.152	30%	0.301	C	S	.	.	H	α-helix	trans	-63.8	-40.3	171.2	-93.3	170.8	0	0	0	113.1	V77 D83 D99 W102 I103	V77-L81 HydrophobicContact CG1-CD1 4.33Å; V77-L81 WeakPolarHBondContact O-CB 3.29Å; V77-L81 PolarHBondContact O-N 3.07Å; L81-D83 PolarHBondContact O-N 3.2Å; L81-D99 HydrophobicContact CD2-CB 4.49Å; L81-W102 HydrophobicContact CD1-CB 4.09Å; L81-W102 HydrophobicContact CD2-CB 3.71Å; L81-W102 HydrophobicContact CG-CB 3.97Å; L81-I103 HydrophobicContact CD1-CG1 4.09Å; L81-I103 HydrophobicContact CD2-CG1 4.23Å
82	N	93.7	Very high	94.8	Very high	138 Å²	138	58.4 Å²	58.4	74%	0.738	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.5	3.4	-178.9	-71.1	2.2	0	0	0	113.2	R78 K79	R78-N82 WeakPolarHBondContact O-CB 3.31Å; R78-N82 VanDerWaalsContact O-CG 3.23Å; R78-N82 PolarHBondContact O-N 3.32Å; R78-N82 VanDerWaalsContact O-N 3.11Å; R78-N82 PolarHBondContact O-OD1 2.91Å; K79-N82 PolarHBondContact O-N 2.93Å
83	D	95.4	Very high	94.7	Very high	65 Å²	65	61.4 Å²	61.4	35%	0.348	33%	0.33	S	S	.	.			trans	-91.8	107.1	-178.1	-165.9	-39.1	0	0	0	110.3	K79 A80 L81 E85 L86 A87	K79-D83 PolarHBondContact O-N 3.36Å; A80-D83 PolarHBondContact O-N 2.93Å; L81-D83 PolarHBondContact O-N 3.2Å; D83-E85 PolarHBondContact O-N 2.98Å; D83-E85 WeakPolarHBondContact OD1-CB 3.46Å; D83-E85 PolarHBondContact OD1-N 3.12Å; D83-L86 HydrophobicContact CB-CB 4.1Å; D83-L86 HydrophobicContact CB-CD1 3.81Å; D83-L86 HydrophobicContact CB-CG 3.87Å; D83-L86 PolarHBondContact O-N 3.41Å; D83-L86 PolarHBondContact OD1-N 2.92Å; D83-A87 PolarHBondContact O-N 3.32Å
84	E	94.7	Very high	94.3	Very high	168 Å²	168	64.7 Å²	64.7	79%	0.785	35%	0.352	S	S	*	.	H	α-helix	trans	-61.3	-28.7	-179.2	-63.3	178.1	-174.1	0	0	112.3	T88	E84-T88 WeakPolarHBondContact O-CB 3.34Å; E84-T88 PolarHBondContact O-N 3.14Å; E84-T88 PolarHBondContact O-OG1 3.32Å
85	E	95.7	Very high	93.8	Very high	140 Å²	140	63.5 Å²	63.5	65%	0.654	36%	0.356	S	S	*	.	H	α-helix	trans	-73.2	-46.9	177.6	-169.7	178.6	153.1	0	0	110.5	D83 A87 T88 I89	D83-E85 PolarHBondContact O-N 2.98Å; D83-E85 WeakPolarHBondContact OD1-CB 3.46Å; D83-E85 PolarHBondContact OD1-N 3.12Å; E85-A87 VanDerWaalsContact C-N 3.34Å; E85-A87 PolarHBondContact O-N 3.36Å; E85-T88 PolarHBondContact O-N 3.41Å; E85-I89 HydrophobicContact CG-CD1 4.04Å; E85-I89 VanDerWaalsContact O-CG1 3.31Å; E85-I89 WeakPolarHBondContact O-CG1 3.28Å; E85-I89 PolarHBondContact O-N 3.09Å
86	L	95	Very high	92.9	Very high	22 Å²	22	71.4 Å²	71.4	12%	0.115	39%	0.387	C	S	.	.	H	α-helix	trans	-64.9	-37.5	177.7	-58.1	180	0	0	0	112.3	A43 R46 A47 A80 D83 S90	A43-L86 HydrophobicContact CB-CD1 3.65Å; A43-L86 HydrophobicContact CB-CD2 4.29Å; R46-L86 HydrophobicContact CG-CB 4.11Å; R46-L86 HydrophobicContact CG-CD1 4.5Å; A47-L86 HydrophobicContact CB-CD2 4.25Å; A80-L86 HydrophobicContact CB-CD1 3.92Å; D83-L86 HydrophobicContact CB-CB 4.1Å; D83-L86 HydrophobicContact CB-CD1 3.81Å; D83-L86 HydrophobicContact CB-CG 3.87Å; D83-L86 PolarHBondContact O-N 3.41Å; D83-L86 PolarHBondContact OD1-N 2.92Å; L86-S90 VanDerWaalsContact O-CB 3.29Å; L86-S90 WeakPolarHBondContact O-CB 3.48Å; L86-S90 PolarHBondContact O-N 2.96Å
87	A	92.8	Very high	91.9	Very high	33 Å²	33	72.8 Å²	72.8	27%	0.273	39%	0.394	S	S	.	.	H	α-helix	trans	-63.7	-41.6	173.1	0	0	0	0	0	111.9	D83 E85 S90 E91	D83-A87 PolarHBondContact O-N 3.32Å; E85-A87 VanDerWaalsContact C-N 3.34Å; E85-A87 PolarHBondContact O-N 3.36Å; A87-S90 WeakPolarHBondContact O-CB 3.14Å; A87-S90 PolarHBondContact O-N 3.39Å; A87-E91 PolarHBondContact O-N 3.36Å
88	T	93.4	Very high	91	Very high	97 Å²	97	76.9 Å²	76.9	60%	0.595	42%	0.419	S	S	*	.	H	α-helix	trans	-66.5	-41.8	177	-57.7	0	0	0	0	112	E84 E85 S90 E91 A92	E84-T88 WeakPolarHBondContact O-CB 3.34Å; E84-T88 PolarHBondContact O-N 3.14Å; E84-T88 PolarHBondContact O-OG1 3.32Å; E85-T88 PolarHBondContact O-N 3.41Å; T88-S90 VanDerWaalsContact C-N 3.34Å; T88-E91 PolarHBondContact O-N 3.47Å; T88-A92 WeakPolarHBondContact O-CB 3.14Å; T88-A92 PolarHBondContact O-N 3.47Å; T88-A92 VanDerWaalsContact O-N 3.12Å
89	I	95.4	Very high	90.6	Very high	68 Å²	68	78.4 Å²	78.4	35%	0.349	43%	0.429	S	S	.	.	H	α-helix	trans	-63.5	-43.2	175.2	-66.5	163.9	0	0	0	110.1	A47 E85 A92 V93	A47-I89 HydrophobicContact CB-CB 4.42Å; A47-I89 HydrophobicContact CB-CG2 3.89Å; E85-I89 HydrophobicContact CG-CD1 4.04Å; E85-I89 VanDerWaalsContact O-CG1 3.31Å; E85-I89 WeakPolarHBondContact O-CG1 3.28Å; E85-I89 PolarHBondContact O-N 3.09Å; I89-A92 PolarHBondContact O-N 3Å; I89-V93 HydrophobicContact CG2-CG2 4.13Å; I89-V93 WeakPolarHBondContact O-CB 2.95Å; I89-V93 VanDerWaalsContact O-CG2 3.28Å; I89-V93 WeakPolarHBondContact O-CG2 3.43Å; I89-V93 PolarHBondContact O-N 3.2Å
90	S	93.8	Very high	90.3	Very high	0 Å²	0	79.6 Å²	79.6	0%	0	44%	0.436	C	S	.	.	H	α-helix	trans	-58.9	-49.2	176.7	176.9	0	0	0	0	112.6	G49 L86 A87 T88 A92 V93 C94 E97	G49-S90 VanDerWaalsContact CA-OG 3.23Å; G49-S90 WeakPolarHBondContact CA-OG 3.32Å; L86-S90 VanDerWaalsContact O-CB 3.29Å; L86-S90 WeakPolarHBondContact O-CB 3.48Å; L86-S90 PolarHBondContact O-N 2.96Å; A87-S90 WeakPolarHBondContact O-CB 3.14Å; A87-S90 PolarHBondContact O-N 3.39Å; T88-S90 VanDerWaalsContact C-N 3.34Å; S90-A92 PolarHBondContact O-N 3.45Å; S90-V93 PolarHBondContact O-N 3.27Å; S90-V93 VanDerWaalsContact O-N 3.1Å; S90-C94 PolarHBondContact O-N 3.44Å; S90-E97 VanDerWaalsContact CB-OE2 3.28Å; S90-E97 WeakPolarHBondContact CB-OE2 3.47Å; S90-E97 VanDerWaalsContact OG-CD 3.22Å; S90-E97 PolarHBondContact OG-OE2 3.39Å
91	E	93.2	Very high	90.2	Very high	112 Å²	112	83.6 Å²	83.6	52%	0.523	45%	0.454	S	S	.	.	H	α-helix	trans	-61.9	-33.1	177.4	-172.2	171.9	-157.7	0	0	111.8	A87 T88 G95	A87-E91 PolarHBondContact O-N 3.36Å; T88-E91 PolarHBondContact O-N 3.47Å; E91-G95 WeakPolarHBondContact CA-O 3.48Å; E91-G95 WeakPolarHBondContact O-CA 3.48Å; E91-G95 PolarHBondContact O-N 3.41Å
92	A	92.4	Very high	90.3	Very high	86 Å²	86	82.3 Å²	82.3	71%	0.711	45%	0.447	S	S	*	.	H	α-helix	trans	-73.5	-29	175.3	0	0	0	0	0	114.2	T88 I89 S90	T88-A92 WeakPolarHBondContact O-CB 3.14Å; T88-A92 PolarHBondContact O-N 3.47Å; T88-A92 VanDerWaalsContact O-N 3.12Å; I89-A92 PolarHBondContact O-N 3Å; S90-A92 PolarHBondContact O-N 3.45Å
93	V	91.6	Very high	90.3	Very high	96 Å²	96	80.4 Å²	80.4	58%	0.582	44%	0.436	S	S	*	.	H	α-helix	trans	-91.5	-40.1	-176.6	170.9	0	0	0	0	112.5	I89 S90	I89-V93 HydrophobicContact CG2-CG2 4.13Å; I89-V93 WeakPolarHBondContact O-CB 2.95Å; I89-V93 VanDerWaalsContact O-CG2 3.28Å; I89-V93 WeakPolarHBondContact O-CG2 3.43Å; I89-V93 PolarHBondContact O-N 3.2Å; S90-V93 PolarHBondContact O-N 3.27Å; S90-V93 VanDerWaalsContact O-N 3.1Å
94	C	88.2	Confident	90.2	Very high	71 Å²	71	81.9 Å²	81.9	48%	0.48	44%	0.443	S	S	.	.	H	α-helix	trans	-113.5	-6.2	-175.3	-70.4	0	0	0	0	114.3	S90	S90-C94 PolarHBondContact O-N 3.44Å
95	G	85.9	Confident	90.2	Very high	33 Å²	33	74.8 Å²	74.8	34%	0.34	41%	0.41	S	S	.	.	S	Bend	trans	73.6	-166.1	-163.2	0	0	0	0	0	111.2	E91 E97	E91-G95 WeakPolarHBondContact CA-O 3.48Å; E91-G95 WeakPolarHBondContact O-CA 3.48Å; E91-G95 PolarHBondContact O-N 3.41Å; G95-E97 PolarHBondContact O-N 2.97Å
96	K	78	Confident	90.1	Very high	184 Å²	184	68.3 Å²	68.3	80%	0.8	38%	0.381	S	S	*	.	S	Bend	trans	-54.6	108.9	-175.4	-65.2	-175.4	176.9	-173.6	0	112.1
97	E	75.5	Confident	89.9	Confident	37 Å²	37	73.5 Å²	73.5	17%	0.173	40%	0.403	C	S	.	.			trans	-73.2	149.8	-176.1	-172.1	173.8	-175.8	0	0	112.3	R46 G49 P50 S90 G95 W102	R46-E97 IonicContact CZ-OE1 2.76Å; R46-E97 IonicContact CZ-OE2 3.92Å; R46-E97 IonicContact NE-OE2 2.76Å; R46-E97 IonicContact NH1-OE1 3.83Å; R46-E97 PolarHBondContact NH1-OE1 3.07Å; R46-E97 IonicContact NH1-OE2 3.84Å; R46-E97 PolarHBondContact NH1-OE2 3.35Å; R46-E97 IonicContact NH2-OE2 3.7Å; G49-E97 WeakPolarHBondContact CA-OE1 3.42Å; P50-E97 WeakPolarHBondContact CA-OE1 3.39Å; P50-E97 HydrophobicContact CB-CG 4.41Å; S90-E97 VanDerWaalsContact CB-OE2 3.28Å; S90-E97 WeakPolarHBondContact CB-OE2 3.47Å; S90-E97 VanDerWaalsContact OG-CD 3.22Å; S90-E97 PolarHBondContact OG-OE2 3.39Å; G95-E97 PolarHBondContact O-N 2.97Å; E97-W102 PolarHBondContact OE1-NE1 3.42Å
98	V	77.1	Confident	89.8	Confident	87 Å²	87	79.1 Å²	79.1	53%	0.527	42%	0.417	S	S	.	.			trans	-97.5	98.6	166.3	-179.7	0	0	0	0	108.5	E100	V98-E100 HydrophobicContact CG1-CB 4.08Å; V98-E100 HydrophobicContact CG1-CG 3.94Å; V98-E100 PolarHBondContact O-N 3.34Å
99	D	86.8	Confident	89.4	Confident	61 Å²	61	83 Å²	83	33%	0.326	43%	0.432	S	S	.	.			trans	-71	-10.2	-178.2	-72	-19.5	0	0	0	114.3	R46 L81 E101 W102 I103	R46-D99 IonicContact CZ-OD1 3.68Å; R46-D99 IonicContact NH1-OD1 3.73Å; R46-D99 PolarHBondContact NH1-OD1 3.42Å; R46-D99 IonicContact NH2-OD1 2.74Å; R46-D99 PolarHBondContact NH2-OD1 2.99Å; R46-D99 IonicContact NH2-OD2 2.89Å; L81-D99 HydrophobicContact CD2-CB 4.49Å; D99-E101 PolarHBondContact O-N 3.48Å; D99-W102 WeakPolarHBondContact O-CB 3.46Å; D99-W102 PolarHBondContact O-N 3.41Å; D99-W102 VanDerWaalsContact O-N 3.13Å; D99-I103 HydrophobicContact CB-CD1 3.74Å; D99-I103 HydrophobicContact CB-CG1 4.29Å; D99-I103 WeakPolarHBondContact O-CG1 3.5Å; D99-I103 PolarHBondContact O-N 3.46Å
100	E	90.5	Very high	88.7	Confident	140 Å²	140	83.8 Å²	83.8	65%	0.654	44%	0.444	S	S	*	.	H	α-helix	trans	-56.6	-46.8	-167.5	-61.2	-169.5	157.4	0	0	113.3	V98 I103 L104	V98-E100 HydrophobicContact CG1-CB 4.08Å; V98-E100 HydrophobicContact CG1-CG 3.94Å; V98-E100 PolarHBondContact O-N 3.34Å; E100-I103 PolarHBondContact O-N 2.78Å; E100-L104 VanDerWaalsContact O-CG 3.3Å; E100-L104 WeakPolarHBondContact O-CG 3.28Å; E100-L104 PolarHBondContact O-N 3.39Å
101	E	92.9	Very high	88.2	Confident	89 Å²	89	88.3 Å²	88.3	42%	0.416	47%	0.473	S	S	.	.	H	α-helix	trans	-67.2	-37.7	179	-72.8	-65.3	169.9	0	0	112.7	L51 D99 I103 L104 E105	L51-E101 HydrophobicContact CB-CB 3.96Å; L51-E101 HydrophobicContact CD2-CB 4.44Å; D99-E101 PolarHBondContact O-N 3.48Å; E101-I103 VanDerWaalsContact C-N 3.34Å; E101-L104 PolarHBondContact O-N 3.03Å; E101-E105 WeakPolarHBondContact O-CB 3.23Å; E101-E105 PolarHBondContact O-N 3.45Å
102	W	94.9	Very high	87.7	Confident	1 Å²	1	90.7 Å²	90.7	0%	0.004	49%	0.488	C	S	.	.	H	α-helix	trans	-63	-41.8	172.9	-75.5	117.2	0	0	0	111.3	L45 R46 G49 L51 L59 V77 L81 E97 D99 E105 G106	L45-W102 HydrophobicContact CB-CH2 3.96Å; L45-W102 HydrophobicContact CB-CZ2 4.37Å; L45-W102 WeakPolarHBondContact O-CZ2 3.46Å; R46-W102 HydrophobicContact CB-CH2 4.27Å; R46-W102 HydrophobicContact CB-CZ2 4Å; G49-W102 PolarHBondContact O-NE1 3.26Å; L51-W102 HydrophobicContact CB-CD2 3.73Å; L51-W102 HydrophobicContact CB-CE3 4.2Å; L51-W102 HydrophobicContact CB-CG 3.97Å; L51-W102 HydrophobicContact CB-CZ2 4.16Å; L51-W102 HydrophobicContact CD1-CE3 4.27Å; L51-W102 HydrophobicContact CD1-CH2 3.93Å; L51-W102 HydrophobicContact CD1-CZ2 4.18Å; L51-W102 HydrophobicContact CD1-CZ3 3.98Å; L51-W102 HydrophobicContact CD2-CD2 4.3Å; L51-W102 HydrophobicContact CD2-CE3 4.02Å; L51-W102 HydrophobicContact CD2-CZ3 4.43Å; L51-W102 HydrophobicContact CG-CD2 4.41Å; L51-W102 HydrophobicContact CG-CE3 4.4Å; L59-W102 HydrophobicContact CD1-CH2 4.36Å; L59-W102 HydrophobicContact CD1-CZ3 4.14Å; V77-W102 HydrophobicContact CG1-CE3 4.01Å; V77-W102 WeakPolarHBondContact CG1-O 3.49Å; V77-W102 HydrophobicContact CG2-CZ3 4.47Å; L81-W102 HydrophobicContact CD1-CB 4.09Å; L81-W102 HydrophobicContact CD2-CB 3.71Å; L81-W102 HydrophobicContact CG-CB 3.97Å; E97-W102 PolarHBondContact OE1-NE1 3.42Å; D99-W102 WeakPolarHBondContact O-CB 3.46Å; D99-W102 PolarHBondContact O-N 3.41Å; D99-W102 VanDerWaalsContact O-N 3.13Å; W102-E105 PolarHBondContact O-N 3.19Å; W102-G106 PolarHBondContact O-N 3Å
103	I	93.3	Very high	87.1	Confident	98 Å²	98	95.1 Å²	95.1	50%	0.503	49%	0.491	S	S	.	.	H	α-helix	trans	-66.3	-39.5	178.1	-68.7	165.4	0	0	0	111.1	L81 D99 E100 E101 K107	L81-I103 HydrophobicContact CD1-CG1 4.09Å; L81-I103 HydrophobicContact CD2-CG1 4.23Å; D99-I103 HydrophobicContact CB-CD1 3.74Å; D99-I103 HydrophobicContact CB-CG1 4.29Å; D99-I103 WeakPolarHBondContact O-CG1 3.5Å; D99-I103 PolarHBondContact O-N 3.46Å; E100-I103 PolarHBondContact O-N 2.78Å; E101-I103 VanDerWaalsContact C-N 3.34Å; I103-K107 PolarHBondContact O-N 2.84Å
104	L	93.1	Very high	86.6	Confident	96 Å²	96	99.2 Å²	99.2	50%	0.503	50%	0.504	S	S	.	.	H	α-helix	trans	-64.6	-44.2	175	-73.1	173	0	0	0	111.7	E100 E101 K107	E100-L104 VanDerWaalsContact O-CG 3.3Å; E100-L104 WeakPolarHBondContact O-CG 3.28Å; E100-L104 PolarHBondContact O-N 3.39Å; E101-L104 PolarHBondContact O-N 3.03Å; L104-K107 WeakPolarHBondContact O-CB 3.23Å; L104-K107 PolarHBondContact O-N 3.2Å
105	E	94	Very high	86.3	Confident	19 Å²	19	107.3 Å²	107.3	9%	0.089	52%	0.524	C	S	.	.	H	α-helix	trans	-65.3	-44.6	176.9	-167.1	58.1	-144.7	0	0	111.5	L51 K56 H60 H73 K74 V77 E101 W102 K107	L51-E105 HydrophobicContact CD2-CB 3.74Å; L51-E105 HydrophobicContact CD2-CG 4.06Å; K56-E105 WeakPolarHBondContact CE-OE2 3.43Å; K56-E105 IonicContact NZ-OE2 2.68Å; K56-E105 PolarHBondContact NZ-OE2 3.22Å; H60-E105 IonicContact CE1-OE1 3.62Å; H60-E105 PolarHBondContact CE1-OE1 3.12Å; H60-E105 IonicContact NE2-OE1 3.15Å; H73-E105 IonicContact CD2-OE1 2.76Å; H73-E105 IonicContact CE1-OE1 3.74Å; H73-E105 WeakPolarHBondContact NE2-CG 3.12Å; H73-E105 CovalentContact NE2-OE1 1.77Å; H73-E105 IonicContact NE2-OE1 2.81Å; H73-E105 PolarHBondContact NE2-OE1 3.12Å; H73-E105 IonicContact NE2-OE2 3.74Å; K74-E105 WeakPolarHBondContact CG-O 3.49Å; V77-E105 HydrophobicContact CG1-CB 4.46Å; V77-E105 HydrophobicContact CG2-CG 4.4Å; E101-E105 WeakPolarHBondContact O-CB 3.23Å; E101-E105 PolarHBondContact O-N 3.45Å; W102-E105 PolarHBondContact O-N 3.19Å; E105-K107 PolarHBondContact O-N 3.43Å; E105-K107 VanDerWaalsContact O-N 3.13Å
106	G	93.8	Very high	85.8	Confident	4 Å²	4	111.1 Å²	111.1	4%	0.041	54%	0.543	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.7	-4.3	177	0	0	0	0	0	115.3	R78 W102 R108	R78-G106 VanDerWaalsContact CD-O 3.22Å; R78-G106 WeakPolarHBondContact CD-O 3.38Å; R78-G106 WeakPolarHBondContact CG-O 3.49Å; R78-G106 PolarHBondContact NH1-O 3.26Å; W102-G106 PolarHBondContact O-N 3Å; G106-R108 PolarHBondContact O-N 3.31Å
107	K	92.3	Very high	85.6	Confident	132 Å²	132	106.7 Å²	106.7	57%	0.574	54%	0.535	S	S	*	.	P	Polyproline II helix	trans	-61.1	119.7	-167.9	-170.2	171.5	-178.1	175.9	0	113.8	K74 I103 L104 E105	K74-K107 PolarHBondContact NZ-O 3.32Å; I103-K107 PolarHBondContact O-N 2.84Å; L104-K107 WeakPolarHBondContact O-CB 3.23Å; L104-K107 PolarHBondContact O-N 3.2Å; E105-K107 PolarHBondContact O-N 3.43Å; E105-K107 VanDerWaalsContact O-N 3.13Å
108	R	90	Very high	85.5	Confident	151 Å²	151	110.1 Å²	110.1	57%	0.57	56%	0.561	S	S	*	*	P	Polyproline II helix	trans	-83.1	154.7	165.7	-68	-172.5	171.8	117.4	-6.9	110.6	G106	G106-R108 PolarHBondContact O-N 3.31Å
109	I	84.3	Confident	85.2	Confident	178 Å²	178	114 Å²	114	91%	0.913	57%	0.573	S	S	*	*	P	Polyproline II helix	trans	-77.3	128.1	156.1	-59.7	174.3	0	0	0	106.9
110	S	81.8	Confident	84.2	Confident	84 Å²	84	114.3 Å²	114.3	59%	0.587	58%	0.578	S	S	*	*			trans	-141.4	133.2	174.2	-175.8	0	0	0	0	108.7	I112	S110-I112 PolarHBondContact O-N 2.79Å
111	P	82.5	Confident	82.9	Confident	95 Å²	95	113.4 Å²	113.4	62%	0.617	58%	0.576	S	S	*	*			trans	-58.6	123.9	170	-23.7	34.9	0	0	0	110.5	F113	P111-F113 HydrophobicContact CB-CD2 4.02Å; P111-F113 HydrophobicContact CB-CE2 3.49Å; P111-F113 VanDerWaalsContact CB-CE2 3.49Å; P111-F113 HydrophobicContact CB-CZ 3.92Å; P111-F113 HydrophobicContact CG-CE2 4.4Å
112	I	82.4	Confident	81.9	Confident	162 Å²	162	116.4 Å²	116.4	83%	0.831	59%	0.588	S	S	*	*			trans	-100	86.1	173.4	-55.8	179.3	0	0	0	107.5	S110	S110-I112 PolarHBondContact O-N 2.79Å
113	F	80	Confident	81.4	Confident	179 Å²	179	119 Å²	119	79%	0.785	60%	0.601	S	S	*	*	P	Polyproline II helix	trans	-76.6	123.8	168.4	-62.2	-69.5	0	0	0	109.2	P111 R115	P111-F113 HydrophobicContact CB-CD2 4.02Å; P111-F113 HydrophobicContact CB-CE2 3.49Å; P111-F113 VanDerWaalsContact CB-CE2 3.49Å; P111-F113 HydrophobicContact CB-CZ 3.92Å; P111-F113 HydrophobicContact CG-CE2 4.4Å; F113-R115 PolarHBondContact O-N 3.37Å
114	Q	82.3	Confident	80.8	Confident	182 Å²	182	118.8 Å²	118.8	85%	0.85	61%	0.608	S	S	*	*	P	Polyproline II helix	trans	-59.7	131	159.4	-66	-176.1	-0.6	0	0	107.3	P116	Q114-P116 VanDerWaalsContact O-CD 3.27Å; Q114-P116 WeakPolarHBondContact O-CD 3.16Å; Q114-P116 VanDerWaalsContact O-N 3.14Å
115	R	81.5	Confident	80.5	Confident	241 Å²	241	119.5 Å²	119.5	91%	0.909	61%	0.609	S	S	*	*	P	Polyproline II helix	trans	-61.9	117.5	174.6	-81.6	-174.4	-80.4	-109.8	0.7	107.9	F113	F113-R115 PolarHBondContact O-N 3.37Å
116	P	74.3	Confident	80.2	Confident	113 Å²	113	121 Å²	121	73%	0.734	63%	0.625	S	S	*	*	P	Polyproline II helix	trans	-61.6	144.1	171.7	27.7	-33.7	0	0	0	108.5	Q114	Q114-P116 VanDerWaalsContact O-CD 3.27Å; Q114-P116 WeakPolarHBondContact O-CD 3.16Å; Q114-P116 VanDerWaalsContact O-N 3.14Å
117	S	74.6	Confident	79.9	Confident	91 Å²	91	125.6 Å²	125.6	64%	0.636	65%	0.649	S	S	*	*	P	Polyproline II helix	trans	-53.3	138.6	159.1	45.2	0	0	0	0	108.4	E119	S117-E119 VanDerWaalsContact C-N 3.31Å; S117-E119 PolarHBondContact O-N 3.02Å
118	P	72	Confident	79.9	Confident	109 Å²	109	124.9 Å²	124.9	71%	0.708	65%	0.645	S	S	*	*			trans	-68.2	86.9	-171.6	27.3	-35.3	0	0	0	111.3	T120 I123	P118-T120 VanDerWaalsContact C-N 3.26Å; P118-T120 PolarHBondContact O-N 3.17Å; P118-I123 VanDerWaalsContact O-CD1 3.26Å; P118-I123 WeakPolarHBondContact O-CD1 3.5Å
119	E	72.3	Confident	79.9	Confident	169 Å²	169	119.7 Å²	119.7	79%	0.79	64%	0.635	S	S	*	*			trans	-76.1	77.3	-174	-166.9	160.7	-143.2	0	0	111.2	S117	S117-E119 VanDerWaalsContact C-N 3.31Å; S117-E119 PolarHBondContact O-N 3.02Å
120	T	65.4	Low	80.1	Confident	68 Å²	68	114.5 Å²	114.5	42%	0.417	61%	0.614	S	S	.	*			trans	-69.4	150.8	170.4	67.2	0	0	0	0	110	P118 F122 I123	P118-T120 VanDerWaalsContact C-N 3.26Å; P118-T120 PolarHBondContact O-N 3.17Å; T120-F122 PolarHBondContact O-N 2.95Å; T120-F122 VanDerWaalsContact O-N 3.1Å; T120-I123 WeakPolarHBondContact O-CB 3.44Å; T120-I123 PolarHBondContact O-N 3.28Å; T120-I123 PolarHBondContact OG1-N 3.5Å
121	I	63.8	Low	80.7	Confident	120 Å²	120	116.8 Å²	116.8	62%	0.615	61%	0.614	S	S	*	*	H	α-helix	trans	-54.9	-31.4	170.6	-53.6	153.4	0	0	0	110.2	I123 S124 R451	I121-I123 VanDerWaalsContact C-N 3.27Å; I121-I123 PolarHBondContact O-N 3.11Å; I121-S124 PolarHBondContact O-N 3.3Å; I121-R451 VanDerWaalsContact CD1-NH2 3.31Å
122	F	70.9	Confident	81.2	Confident	153 Å²	153	115.6 Å²	115.6	67%	0.671	60%	0.6	S	S	*	*	H	α-helix	trans	-66.9	-17.4	174.9	-54.1	-69	0	0	0	114.2	T120 Q125 A126	T120-F122 PolarHBondContact O-N 2.95Å; T120-F122 VanDerWaalsContact O-N 3.1Å; F122-Q125 CarbonylContact O-C 3.6Å; F122-Q125 PolarHBondContact O-N 3.01Å; F122-A126 WeakPolarHBondContact O-CA 3.27Å; F122-A126 WeakPolarHBondContact O-CB 3.3Å; F122-A126 PolarHBondContact O-N 3.37Å
123	I	83.8	Confident	81.5	Confident	56 Å²	56	111.8 Å²	111.8	29%	0.287	58%	0.579	S	S	.	*	H	α-helix	trans	-67.4	-37.3	174.7	-81.9	178.5	0	0	0	111.5	P118 T120 I121 Q125 A126 N127	P118-I123 VanDerWaalsContact O-CD1 3.26Å; P118-I123 WeakPolarHBondContact O-CD1 3.5Å; T120-I123 WeakPolarHBondContact O-CB 3.44Å; T120-I123 PolarHBondContact O-N 3.28Å; T120-I123 PolarHBondContact OG1-N 3.5Å; I121-I123 VanDerWaalsContact C-N 3.27Å; I121-I123 PolarHBondContact O-N 3.11Å; I123-Q125 PolarHBondContact O-N 3.3Å; I123-A126 PolarHBondContact O-N 3.38Å; I123-N127 WeakPolarHBondContact CG2-ND2 3.47Å; I123-N127 WeakPolarHBondContact O-CB 3.06Å; I123-N127 PolarHBondContact O-N 2.9Å; I123-N127 PolarHBondContact O-ND2 3.26Å; I123-N127 PolarHBondContact O-OD1 2.89Å
124	S	81.8	Confident	82	Confident	93 Å²	93	108.3 Å²	108.3	65%	0.65	57%	0.568	S	S	*	*	H	α-helix	trans	-59.1	-49.9	171.5	176.8	0	0	0	0	111	I121 A126 K128	I121-S124 PolarHBondContact O-N 3.3Å; S124-A126 PolarHBondContact O-N 3.39Å; S124-K128 WeakPolarHBondContact O-CB 3.11Å; S124-K128 PolarHBondContact O-N 3.19Å
125	Q	87.6	Confident	82.4	Confident	111 Å²	111	102.6 Å²	102.6	52%	0.519	54%	0.543	S	S	.	.	H	α-helix	trans	-70.3	-32	-179.3	-175.3	59.1	19.3	0	0	113.3	F122 I123 A129	F122-Q125 CarbonylContact O-C 3.6Å; F122-Q125 PolarHBondContact O-N 3.01Å; I123-Q125 PolarHBondContact O-N 3.3Å; Q125-A129 VanDerWaalsContact O-CB 3.23Å; Q125-A129 WeakPolarHBondContact O-CB 3.26Å; Q125-A129 PolarHBondContact O-N 3.07Å
126	A	85.9	Confident	82.8	Confident	51 Å²	51	96.8 Å²	96.8	42%	0.421	52%	0.521	S	S	.	.	H	α-helix	trans	-79.7	-34.3	177.9	0	0	0	0	0	112.1	F122 I123 S124 A129 S130	F122-A126 WeakPolarHBondContact O-CA 3.27Å; F122-A126 WeakPolarHBondContact O-CB 3.3Å; F122-A126 PolarHBondContact O-N 3.37Å; I123-A126 PolarHBondContact O-N 3.38Å; S124-A126 PolarHBondContact O-N 3.39Å; A126-A129 PolarHBondContact O-N 3.45Å; A126-S130 WeakPolarHBondContact O-CB 3.21Å; A126-S130 PolarHBondContact O-N 2.89Å; A126-S130 PolarHBondContact O-OG 3.2Å
127	N	88.1	Confident	83.4	Confident	100 Å²	100	95.5 Å²	95.5	54%	0.535	51%	0.507	S	S	.	.	H	α-helix	trans	-64.4	-43	168.7	-71.6	-8.4	0	0	0	109.9	I123 S130 F131	I123-N127 WeakPolarHBondContact CG2-ND2 3.47Å; I123-N127 WeakPolarHBondContact O-CB 3.06Å; I123-N127 PolarHBondContact O-N 2.9Å; I123-N127 PolarHBondContact O-ND2 3.26Å; I123-N127 PolarHBondContact O-OD1 2.89Å; N127-S130 WeakPolarHBondContact CA-OG 3.41Å; N127-S130 PolarHBondContact O-OG 2.93Å; N127-F131 WeakPolarHBondContact O-CB 3.44Å; N127-F131 PolarHBondContact O-N 3.07Å
128	K	92.9	Very high	84	Confident	116 Å²	116	95.3 Å²	95.3	50%	0.504	51%	0.506	S	S	.	.	H	α-helix	trans	-60.5	-51.9	172	-177.5	179.5	174.1	-177.5	0	111.8	S124 S130 F131 E132	S124-K128 WeakPolarHBondContact O-CB 3.11Å; S124-K128 PolarHBondContact O-N 3.19Å; K128-S130 PolarHBondContact O-N 2.99Å; K128-F131 PolarHBondContact O-N 3.37Å; K128-E132 WeakPolarHBondContact CE-OE1 3.28Å; K128-E132 WeakPolarHBondContact O-CB 3.5Å; K128-E132 WeakPolarHBondContact O-CG 3.14Å; K128-E132 PolarHBondContact O-N 2.7Å
129	A	90.4	Very high	84.7	Confident	43 Å²	43	99.7 Å²	99.7	36%	0.355	51%	0.509	S	S	.	.	H	α-helix	trans	-65	-37.9	-178	0	0	0	0	0	113	Q125 A126 Q133	Q125-A129 VanDerWaalsContact O-CB 3.23Å; Q125-A129 WeakPolarHBondContact O-CB 3.26Å; Q125-A129 PolarHBondContact O-N 3.07Å; A126-A129 PolarHBondContact O-N 3.45Å; A129-Q133 VanDerWaalsContact O-CB 3.27Å; A129-Q133 WeakPolarHBondContact O-CB 3.43Å; A129-Q133 PolarHBondContact O-N 2.93Å
130	S	88.7	Confident	85.3	Confident	68 Å²	68	97.2 Å²	97.2	48%	0.476	50%	0.5	S	S	.	.	H	α-helix	trans	-72.5	-34	175.4	59.2	0	0	0	0	112.5	A126 N127 K128 Q133 L134	A126-S130 WeakPolarHBondContact O-CB 3.21Å; A126-S130 PolarHBondContact O-N 2.89Å; A126-S130 PolarHBondContact O-OG 3.2Å; N127-S130 WeakPolarHBondContact CA-OG 3.41Å; N127-S130 PolarHBondContact O-OG 2.93Å; K128-S130 PolarHBondContact O-N 2.99Å; S130-Q133 PolarHBondContact O-N 3.09Å; S130-L134 VanDerWaalsContact O-CB 3.27Å; S130-L134 WeakPolarHBondContact O-CB 3.43Å; S130-L134 PolarHBondContact O-N 2.94Å
131	F	92.7	Very high	86.1	Confident	132 Å²	132	96.6 Å²	96.6	58%	0.579	50%	0.497	S	S	*	.	H	α-helix	trans	-68.6	-43.9	172	-174.8	-107.2	0	0	0	112	N127 K128 Q133 L134 I135	N127-F131 WeakPolarHBondContact O-CB 3.44Å; N127-F131 PolarHBondContact O-N 3.07Å; K128-F131 PolarHBondContact O-N 3.37Å; F131-Q133 VanDerWaalsContact C-N 3.3Å; F131-Q133 PolarHBondContact O-N 3.47Å; F131-L134 PolarHBondContact O-N 3.26Å; F131-I135 HydrophobicContact CD1-CD1 3.85Å; F131-I135 HydrophobicContact CE1-CD1 3.47Å; F131-I135 VanDerWaalsContact CE1-CD1 3.47Å; F131-I135 HydrophobicContact CZ-CD1 3.89Å; F131-I135 WeakPolarHBondContact O-CG1 3.19Å; F131-I135 PolarHBondContact O-N 2.93Å
132	E	93.6	Very high	86.7	Confident	71 Å²	71	94.6 Å²	94.6	33%	0.332	49%	0.493	S	S	.	.	H	α-helix	trans	-57.6	-44	169.7	-76.2	-177.8	-151.6	0	0	111.5	K128 I135 R136	K128-E132 WeakPolarHBondContact CE-OE1 3.28Å; K128-E132 WeakPolarHBondContact O-CB 3.5Å; K128-E132 WeakPolarHBondContact O-CG 3.14Å; K128-E132 PolarHBondContact O-N 2.7Å; E132-I135 PolarHBondContact O-N 3.21Å; E132-R136 WeakPolarHBondContact O-CG 3.27Å; E132-R136 PolarHBondContact O-N 3.12Å; E132-R136 IonicContact OE2-CZ 3Å; E132-R136 IonicContact OE2-NH1 3.77Å; E132-R136 IonicContact OE2-NH2 2.81Å; E132-R136 PolarHBondContact OE2-NH2 3.1Å
133	Q	89	Confident	87.1	Confident	82 Å²	82	92.7 Å²	92.7	38%	0.383	50%	0.496	S	S	.	.	H	α-helix	trans	-70	-32.4	178.7	-166.1	58.3	32.3	0	0	112.3	A129 S130 F131 I135 R136 N137	A129-Q133 VanDerWaalsContact O-CB 3.27Å; A129-Q133 WeakPolarHBondContact O-CB 3.43Å; A129-Q133 PolarHBondContact O-N 2.93Å; S130-Q133 PolarHBondContact O-N 3.09Å; F131-Q133 VanDerWaalsContact C-N 3.3Å; F131-Q133 PolarHBondContact O-N 3.47Å; Q133-I135 VanDerWaalsContact C-N 3.33Å; Q133-R136 PolarHBondContact O-N 3.49Å; Q133-R136 VanDerWaalsContact OE1-NH1 3.08Å; Q133-N137 PolarHBondContact NE2-OD1 2.96Å; Q133-N137 VanDerWaalsContact O-CB 3.31Å; Q133-N137 WeakPolarHBondContact O-CB 3.49Å; Q133-N137 PolarHBondContact O-N 3.27Å; Q133-N137 PolarHBondContact O-OD1 3.27Å
134	L	89.8	Confident	86.8	Confident	105 Å²	105	94 Å²	94	55%	0.55	52%	0.515	S	S	.	.	H	α-helix	trans	-64	-39.6	171.4	-174.1	152.7	0	0	0	110.8	S130 F131 R136 N137 S138	S130-L134 VanDerWaalsContact O-CB 3.27Å; S130-L134 WeakPolarHBondContact O-CB 3.43Å; S130-L134 PolarHBondContact O-N 2.94Å; F131-L134 PolarHBondContact O-N 3.26Å; L134-R136 VanDerWaalsContact C-N 3.33Å; L134-N137 PolarHBondContact O-N 2.84Å; L134-S138 WeakPolarHBondContact O-CB 3.48Å; L134-S138 PolarHBondContact O-N 3.26Å; L134-S138 PolarHBondContact O-OG 3.01Å
135	I	91.5	Very high	86.3	Confident	63 Å²	63	94.7 Å²	94.7	32%	0.323	51%	0.508	S	S	.	.	H	α-helix	trans	-68	-29.8	173.6	-69	167.7	0	0	0	112.4	F131 E132 Q133 S138 R139	F131-I135 HydrophobicContact CD1-CD1 3.85Å; F131-I135 HydrophobicContact CE1-CD1 3.47Å; F131-I135 VanDerWaalsContact CE1-CD1 3.47Å; F131-I135 HydrophobicContact CZ-CD1 3.89Å; F131-I135 WeakPolarHBondContact O-CG1 3.19Å; F131-I135 PolarHBondContact O-N 2.93Å; E132-I135 PolarHBondContact O-N 3.21Å; Q133-I135 VanDerWaalsContact C-N 3.33Å; I135-S138 PolarHBondContact O-OG 3.22Å; I135-R139 WeakPolarHBondContact O-CD 3.45Å; I135-R139 WeakPolarHBondContact O-CG 3.47Å; I135-R139 PolarHBondContact O-NE 2.89Å
136	R	89.3	Confident	85.5	Confident	119 Å²	119	93.3 Å²	93.3	45%	0.449	51%	0.508	S	S	.	.	H	α-helix	trans	-73.1	-46.2	170.7	-66.5	179.3	-162.4	102.7	10.2	110.8	E132 Q133 L134 S138 R139	E132-R136 WeakPolarHBondContact O-CG 3.27Å; E132-R136 PolarHBondContact O-N 3.12Å; E132-R136 IonicContact OE2-CZ 3Å; E132-R136 IonicContact OE2-NH1 3.77Å; E132-R136 IonicContact OE2-NH2 2.81Å; E132-R136 PolarHBondContact OE2-NH2 3.1Å; Q133-R136 PolarHBondContact O-N 3.49Å; Q133-R136 VanDerWaalsContact OE1-NH1 3.08Å; L134-R136 VanDerWaalsContact C-N 3.33Å; R136-S138 PolarHBondContact O-N 3.26Å; R136-R139 WeakPolarHBondContact O-CB 3.2Å; R136-R139 PolarHBondContact O-N 3.32Å
137	N	88.1	Confident	84.4	Confident	85 Å²	85	93.9 Å²	93.9	46%	0.455	51%	0.512	S	S	.	.	H	α-helix	trans	-66	-35.2	-178.5	-68.9	3.1	0	0	0	112.4	Q133 L134 R139 L140	Q133-N137 PolarHBondContact NE2-OD1 2.96Å; Q133-N137 VanDerWaalsContact O-CB 3.31Å; Q133-N137 WeakPolarHBondContact O-CB 3.49Å; Q133-N137 PolarHBondContact O-N 3.27Å; Q133-N137 PolarHBondContact O-OD1 3.27Å; L134-N137 PolarHBondContact O-N 2.84Å; N137-R139 PolarHBondContact O-N 3.13Å; N137-L140 WeakPolarHBondContact O-CB 3.27Å; N137-L140 PolarHBondContact O-N 2.69Å
138	S	87.4	Confident	82.8	Confident	88 Å²	88	92.9 Å²	92.9	62%	0.615	51%	0.51	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.5	-2.8	176.4	66.2	0	0	0	0	114.5	L134 I135 R136	L134-S138 WeakPolarHBondContact O-CB 3.48Å; L134-S138 PolarHBondContact O-N 3.26Å; L134-S138 PolarHBondContact O-OG 3.01Å; I135-S138 PolarHBondContact O-OG 3.22Å; R136-S138 PolarHBondContact O-N 3.26Å
139	R	86.5	Confident	81	Confident	200 Å²	200	93 Å²	93	76%	0.755	51%	0.51	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.4	-7.6	169.4	-60.4	171	-173.8	-162.8	-1.1	112.8	I135 R136 N137	I135-R139 WeakPolarHBondContact O-CD 3.45Å; I135-R139 WeakPolarHBondContact O-CG 3.47Å; I135-R139 PolarHBondContact O-NE 2.89Å; R136-R139 WeakPolarHBondContact O-CB 3.2Å; R136-R139 PolarHBondContact O-N 3.32Å; N137-R139 PolarHBondContact O-N 3.13Å
140	L	84.3	Confident	79.4	Confident	117 Å²	117	94.1 Å²	94.1	61%	0.613	52%	0.516	S	S	*	.	S	Bend	trans	-79.3	146.3	172.7	-59.8	178.1	0	0	0	109	N137	N137-L140 WeakPolarHBondContact O-CB 3.27Å; N137-L140 PolarHBondContact O-N 2.69Å
141	P	81.3	Confident	77.9	Confident	55 Å²	55	97.2 Å²	97.2	36%	0.357	52%	0.523	S	S	.	.	P	Polyproline II helix	trans	-60.4	157.5	168.9	28.8	-35.4	0	0	0	110.3	E145	P141-E145 HydrophobicContact CB-CB 3.99Å
142	C	77.6	Confident	76.2	Confident	78 Å²	78	94.5 Å²	94.5	53%	0.527	52%	0.517	S	S	.	.	P	Polyproline II helix	trans	-62	146	178.4	-148.4	0	0	0	0	109.4	A144 E145 T146	C142-A144 PolarHBondContact O-N 2.95Å; C142-E145 HydrophobicContact CB-CG 4.13Å; C142-E145 WeakPolarHBondContact CB-OE2 3.42Å; C142-E145 PolarHBondContact N-OE2 3.29Å; C142-E145 WeakPolarHBondContact O-CA 3.31Å; C142-E145 WeakPolarHBondContact O-CB 3.46Å; C142-E145 PolarHBondContact O-N 3.42Å; C142-T146 PolarHBondContact O-N 3Å; C142-T146 PolarHBondContact O-OG1 3.49Å
143	P	78.8	Confident	74.4	Confident	114 Å²	114	98 Å²	98	74%	0.74	53%	0.531	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.1	-26.8	-173.6	-30.3	36.8	0	0	0	115.6
144	A	78.3	Confident	73	Confident	83 Å²	83	98.6 Å²	98.6	69%	0.686	54%	0.537	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.1	-31.5	172.9	0	0	0	0	0	113.7	C142	C142-A144 PolarHBondContact O-N 2.95Å
145	E	71.8	Confident	71.5	Confident	107 Å²	107	100.9 Å²	100.9	50%	0.5	54%	0.542	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.6	-26.4	178.5	-60.9	169.9	153.6	0	0	111.6	P141 C142 A147 T148	P141-E145 HydrophobicContact CB-CB 3.99Å; C142-E145 HydrophobicContact CB-CG 4.13Å; C142-E145 WeakPolarHBondContact CB-OE2 3.42Å; C142-E145 PolarHBondContact N-OE2 3.29Å; C142-E145 WeakPolarHBondContact O-CA 3.31Å; C142-E145 WeakPolarHBondContact O-CB 3.46Å; C142-E145 PolarHBondContact O-N 3.42Å; E145-A147 PolarHBondContact O-N 1.77Å; E145-A147 VanDerWaalsContact O-N 3.15Å; E145-T148 PolarHBondContact O-N 3.33Å; E145-T148 PolarHBondContact O-OG1 3.25Å
146	T	69	Low	70	Confident	82 Å²	82	102.7 Å²	102.7	50%	0.503	55%	0.552	S	S	.	*	T	Hydrogen-bonded Turn	trans	-58.7	-26.7	175.7	-51	0	0	0	0	112.8	C142	C142-T146 PolarHBondContact O-N 3Å; C142-T146 PolarHBondContact O-OG1 3.49Å
147	A	62.8	Low	68.6	Low	63 Å²	63	99.8 Å²	99.8	52%	0.521	55%	0.553	S	S	.	*	T	Hydrogen-bonded Turn	trans	-67.3	-39.4	178.9	0	0	0	0	0	113.4	E145 F149 S150	E145-A147 PolarHBondContact O-N 1.77Å; E145-A147 VanDerWaalsContact O-N 3.15Å; A147-F149 VanDerWaalsContact C-N 3.29Å; A147-F149 PolarHBondContact O-N 2.91Å; A147-S150 PolarHBondContact O-N 3.34Å; A147-S150 PolarHBondContact O-OG 3.45Å
148	T	56.1	Low	67.1	Low	79 Å²	79	103.7 Å²	103.7	49%	0.485	57%	0.566	S	S	.	*	H	α-helix	trans	-76.2	-15.4	-170.7	61.9	0	0	0	0	113.8	E145 S150 E151 T152	E145-T148 PolarHBondContact O-N 3.33Å; E145-T148 PolarHBondContact O-OG1 3.25Å; T148-S150 PolarHBondContact O-N 3.4Å; T148-E151 PolarHBondContact O-N 2.91Å; T148-T152 PolarHBondContact O-N 2.99Å; T148-T152 PolarHBondContact O-OG1 2.81Å
149	F	55.2	Low	65.8	Low	118 Å²	118	106 Å²	106	52%	0.518	57%	0.571	S	S	.	*	H	α-helix	trans	-62.9	-27.5	170.1	-92.4	-80.2	0	0	0	113	A147 T152 F153	A147-F149 VanDerWaalsContact C-N 3.29Å; A147-F149 PolarHBondContact O-N 2.91Å; F149-T152 WeakPolarHBondContact CA-OG1 3.49Å; F149-T152 PolarHBondContact O-OG1 2.9Å; F149-F153 HydrophobicContact CD1-CD2 4.3Å; F149-F153 HydrophobicContact CD1-CE2 4.02Å; F149-F153 WeakPolarHBondContact O-CD2 3.38Å; F149-F153 PolarHBondContact O-N 2.68Å
150	S	57	Low	64.3	Low	67 Å²	67	102.4 Å²	102.4	47%	0.469	57%	0.567	S	S	.	*	H	α-helix	trans	-66.7	-45.7	176.7	66.3	0	0	0	0	112.3	A147 T148 I154	A147-S150 PolarHBondContact O-N 3.34Å; A147-S150 PolarHBondContact O-OG 3.45Å; T148-S150 PolarHBondContact O-N 3.4Å; S150-I154 WeakPolarHBondContact O-CB 3.36Å; S150-I154 WeakPolarHBondContact O-CD1 3.27Å; S150-I154 VanDerWaalsContact O-CG1 3.25Å; S150-I154 WeakPolarHBondContact O-CG1 3.41Å; S150-I154 PolarHBondContact O-N 2.89Å
151	E	55.5	Low	63	Low	134 Å²	134	104 Å²	104	63%	0.626	58%	0.576	S	S	*	*	H	α-helix	trans	-70.2	-34.5	-178.2	-64.1	-164.2	115.4	0	0	113.2	T148 K155	T148-E151 PolarHBondContact O-N 2.91Å; E151-K155 WeakPolarHBondContact O-CB 3.47Å; E151-K155 PolarHBondContact O-N 2.94Å
152	T	57.2	Low	61.6	Low	74 Å²	74	108.7 Å²	108.7	45%	0.454	60%	0.598	S	S	.	*	H	α-helix	trans	-69.2	-45.9	177.6	36.2	0	0	0	0	111.7	T148 F149 I154 K155 L156	T148-T152 PolarHBondContact O-N 2.99Å; T148-T152 PolarHBondContact O-OG1 2.81Å; F149-T152 WeakPolarHBondContact CA-OG1 3.49Å; F149-T152 PolarHBondContact O-OG1 2.9Å; T152-I154 PolarHBondContact O-N 3.21Å; T152-K155 PolarHBondContact O-N 3.3Å; T152-L156 VanDerWaalsContact O-CD1 3.29Å; T152-L156 WeakPolarHBondContact O-CD1 3.41Å; T152-L156 PolarHBondContact O-N 3.22Å
153	F	56	Low	59.9	Low	144 Å²	144	113.8 Å²	113.8	63%	0.632	61%	0.611	S	S	*	*	H	α-helix	trans	-66.1	-35.8	174.8	-86.7	-76.3	0	0	0	113.1	F149 K155 L156 A157	F149-F153 HydrophobicContact CD1-CD2 4.3Å; F149-F153 HydrophobicContact CD1-CE2 4.02Å; F149-F153 WeakPolarHBondContact O-CD2 3.38Å; F149-F153 PolarHBondContact O-N 2.68Å; F153-K155 VanDerWaalsContact C-N 3.31Å; F153-K155 PolarHBondContact O-N 2.81Å; F153-L156 PolarHBondContact O-N 2.97Å; F153-A157 VanDerWaalsContact O-CB 3.27Å; F153-A157 WeakPolarHBondContact O-CB 3.36Å; F153-A157 PolarHBondContact O-N 3.1Å
154	I	59.9	Low	58.1	Low	96 Å²	96	114.5 Å²	114.5	49%	0.492	61%	0.613	S	S	.	*	H	α-helix	trans	-67.4	-30.8	174.3	-68.9	168.4	0	0	0	111.9	S150 T152 K158	S150-I154 WeakPolarHBondContact O-CB 3.36Å; S150-I154 WeakPolarHBondContact O-CD1 3.27Å; S150-I154 VanDerWaalsContact O-CG1 3.25Å; S150-I154 WeakPolarHBondContact O-CG1 3.41Å; S150-I154 PolarHBondContact O-N 2.89Å; T152-I154 PolarHBondContact O-N 3.21Å; I154-K158 HydrophobicContact CG2-CD 4.36Å; I154-K158 VanDerWaalsContact O-CG 3.32Å; I154-K158 WeakPolarHBondContact O-CG 3.43Å; I154-K158 PolarHBondContact O-N 2.53Å
155	K	59	Low	56.3	Low	153 Å²	153	117.1 Å²	117.1	67%	0.665	62%	0.615	S	S	*	*	H	α-helix	trans	-74.4	-40	172.6	-88	177.7	174.7	168.3	0	113.5	E151 T152 F153	E151-K155 WeakPolarHBondContact O-CB 3.47Å; E151-K155 PolarHBondContact O-N 2.94Å; T152-K155 PolarHBondContact O-N 3.3Å; F153-K155 VanDerWaalsContact C-N 3.31Å; F153-K155 PolarHBondContact O-N 2.81Å
156	L	60.4	Low	54.8	Low	100 Å²	100	117.7 Å²	117.7	52%	0.524	63%	0.626	S	S	.	*	H	α-helix	trans	-71.7	-39.7	177.1	-89.6	76.6	0	0	0	112.2	T152 F153 K158 L159 N160	T152-L156 VanDerWaalsContact O-CD1 3.29Å; T152-L156 WeakPolarHBondContact O-CD1 3.41Å; T152-L156 PolarHBondContact O-N 3.22Å; F153-L156 PolarHBondContact O-N 2.97Å; L156-K158 VanDerWaalsContact C-N 3.3Å; L156-K158 PolarHBondContact O-N 2.82Å; L156-L159 PolarHBondContact O-N 2.79Å; L156-L159 VanDerWaalsContact O-N 3.09Å; L156-N160 PolarHBondContact O-N 2.87Å
157	A	58.3	Low	53.3	Low	59 Å²	59	122.8 Å²	122.8	49%	0.488	64%	0.641	S	S	.	*	H	α-helix	trans	-57.5	-44.5	176	0	0	0	0	0	111.5	F153 L159 N160	F153-A157 VanDerWaalsContact O-CB 3.27Å; F153-A157 WeakPolarHBondContact O-CB 3.36Å; F153-A157 PolarHBondContact O-N 3.1Å; A157-L159 PolarHBondContact O-N 3.12Å; A157-L159 VanDerWaalsContact O-N 3.12Å; A157-N160 PolarHBondContact O-N 2.84Å; A157-N160 VanDerWaalsContact O-N 3.15Å
158	K	58.1	Low	51.6	Low	166 Å²	166	128.4 Å²	128.4	72%	0.722	66%	0.657	S	S	*	*	H	α-helix	trans	-71.1	1.2	178.1	-71.3	-179.8	177.7	-176.6	0	115.5	I154 L156	I154-K158 HydrophobicContact CG2-CD 4.36Å; I154-K158 VanDerWaalsContact O-CG 3.32Å; I154-K158 WeakPolarHBondContact O-CG 3.43Å; I154-K158 PolarHBondContact O-N 2.53Å; L156-K158 VanDerWaalsContact C-N 3.3Å; L156-K158 PolarHBondContact O-N 2.82Å
159	L	59.1	Low	50.6	Low	138 Å²	138	130.2 Å²	130.2	72%	0.723	67%	0.67	S	S	*	*	H	α-helix	trans	-111.3	-5	172.7	-77.9	168.7	0	0	0	113.1	L156 A157	L156-L159 PolarHBondContact O-N 2.79Å; L156-L159 VanDerWaalsContact O-N 3.09Å; A157-L159 PolarHBondContact O-N 3.12Å; A157-L159 VanDerWaalsContact O-N 3.12Å
160	N	55.6	Low	49.4	Very low	124 Å²	124	129.3 Å²	129.3	66%	0.663	68%	0.678	S	S	*	*	H	α-helix	trans	-109.2	-4.8	-171.4	-71.8	-6.9	0	0	0	114.6	L156 A157 D162	L156-N160 PolarHBondContact O-N 2.87Å; A157-N160 PolarHBondContact O-N 2.84Å; A157-N160 VanDerWaalsContact O-N 3.15Å; N160-D162 VanDerWaalsContact C-N 3.26Å; N160-D162 PolarHBondContact O-N 2.77Å
161	D	56.9	Low	48.5	Very low	151 Å²	151	132.8 Å²	132.8	81%	0.807	70%	0.696	S	S	*	*	S	Bend	trans	-70.5	-23.3	173.7	-79	-48	0	0	0	112.3	K163	D161-K163 PolarHBondContact O-N 3.1Å; D161-K163 VanDerWaalsContact O-N 3.08Å
162	D	52.2	Low	47.3	Very low	152 Å²	152	135.2 Å²	135.2	81%	0.813	71%	0.707	S	S	*	*	S	Bend	trans	-84.2	82.1	177.9	-86.4	-45.8	0	0	0	112.9	N160	N160-D162 VanDerWaalsContact C-N 3.26Å; N160-D162 PolarHBondContact O-N 2.77Å
163	K	41.1	Very low	46.3	Very low	186 Å²	186	140.5 Å²	140.5	81%	0.809	73%	0.727	S	S	*	*			trans	86.2	152.5	142.8	-141.7	168.5	-171.8	-67.2	0	118	D161	D161-K163 PolarHBondContact O-N 3.1Å; D161-K163 VanDerWaalsContact O-N 3.08Å
164	V	41.2	Very low	45.2	Very low	128 Å²	128	142.3 Å²	142.3	78%	0.776	74%	0.735	S	S	*	*			trans	83.3	72.2	172	-162.9	0	0	0	0	117.2
165	D	39.1	Very low	43.7	Very low	138 Å²	138	142.8 Å²	142.8	74%	0.738	75%	0.746	S	S	*	*				4.3	121.7	126.1	-174.7	16.4	0	0	0	118.4
166	V	42.3	Very low	42.4	Very low	119 Å²	119	140.3 Å²	140.3	72%	0.721	75%	0.745	S	S	*	*				-179	114	127.3	149	0	0	0	0	112.4
167	K	36.7	Very low	41.1	Very low	190 Å²	190	141.6 Å²	141.6	83%	0.826	76%	0.759	S	S	*	*			trans	37.8	118.5	149.3	-57	179.9	-179.1	177.2	0	121.9
168	Q	27.7	Very low	40.3	Very low	181 Å²	181	145.8 Å²	145.8	85%	0.846	77%	0.772	S	S	*	*			trans	-76.2	160.6	157.4	-67.6	178	-29.7	0	0	113.1
169	P	34.5	Very low	38.9	Very low	117 Å²	117	144.4 Å²	144.4	76%	0.76	78%	0.777	S	S	*	*				-135.7	133	115.9	36.2	-25.5	0	0	0	111.9
170	S	29.3	Very low	37.9	Very low	98 Å²	98	143.9 Å²	143.9	69%	0.685	78%	0.779	S	S	*	*			cis	64.8	87.6	47.5	73.9	0	0	0	0	116.2
171	V	38.9	Very low	37	Very low	140 Å²	140	144 Å²	144	85%	0.848	79%	0.785	S	S	*	*			trans	-140.9	121.6	151.8	-179.7	0	0	0	0	108.9
172	E	29.1	Very low	35.8	Very low	185 Å²	185	144.3 Å²	144.3	86%	0.864	79%	0.786	S	S	*	*			trans	-108.2	135.7	168.7	-65.9	-177.1	112.2	0	0	110.7
173	Q	37.7	Very low	35.1	Very low	186 Å²	186	143.8 Å²	143.8	87%	0.869	78%	0.784	S	S	*	*			trans	-157	113.1	159.3	-116.2	172.6	4	0	0	107.7
174	K	31.9	Very low	34.8	Very low	181 Å²	181	143.4 Å²	143.4	79%	0.787	78%	0.782	S	S	*	*			cis	83.8	140.4	26.6	-154.1	-166.3	174.8	176.5	0	114
175	C	27.9	Very low	34.6	Very low	107 Å²	107	143.4 Å²	143.4	72%	0.723	78%	0.782	S	S	*	*			trans	85.7	162.4	173.3	-54.7	0	0	0	0	114.7
176	P	32.7	Very low	34.3	Very low	100 Å²	100	141.5 Å²	141.5	65%	0.649	78%	0.778	S	S	*	*				-135.6	178.8	-95.4	27.5	-2.7	0	0	0	114.7
177	P	33.6	Very low	33.8	Very low	128 Å²	128	142.2 Å²	142.2	83%	0.831	78%	0.778	S	S	*	*			trans	-72.2	148.7	168.9	30.9	-36.1	0	0	0	112.5
178	I	40.1	Very low	33.4	Very low	146 Å²	146	141.7 Å²	141.7	75%	0.749	78%	0.779	S	S	*	*			trans	-131.9	142.4	174.8	-68.7	179.7	0	0	0	109.8	V180	I178-V180 HydrophobicContact CG2-CG2 4.11Å
179	V	29.8	Very low	33.7	Very low	137 Å²	137	138.4 Å²	138.4	83%	0.83	78%	0.776	S	S	*	*			trans	-116.6	129.3	175.5	174.5	0	0	0	0	108.6
180	V	38.4	Very low	33.5	Very low	127 Å²	127	141.9 Å²	141.9	77%	0.77	78%	0.779	S	S	*	*			trans	-138.7	150.8	166.8	-175.6	0	0	0	0	109.7	I178	I178-V180 HydrophobicContact CG2-CG2 4.11Å
181	T	36.6	Very low	33.7	Very low	126 Å²	126	143.3 Å²	143.3	77%	0.773	78%	0.784	S	S	*	*			trans	-84.2	168.1	-161.5	45.2	0	0	0	0	116.5
182	N	31.1	Very low	33.3	Very low	158 Å²	158	143 Å²	143	85%	0.845	78%	0.777	S	S	*	*			trans	-82.6	144.4	167.2	-55.7	-37.9	0	0	0	112.2
183	D	37.5	Very low	33.3	Very low	142 Å²	142	141 Å²	141	76%	0.759	77%	0.771	S	S	*	*			trans	-175.2	155.9	155.9	-100.9	-34.4	0	0	0	106.3
184	K	35.7	Very low	33.1	Very low	177 Å²	177	140.6 Å²	140.6	77%	0.77	77%	0.769	S	S	*	*			cis	-171.6	-175.8	-26.9	-134.7	-173.7	-172.9	178.1	0	106.5
185	V	35.4	Very low	32.9	Very low	128 Å²	128	137.4 Å²	137.4	78%	0.776	76%	0.764	S	S	*	*			trans	74.7	118.6	173.4	-163.1	0	0	0	0	111.7
186	C	32.7	Very low	33.1	Very low	98 Å²	98	138.2 Å²	138.2	66%	0.662	77%	0.766	S	S	*	*				73.8	139.8	57.7	-69.3	0	0	0	0	112.9
187	D	32.9	Very low	32.9	Very low	135 Å²	135	142.2 Å²	142.2	72%	0.722	77%	0.773	S	S	*	*			cis	-155.7	157.3	-3.9	-95.6	-27.4	0	0	0	111.8
188	E	28.7	Very low	32.8	Very low	179 Å²	179	144 Å²	144	84%	0.836	77%	0.771	S	S	*	*			trans	52.2	165.8	148.6	-66.6	-158.1	155.2	0	0	124.4
189	S	33.4	Very low	32.2	Very low	112 Å²	112	143.3 Å²	143.3	78%	0.783	78%	0.778	S	S	*	*			trans	68.7	128.9	175.8	71.5	0	0	0	0	115.6
190	K	31	Very low	32.4	Very low	189 Å²	189	142.3 Å²	142.3	82%	0.822	77%	0.767	S	S	*	*			cis	120.1	147.9	20.9	-98.7	-174	175.6	177	0	107.4
191	T	32.9	Very low	31.8	Very low	128 Å²	128	143.7 Å²	143.7	79%	0.785	77%	0.765	S	S	*	*			trans	64.4	159.5	179.6	75.3	0	0	0	0	114.9
192	D	31.3	Very low	31.5	Very low	134 Å²	134	146.8 Å²	146.8	72%	0.717	77%	0.768	S	S	*	*			cis	-159.6	161.1	-47.1	-104.3	-54.4	0	0	0	107.3	H194	D192-H194 PolarHBondContact O-N 3.28Å
193	I	27.5	Very low	31.4	Very low	143 Å²	143	142.2 Å²	142.2	73%	0.733	75%	0.749	S	S	*	*			trans	-6.2	118	159.9	-52.2	166	0	0	0	115.7
194	H	33.3	Very low	30.9	Very low	177 Å²	177	143.7 Å²	143.7	82%	0.819	75%	0.751	S	S	*	*			trans	-150	128.8	141.9	-129.7	-78.5	0	0	0	115.6	D192	D192-H194 PolarHBondContact O-N 3.28Å
195	T	28.5	Very low	30.7	Very low	114 Å²	114	142 Å²	142	70%	0.699	75%	0.75	S	S	*	*			trans	-82.7	124.5	179	-57.6	0	0	0	0	111.6
196	V	32.9	Very low	30.4	Very low	125 Å²	125	144.2 Å²	144.2	76%	0.758	75%	0.75	S	S	*	*			trans	-137.2	95.9	166.3	178.5	0	0	0	0	105.9
197	K	27.4	Very low	30.4	Very low	183 Å²	183	147.6 Å²	147.6	80%	0.796	76%	0.761	S	S	*	*				40.5	100.6	86.3	-79.2	-169.9	174.4	-177.5	0	113.5
198	E	32.3	Very low	30.2	Very low	167 Å²	167	149.4 Å²	149.4	78%	0.78	77%	0.765	S	S	*	*				-160.2	119.5	124.6	-114	172.8	-167.5	0	0	112.6	I200	E198-I200 HydrophobicContact CB-CG1 4.45Å; E198-I200 VanDerWaalsContact CD-CD1 3.41Å; E198-I200 HydrophobicContact CG-CD1 3.89Å; E198-I200 HydrophobicContact CG-CG1 3.95Å; E198-I200 WeakPolarHBondContact OE2-CD1 3.32Å
199	S	27	Very low	30.6	Very low	130 Å²	130	146.6 Å²	146.6	91%	0.909	77%	0.765	S	S	*	*			trans	-101.3	103.9	159.4	-58.7	0	0	0	0	106.5
200	I	33.4	Very low	30.4	Very low	116 Å²	116	148.7 Å²	148.7	60%	0.595	77%	0.768	S	S	*	*			trans	-117.6	142.3	174.1	-68	-173.5	0	0	0	110.5	E198 F202	E198-I200 HydrophobicContact CB-CG1 4.45Å; E198-I200 VanDerWaalsContact CD-CD1 3.41Å; E198-I200 HydrophobicContact CG-CD1 3.89Å; E198-I200 HydrophobicContact CG-CG1 3.95Å; E198-I200 WeakPolarHBondContact OE2-CD1 3.32Å; I200-F202 HydrophobicContact CG2-CD2 4.06Å; I200-F202 HydrophobicContact CG2-CE2 4.24Å
201	H	26.2	Very low	30.6	Very low	157 Å²	157	148 Å²	148	73%	0.727	77%	0.771	S	S	*	*			trans	-130	112	-162.5	167.3	-73.9	0	0	0	109.4
202	F	30.8	Very low	30.4	Very low	191 Å²	191	150.3 Å²	150.3	84%	0.838	77%	0.77	S	S	*	*			trans	-138.9	109.2	168.5	-85.2	-81.5	0	0	0	107.5	I200	I200-F202 HydrophobicContact CG2-CD2 4.06Å; I200-F202 HydrophobicContact CG2-CE2 4.24Å
203	S	27.9	Very low	30.6	Very low	62 Å²	62	151.5 Å²	151.5	43%	0.434	78%	0.776	S	S	.	*			cis	80.1	103.4	23.5	99.3	0	0	0	0	116.2
204	Q	28.7	Very low	30.9	Very low	172 Å²	172	149.7 Å²	149.7	80%	0.804	77%	0.767	S	S	*	*			trans	69.6	119.8	149	-60	179.7	-12.2	0	0	119.8
205	N	30.7	Very low	30.9	Very low	143 Å²	143	148.6 Å²	148.6	77%	0.765	77%	0.768	S	S	*	*				164.1	108.5	121.8	-79.1	-23	0	0	0	106.3
206	K	28.7	Very low	31	Very low	174 Å²	174	147.1 Å²	147.1	76%	0.757	76%	0.762	S	S	*	*			cis	47.2	103.4	48.8	-98.6	-156	177.7	-154.8	0	112.6
207	N	33.7	Very low	31.1	Very low	169 Å²	169	148.5 Å²	148.5	90%	0.904	77%	0.765	S	S	*	*			trans	-155.2	134.3	141.8	-95.4	-29.1	0	0	0	108.5
208	E	28.6	Very low	31.4	Very low	173 Å²	173	148.4 Å²	148.4	81%	0.808	77%	0.765	S	S	*	*			trans	-105.4	131.8	179.9	-64.5	164.6	167.9	0	0	108.4
209	S	36.3	Very low	31.4	Very low	120 Å²	120	148.5 Å²	148.5	84%	0.839	77%	0.77	S	S	*	*			trans	-155.1	129	157.9	57.4	0	0	0	0	111.6
210	N	28.6	Very low	31.5	Very low	156 Å²	156	148.4 Å²	148.4	83%	0.834	76%	0.764	S	S	*	*			trans	-72.3	152.8	178.8	-55.4	-87.4	0	0	0	111.5
211	I	36.4	Very low	31.6	Very low	175 Å²	175	151.4 Å²	151.4	90%	0.897	78%	0.776	S	S	*	*			trans	-152.7	140.5	137.3	-99.6	143.8	0	0	0	108.4
212	K	28.5	Very low	31.9	Very low	175 Å²	175	152.6 Å²	152.6	76%	0.761	78%	0.778	S	S	*	*			trans	-101.5	144.2	175.8	-67.7	-179.9	174.5	-174.7	0	110.8
213	L	35.6	Very low	31.6	Very low	159 Å²	159	149.2 Å²	149.2	83%	0.832	78%	0.777	S	S	*	*				-170.3	111	129.4	-127.2	59.9	0	0	0	106.6
214	D	32.9	Very low	31.6	Very low	105 Å²	105	151.8 Å²	151.8	56%	0.561	80%	0.795	S	S	*	*				58	91.5	70.1	-70.2	-43.2	0	0	0	114.1
215	N	34.7	Very low	31.6	Very low	155 Å²	155	149.3 Å²	149.3	83%	0.829	79%	0.794	S	S	*	*				-170.3	85.5	117.5	-96.9	-43.5	0	0	0	113.8
216	S	30.5	Very low	31.6	Very low	83 Å²	83	149.5 Å²	149.5	58%	0.58	80%	0.8	S	S	*	*				22.3	146.2	124.3	-49.2	0	0	0	0	122
217	N	34.8	Very low	31.7	Very low	153 Å²	153	150.2 Å²	150.2	82%	0.818	80%	0.803	S	S	*	*			trans	85.8	141.5	155.9	-56.3	-46.3	0	0	0	118
218	K	32.8	Very low	31.5	Very low	182 Å²	182	147.9 Å²	147.9	79%	0.791	80%	0.795	S	S	*	*			cis	-171.5	116.2	-13.4	166.1	-173.1	178.4	-173.7	0	109.9
219	L	33.3	Very low	31.8	Very low	169 Å²	169	148.5 Å²	148.5	89%	0.885	80%	0.798	S	S	*	*			trans	-176.9	134.2	139.3	-103.8	160.7	0	0	0	109.6
220	T	27.7	Very low	31.7	Very low	128 Å²	128	149.5 Å²	149.5	79%	0.785	79%	0.794	S	S	*	*			trans	-133.1	128.1	-169.7	51.3	0	0	0	0	111
221	E	35.9	Very low	32.1	Very low	179 Å²	179	147.4 Å²	147.4	84%	0.836	78%	0.783	S	S	*	*			trans	-148	96.2	149.7	-135.9	157.4	-139.4	0	0	114
222	K	32.6	Very low	32	Very low	181 Å²	181	144.8 Å²	144.8	79%	0.787	78%	0.777	S	S	*	*			trans	33.6	97.3	139.4	-59.5	171.8	-177.7	171.1	0	116.3
223	C	25.5	Very low	32.4	Very low	120 Å²	120	142.9 Å²	142.9	81%	0.811	77%	0.774	S	S	*	*				55.2	113.4	64.7	-50.9	0	0	0	0	115.7
224	S	27.4	Very low	32.7	Very low	116 Å²	116	140.8 Å²	140.8	81%	0.811	77%	0.768	S	S	*	*				-169.6	149.5	115.1	-80.5	0	0	0	0	111.7
225	P	28.7	Very low	32.9	Very low	120 Å²	120	145.3 Å²	145.3	78%	0.779	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-86.1	138.4	-168.4	32.9	-35.2	0	0	0	113.9
226	V	30.4	Very low	33	Very low	147 Å²	147	142.8 Å²	142.8	89%	0.891	78%	0.777	S	S	*	*	P	Polyproline II helix	trans	-79.7	128.7	166.4	-179.9	0	0	0	0	109.2
227	K	31.9	Very low	33.2	Very low	190 Å²	190	146 Å²	146	83%	0.826	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-69.6	133.6	-166	-61.1	162.2	-176	171.6	0	111.9	Q229	K227-Q229 PolarHBondContact O-N 2.86Å; K227-Q229 VanDerWaalsContact O-N 3.09Å
228	T	28.8	Very low	33.4	Very low	120 Å²	120	146.2 Å²	146.2	74%	0.736	79%	0.787	S	S	*	*			trans	-55.8	114.2	159.5	-47.2	0	0	0	0	108.8	N230	T228-N230 VanDerWaalsContact C-N 3.32Å; T228-N230 PolarHBondContact O-N 3.02Å
229	Q	34.6	Very low	33.4	Very low	186 Å²	186	145.2 Å²	145.2	87%	0.869	79%	0.786	S	S	*	*			trans	-77.1	86.9	179.9	-165	175.3	19.9	0	0	109.3	K227 N231	K227-Q229 PolarHBondContact O-N 2.86Å; K227-Q229 VanDerWaalsContact O-N 3.09Å; Q229-N231 VanDerWaalsContact C-N 3.31Å; Q229-N231 PolarHBondContact O-N 3.47Å
230	N	34.2	Very low	33.3	Very low	141 Å²	141	143.1 Å²	143.1	75%	0.754	78%	0.782	S	S	*	*			trans	-62.8	89.7	176.7	-74.1	-24.2	0	0	0	110.4	T228	T228-N230 VanDerWaalsContact C-N 3.32Å; T228-N230 PolarHBondContact O-N 3.02Å
231	N	36.3	Very low	33.6	Very low	112 Å²	112	145.7 Å²	145.7	60%	0.599	78%	0.782	S	S	*	*			trans	-68.3	119	177.5	-159.6	-9.4	0	0	0	108.6	Q229 L233 V234	Q229-N231 VanDerWaalsContact C-N 3.31Å; Q229-N231 PolarHBondContact O-N 3.47Å; N231-L233 PolarHBondContact O-N 3.49Å; N231-V234 PolarHBondContact O-N 2.71Å
232	P	34.4	Very low	33.3	Very low	119 Å²	119	143.8 Å²	143.8	77%	0.773	78%	0.783	S	S	*	*	G	3₁₀ helix	trans	-68.3	-2.5	-164.1	24.8	-35.1	0	0	0	115.6
233	L	37.4	Very low	33.2	Very low	135 Å²	135	139.1 Å²	139.1	71%	0.707	78%	0.779	S	S	*	*	G	3₁₀ helix	trans	-81.8	-8.4	-179.6	-111	159.5	0	0	0	114.9	N231	N231-L233 PolarHBondContact O-N 3.49Å
234	V	42.2	Very low	33.4	Very low	116 Å²	116	138.6 Å²	138.6	70%	0.703	78%	0.776	S	S	*	*	G	3₁₀ helix	trans	-95.3	-0.1	-170.2	-167.8	0	0	0	0	113.5	N231	N231-V234 PolarHBondContact O-N 2.71Å
235	K	36.5	Very low	33.7	Very low	199 Å²	199	140.8 Å²	140.8	87%	0.865	78%	0.777	S	S	*	*	S	Bend	trans	-105.3	-6.6	179.6	-84.5	-162.6	172	-167.4	0	116.3
236	S	36.7	Very low	33.8	Very low	102 Å²	102	142.8 Å²	142.8	71%	0.713	78%	0.776	S	S	*	*	S	Bend	trans	-94.6	3.4	-178.3	63.9	0	0	0	0	115
237	L	36.4	Very low	33.7	Very low	152 Å²	152	140.7 Å²	140.7	80%	0.796	77%	0.768	S	S	*	*	S	Bend	trans	-110.4	0.3	-174.1	-162.2	58.2	0	0	0	113.7
238	L	37.5	Very low	33.5	Very low	156 Å²	156	138 Å²	138	82%	0.817	77%	0.769	S	S	*	*	S	Bend	trans	-126.9	42.5	-176.7	-104.5	86.8	0	0	0	113.5
239	E	33.6	Very low	33.5	Very low	161 Å²	161	137.3 Å²	137.3	75%	0.752	77%	0.77	S	S	*	*			trans	-133.2	114.1	159.3	-78.6	-162.9	166.9	0	0	110.8	K241	E239-K241 VanDerWaalsContact C-N 3.3Å; E239-K241 PolarHBondContact O-N 3.44Å
240	P	31.7	Very low	33.4	Very low	125 Å²	125	135.5 Å²	135.5	81%	0.812	77%	0.765	S	S	*	*			trans	-79.6	77.2	176.3	33	-34.2	0	0	0	110.3	T242	P240-T242 PolarHBondContact O-N 2.84Å
241	K	32.6	Very low	33.2	Very low	182 Å²	182	138.4 Å²	138.4	79%	0.791	77%	0.77	S	S	*	*			trans	-78.2	83.5	-178.6	-163.9	162.6	-169.8	165.9	0	112	E239 A243	E239-K241 VanDerWaalsContact C-N 3.3Å; E239-K241 PolarHBondContact O-N 3.44Å; K241-A243 PolarHBondContact O-N 3.35Å
242	T	29.2	Very low	33	Very low	140 Å²	140	138.8 Å²	138.8	86%	0.859	77%	0.773	S	S	*	*			trans	-55.4	114.9	169	50.4	0	0	0	0	110.7	P240	P240-T242 PolarHBondContact O-N 2.84Å
243	A	31.6	Very low	32.8	Very low	83 Å²	83	139 Å²	139	69%	0.686	77%	0.767	S	S	*	*			trans	-131.1	79.9	175.4	0	0	0	0	0	109.5	K241 I245	K241-A243 PolarHBondContact O-N 3.35Å; A243-I245 PolarHBondContact O-N 3.5Å
244	S	29.6	Very low	32.4	Very low	108 Å²	108	139.4 Å²	139.4	76%	0.755	77%	0.77	S	S	*	*			trans	-66.6	121.7	164.3	179.9	0	0	0	0	108.5
245	I	32.8	Very low	31.7	Very low	163 Å²	163	143.9 Å²	143.9	84%	0.836	78%	0.781	S	S	*	*			trans	-113.4	96	163.9	-62	-178.2	0	0	0	105.9	A243	A243-I245 PolarHBondContact O-N 3.5Å
246	Q	31.2	Very low	31.3	Very low	162 Å²	162	140.1 Å²	140.1	76%	0.757	77%	0.774	S	S	*	*	P	Polyproline II helix	trans	-83.1	145.1	-179.1	-160.9	169	18.4	0	0	110.2
247	S	28.8	Very low	30.8	Very low	102 Å²	102	140.9 Å²	140.9	71%	0.713	77%	0.774	S	S	*	*	P	Polyproline II helix	trans	-56.5	149.2	174.6	-56.7	0	0	0	0	111.7
248	P	28.5	Very low	30.6	Very low	133 Å²	133	141.1 Å²	141.1	86%	0.864	78%	0.776	S	S	*	*	P	Polyproline II helix	trans	-72.2	138	-168.6	28.9	-35.7	0	0	0	112.8
249	S	29.2	Very low	30.2	Very low	107 Å²	107	141.8 Å²	141.8	75%	0.748	77%	0.772	S	S	*	*			trans	-134.8	123.4	162.7	-173.5	0	0	0	0	109	K251	S249-K251 PolarHBondContact O-N 3.41Å
250	I	31.1	Very low	29.8	Very low	148 Å²	148	141.1 Å²	141.1	76%	0.759	77%	0.774	S	S	*	*			trans	-74.6	115.2	177.9	-64	168.3	0	0	0	107.7
251	K	29.5	Very low	29.9	Very low	201 Å²	201	140.7 Å²	140.7	87%	0.874	77%	0.774	S	S	*	*			trans	-98.6	88.1	163.3	-77.7	-167.4	174.4	-175.8	0	109.5	S249	S249-K251 PolarHBondContact O-N 3.41Å
252	D	31.8	Very low	29.7	Very low	121 Å²	121	139.4 Å²	139.4	65%	0.647	78%	0.775	S	S	*	*			trans	-60.9	137	157.8	-93.5	-62	0	0	0	110.1
253	N	31.3	Very low	29.7	Very low	123 Å²	123	139 Å²	139	66%	0.658	77%	0.768	S	S	*	*			trans	47.6	109.9	150.9	-54.9	-54.6	0	0	0	119.1
254	N	29.1	Very low	29.6	Very low	144 Å²	144	140.9 Å²	140.9	77%	0.77	77%	0.77	S	S	*	*				21.1	118.8	126.7	-54	-24.1	0	0	0	117.2
255	F	28.2	Very low	29.6	Very low	210 Å²	210	143.9 Å²	143.9	92%	0.921	78%	0.775	S	S	*	*				-152.9	152.8	105.6	-124.9	-87.3	0	0	0	111.8
256	V	27.7	Very low	29.2	Very low	119 Å²	119	143.5 Å²	143.5	72%	0.721	77%	0.773	S	S	*	*			trans	-107.5	124.3	179	163.5	0	0	0	0	108.1
257	V	26.5	Very low	29.3	Very low	119 Å²	119	140.7 Å²	140.7	72%	0.721	77%	0.769	S	S	*	*			trans	49.3	118.6	153.6	176.7	0	0	0	0	117.5
258	D	30.4	Very low	29.4	Very low	156 Å²	156	144.2 Å²	144.2	83%	0.834	77%	0.774	S	S	*	*				-150.2	174.5	109.8	-134.5	-31.4	0	0	0	113.8
259	K	29.6	Very low	29.3	Very low	170 Å²	170	145.1 Å²	145.1	74%	0.739	77%	0.765	S	S	*	*			trans	-113.5	168.5	-171	-73.2	-173.9	174	-177.5	0	113.6
260	N	26.4	Very low	29.3	Very low	147 Å²	147	147.1 Å²	147.1	79%	0.786	76%	0.764	S	S	*	*			trans	65.6	89.4	153.2	-61.7	-7.6	0	0	0	118.6
261	S	33.2	Very low	29	Very low	117 Å²	117	146.9 Å²	146.9	82%	0.818	76%	0.76	S	S	*	*				-176.3	125.9	127.6	-74.9	0	0	0	0	106.2
262	L	28.5	Very low	29.2	Very low	155 Å²	155	143.9 Å²	143.9	81%	0.812	75%	0.752	S	S	*	*			cis	71.8	127.1	44.6	-157.3	74.2	0	0	0	113
263	D	29.1	Very low	29.1	Very low	132 Å²	132	143 Å²	143	71%	0.706	76%	0.755	S	S	*	*			trans	71	112.5	166.1	-71.3	-12.4	0	0	0	122.7
264	V	28.4	Very low	29	Very low	122 Å²	122	141.8 Å²	141.8	74%	0.739	76%	0.756	S	S	*	*				88.9	145.2	121.2	172.2	0	0	0	0	120.5
265	M	29.4	Very low	28.8	Very low	171 Å²	171	139.7 Å²	139.7	84%	0.842	75%	0.753	S	S	*	*			trans	78.9	91.6	164.3	-86.6	165.7	61.9	0	0	121.3
266	L	25.1	Very low	28.8	Very low	154 Å²	154	137 Å²	137	81%	0.806	75%	0.747	S	S	*	*				-51.4	173.8	126.6	-113.5	71.6	0	0	0	111.9
267	P	33.6	Very low	29	Very low	103 Å²	103	138.9 Å²	138.9	67%	0.669	75%	0.748	S	S	*	*			cis	-133.9	179.7	-18.7	39.9	-25.1	0	0	0	113
268	Q	31.5	Very low	28.9	Very low	177 Å²	177	139.3 Å²	139.3	83%	0.827	74%	0.744	S	S	*	*				-169.2	139.7	118.1	-106.2	175.5	16.5	0	0	113.1
269	K	25.9	Very low	29	Very low	152 Å²	152	139 Å²	139	66%	0.661	74%	0.742	S	S	*	*			trans	-108.3	137.1	166.1	-176.4	-163	-171.5	-160	0	107	E271	K269-E271 WeakPolarHBondContact CE-OE1 3.48Å; K269-E271 WeakPolarHBondContact CE-OE2 3.25Å; K269-E271 IonicContact NZ-OE1 2.64Å; K269-E271 PolarHBondContact NZ-OE1 3.45Å; K269-E271 IonicContact NZ-OE2 2.67Å; K269-E271 PolarHBondContact NZ-OE2 3.41Å
270	M	29.6	Very low	28.9	Very low	148 Å²	148	136.4 Å²	136.4	73%	0.729	74%	0.735	S	S	*	*			trans	-135.8	114.4	167.8	-165.5	171.4	-69.8	0	0	110.3	I272	M270-I272 HydrophobicContact CG-CD1 4.36Å; M270-I272 HydrophobicContact CG-CG1 4.19Å; M270-I272 HydrophobicContact SD-CD1 4.2Å
271	E	24.7	Very low	29.2	Very low	144 Å²	144	138 Å²	138	67%	0.673	74%	0.738	S	S	*	*			trans	-104.6	128.4	167.9	-77.7	162.6	158.5	0	0	108.8	K269	K269-E271 WeakPolarHBondContact CE-OE1 3.48Å; K269-E271 WeakPolarHBondContact CE-OE2 3.25Å; K269-E271 IonicContact NZ-OE1 2.64Å; K269-E271 PolarHBondContact NZ-OE1 3.45Å; K269-E271 IonicContact NZ-OE2 2.67Å; K269-E271 PolarHBondContact NZ-OE2 3.41Å
272	I	32.8	Very low	29.1	Very low	138 Å²	138	139.6 Å²	139.6	71%	0.708	73%	0.732	S	S	*	*			trans	-142.5	110.6	161.7	-37.6	179.7	0	0	0	102.3	M270	M270-I272 HydrophobicContact CG-CD1 4.36Å; M270-I272 HydrophobicContact CG-CG1 4.19Å; M270-I272 HydrophobicContact SD-CD1 4.2Å
273	S	29.2	Very low	29.2	Very low	103 Å²	103	139 Å²	139	72%	0.72	73%	0.726	S	S	*	*				56.2	137.1	72.7	-59.2	0	0	0	0	112.3
274	S	29.6	Very low	29.3	Very low	96 Å²	96	138.6 Å²	138.6	67%	0.671	72%	0.723	S	S	*	*			cis	-174.8	130.4	-9.8	44.5	0	0	0	0	110.2
275	S	25.6	Very low	29.6	Very low	100 Å²	100	138.6 Å²	138.6	70%	0.699	73%	0.726	S	S	*	*			trans	55.3	158.2	149.9	59.9	0	0	0	0	122.4
276	L	28.9	Very low	29.9	Very low	153 Å²	153	135.4 Å²	135.4	80%	0.801	73%	0.727	S	S	*	*			trans	75.3	147.3	169.4	-43.3	178.9	0	0	0	114.5
277	Q	30.5	Very low	30.2	Very low	160 Å²	160	135.9 Å²	135.9	75%	0.748	73%	0.729	S	S	*	*			cis	-150.4	167.7	-3.5	-168.7	59.3	1.6	0	0	110.9
278	M	25.7	Very low	30.3	Very low	127 Å²	127	135.7 Å²	135.7	63%	0.626	73%	0.728	S	S	*	*			trans	-39	145.2	174.2	-56.7	-86.6	-76.7	0	0	119.7	I280	M278-I280 HydrophobicContact CE-CD1 3.67Å
279	D	31	Very low	30.2	Very low	149 Å²	149	132.8 Å²	132.8	80%	0.797	72%	0.722	S	S	*	*				171.5	128.6	121.5	-86.1	-17.3	0	0	0	108.7
280	I	29.1	Very low	30.5	Very low	117 Å²	117	131.3 Å²	131.3	60%	0.6	73%	0.731	S	S	*	*			cis	86.1	94.1	45.7	-60.5	176.9	0	0	0	114.7	M278	M278-I280 HydrophobicContact CE-CD1 3.67Å
281	Q	31.9	Very low	30.4	Very low	180 Å²	180	133.3 Å²	133.3	84%	0.841	74%	0.736	S	S	*	*			trans	172.7	134.6	139.4	-93.9	158.8	60.2	0	0	108.7
282	Q	30.1	Very low	30.7	Very low	151 Å²	151	131.8 Å²	131.8	71%	0.706	74%	0.742	S	S	*	*			cis	76.7	121.5	37.4	-171	178	-3.2	0	0	110.9
283	E	32.5	Very low	30.6	Very low	143 Å²	143	130.4 Å²	130.4	67%	0.668	74%	0.744	S	S	*	*			cis	-145.3	-176.3	25.4	-75.6	-139.1	167.2	0	0	111.8
284	N	30.7	Very low	30.7	Very low	123 Å²	123	131 Å²	131	66%	0.658	75%	0.748	S	S	*	*			cis	-161.8	168.2	-39.4	-97.9	-22.3	0	0	0	109.6
285	P	35	Very low	30.8	Very low	121 Å²	121	132.2 Å²	132.2	79%	0.786	76%	0.756	S	S	*	*			trans	-101.4	166.3	-174	38.9	-35.3	0	0	0	115.7
286	A	35.7	Very low	31	Very low	105 Å²	105	132.9 Å²	132.9	87%	0.868	76%	0.761	S	S	*	*			trans	-126.9	149	171.6	0	0	0	0	0	113.2
287	L	31.5	Very low	31.2	Very low	164 Å²	164	130.7 Å²	130.7	86%	0.859	76%	0.759	S	S	*	*			trans	-116.2	-177.3	-167.2	-81.8	163	0	0	0	110.2
288	P	35.6	Very low	31.2	Very low	98 Å²	98	127.2 Å²	127.2	64%	0.636	75%	0.752	S	S	*	*			cis	-140.6	176.4	-34.9	35.5	-16.4	0	0	0	115.6
289	T	28.3	Very low	31.5	Very low	116 Å²	116	131.4 Å²	131.4	71%	0.712	76%	0.762	S	S	*	*			trans	41.9	131.2	143.2	56.1	0	0	0	0	123.3
290	S	33	Very low	31.4	Very low	122 Å²	122	129.2 Å²	129.2	85%	0.853	76%	0.755	S	S	*	*				-146.8	166.5	115.9	60.9	0	0	0	0	110.9
291	F	27.9	Very low	31.6	Very low	190 Å²	190	132.8 Å²	132.8	83%	0.833	77%	0.769	S	S	*	*			trans	-99.9	153	-165.1	-65.2	-107	0	0	0	113.4
292	S	30.8	Very low	31.6	Very low	112 Å²	112	130.7 Å²	130.7	78%	0.783	77%	0.768	S	S	*	*				-178.2	160.1	126.8	-86.9	0	0	0	0	116
293	S	30.7	Very low	31.5	Very low	108 Å²	108	131 Å²	131	76%	0.755	77%	0.773	S	S	*	*			trans	67.4	110.2	153	60.3	0	0	0	0	121.7
294	S	30.6	Very low	31.5	Very low	117 Å²	117	130.5 Å²	130.5	82%	0.818	78%	0.784	S	S	*	*			trans	51.1	112.9	132.5	62.2	0	0	0	0	121.2
295	S	31	Very low	31.5	Very low	120 Å²	120	128.4 Å²	128.4	84%	0.839	78%	0.784	S	S	*	*			trans	-118.8	96.7	158.8	57.1	0	0	0	0	111.2
296	S	31.2	Very low	31.5	Very low	114 Å²	114	131.9 Å²	131.9	80%	0.797	79%	0.786	S	S	*	*			trans	-84.9	110.9	166.7	43.2	0	0	0	0	109.8	S298	S296-S298 PolarHBondContact O-N 2.8Å
297	S	32.2	Very low	31.4	Very low	108 Å²	108	133 Å²	133	76%	0.755	78%	0.778	S	S	*	*			trans	-78	67.6	-178.9	50.1	0	0	0	0	113	Y299	S297-Y299 PolarHBondContact O-N 3.35Å
298	S	29.9	Very low	31.5	Very low	86 Å²	86	132.8 Å²	132.8	60%	0.601	77%	0.772	S	S	*	*			trans	-70.3	109.7	161	179.7	0	0	0	0	109.1	S296 T300	S296-S298 PolarHBondContact O-N 2.8Å; S298-T300 VanDerWaalsContact C-N 3.28Å; S298-T300 PolarHBondContact O-N 2.85Å; S298-T300 PolarHBondContact OG-OG1 2.74Å
299	Y	31.8	Very low	31.3	Very low	215 Å²	215	134 Å²	134	84%	0.843	78%	0.778	S	S	*	*			trans	-75.6	84.4	170.7	-91.2	-83.2	0	0	0	110.6	S297	S297-Y299 PolarHBondContact O-N 3.35Å
300	T	30.1	Very low	31.4	Very low	104 Å²	104	136.3 Å²	136.3	64%	0.638	79%	0.785	S	S	*	*			trans	-133.1	77.5	170.7	44.6	0	0	0	0	108.4	S298	S298-T300 VanDerWaalsContact C-N 3.28Å; S298-T300 PolarHBondContact O-N 2.85Å; S298-T300 PolarHBondContact OG-OG1 2.74Å
301	E	32.2	Very low	31.3	Very low	192 Å²	192	135.6 Å²	135.6	90%	0.897	78%	0.78	S	S	*	*	P	Polyproline II helix	trans	-71.6	129.4	169.1	-76.2	-161	130.1	0	0	110.1
302	V	31.9	Very low	31.5	Very low	135 Å²	135	133.5 Å²	133.5	82%	0.818	78%	0.777	S	S	*	*	P	Polyproline II helix	trans	-103	136.1	-178.3	175.1	0	0	0	0	109.2	C304	V302-C304 PolarHBondContact O-N 2.94Å
303	I	29.6	Very low	31.6	Very low	158 Å²	158	136.3 Å²	136.3	81%	0.81	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-61	131.6	179.1	-61.2	162.9	0	0	0	110.5	A305	I303-A305 HydrophobicContact CG2-CB 4.42Å
304	C	31.3	Very low	31.6	Very low	133 Å²	133	139.7 Å²	139.7	90%	0.899	79%	0.787	S	S	*	*			trans	-130.5	146.3	152.4	-156.2	0	0	0	0	109.2	V302	V302-C304 PolarHBondContact O-N 2.94Å
305	A	31	Very low	31.7	Very low	79 Å²	79	140 Å²	140	65%	0.653	78%	0.784	S	S	*	*			trans	-135.2	156.3	-152.7	0	0	0	0	0	114.5	I303	I303-A305 HydrophobicContact CG2-CB 4.42Å
306	K	35.4	Very low	31.7	Very low	193 Å²	193	139 Å²	139	84%	0.839	78%	0.777	S	S	*	*			trans	-157.1	107.9	149	-112.9	165.8	-175.3	175	0	111.2
307	N	32.7	Very low	31.7	Very low	129 Å²	129	141.8 Å²	141.8	69%	0.69	78%	0.782	S	S	*	*			trans	47.5	146.1	138.9	-57	-17.9	0	0	0	120.7
308	Q	34.7	Very low	31.7	Very low	159 Å²	159	141.9 Å²	141.9	74%	0.743	78%	0.78	S	S	*	*			cis	-165.3	159.3	-9.3	-98.6	163.2	34.4	0	0	103.3
309	V	30.8	Very low	31.6	Very low	125 Å²	125	141.7 Å²	141.7	76%	0.758	77%	0.771	S	S	*	*			cis	-157.9	-179.9	46	-178.5	0	0	0	0	107.3
310	L	31	Very low	31.7	Very low	164 Å²	164	137.2 Å²	137.2	86%	0.859	77%	0.766	S	S	*	*			trans	77.1	68.4	171.6	-58.4	-177.1	0	0	0	116.9
311	S	29.6	Very low	31.5	Very low	107 Å²	107	135.6 Å²	135.6	75%	0.748	76%	0.756	S	S	*	*			trans	-87.6	140.4	144.6	56.3	0	0	0	0	110.1
312	N	32.7	Very low	31.6	Very low	146 Å²	146	137.9 Å²	137.9	78%	0.781	76%	0.757	S	S	*	*			trans	-160.6	89.2	146.1	-105.1	-23.3	0	0	0	112.5
313	Q	34	Very low	31.4	Very low	171 Å²	171	139.1 Å²	139.1	80%	0.799	75%	0.753	S	S	*	*			trans	45.8	112.9	139	-54.6	-176.5	18.6	0	0	120
314	L	30.4	Very low	31.5	Very low	179 Å²	179	136.7 Å²	136.7	94%	0.937	75%	0.75	S	S	*	*			trans	-147.6	63.7	138.1	-150.3	90.4	0	0	0	112.1
315	T	31.8	Very low	31.6	Very low	124 Å²	124	135.8 Å²	135.8	76%	0.761	75%	0.746	S	S	*	*	S	Bend	trans	-134.2	134.8	177.6	-37.4	0	0	0	0	111.1
316	S	30.6	Very low	31.6	Very low	98 Å²	98	136.8 Å²	136.8	69%	0.685	75%	0.748	S	S	*	*			trans	46.2	96.9	163.2	58.2	0	0	0	0	118.2
317	L	31.4	Very low	31.6	Very low	173 Å²	173	133.6 Å²	133.6	91%	0.906	75%	0.75	S	S	*	*			trans	-72.5	124	150.5	-83	166.3	0	0	0	109.1
318	P	33.2	Very low	31.4	Very low	109 Å²	109	130.3 Å²	130.3	71%	0.708	75%	0.747	S	S	*	*			trans	-78.9	134.4	178.3	31	-33.6	0	0	0	111.5	V320	P318-V320 PolarHBondContact O-N 3.38Å
319	I	26.5	Very low	31.4	Very low	82 Å²	82	130.1 Å²	130.1	42%	0.421	75%	0.751	S	S	.	*			trans	-78.6	108.1	167.2	-72	163.1	0	0	0	107.9	T606	I319-T606 WeakPolarHBondContact CG2-OG1 3.36Å
320	V	33.9	Very low	31.4	Very low	122 Å²	122	129.2 Å²	129.2	74%	0.739	75%	0.75	S	S	*	*			trans	-136.2	103.6	167.8	-178.1	0	0	0	0	109.2	P318	P318-V320 PolarHBondContact O-N 3.38Å
321	T	27.8	Very low	31.3	Very low	70 Å²	70	127 Å²	127	43%	0.429	75%	0.747	S	S	.	*			trans	-72.8	128.6	169.7	-50.5	0	0	0	0	109.4
322	R	33.6	Very low	31.4	Very low	240 Å²	240	126.8 Å²	126.8	91%	0.906	74%	0.743	S	S	*	*			trans	-152.6	137.8	158.3	-151.8	168.1	167.8	149.7	-1.8	112.1
323	E	27.6	Very low	31.2	Very low	160 Å²	160	126.1 Å²	126.1	75%	0.748	74%	0.739	S	S	*	*			trans	-98.3	155.2	-170.3	-58.2	165.9	-158.5	0	0	112.2
324	S	32.1	Very low	31.1	Very low	107 Å²	107	128 Å²	128	75%	0.748	74%	0.744	S	S	*	*				164.4	136	127.3	-74.6	0	0	0	0	112.5
325	S	32.1	Very low	31.1	Very low	115 Å²	115	123 Å²	123	80%	0.804	72%	0.724	S	S	*	*			trans	58.7	146.1	156.5	48.1	0	0	0	0	119.7
326	S	31.5	Very low	31.1	Very low	99 Å²	99	126.5 Å²	126.5	69%	0.692	73%	0.732	S	S	*	*			cis	-169.4	151.6	-9.8	46	0	0	0	0	110.9
327	S	34.8	Very low	31.1	Very low	127 Å²	127	128 Å²	128	89%	0.888	73%	0.732	S	S	*	*			trans	62.7	149.7	168.3	69.5	0	0	0	0	117.3
328	G	28.8	Very low	31.2	Very low	60 Å²	60	124.9 Å²	124.9	62%	0.619	72%	0.72	S	S	*	*			cis	169.3	156.4	-5.2	0	0	0	0	0	111.3
329	N	35.2	Very low	31.1	Very low	155 Å²	155	124.8 Å²	124.8	83%	0.829	72%	0.722	S	S	*	*			trans	78.1	99.5	-174.8	-48.7	-21.4	0	0	0	113.8
330	S	31.8	Very low	31.3	Very low	105 Å²	105	128 Å²	128	73%	0.734	74%	0.739	S	S	*	*				70.3	139.5	62.6	84.2	0	0	0	0	113.2
331	C	27.3	Very low	31.1	Very low	118 Å²	118	128.3 Å²	128.3	80%	0.797	74%	0.741	S	S	*	*			cis	170.2	173.4	-10.4	-102.7	0	0	0	0	105.2
332	P	33	Very low	31.3	Very low	102 Å²	102	130 Å²	130	66%	0.662	75%	0.748	S	S	*	*			cis	-141.9	-167.9	-45.6	42.8	-25.4	0	0	0	113.3
333	L	28	Very low	31.1	Very low	133 Å²	133	124.2 Å²	124.2	70%	0.696	74%	0.743	S	S	*	*			trans	65.1	119.5	154.4	-67.4	172.2	0	0	0	121.4
334	K	32	Very low	31.1	Very low	211 Å²	211	122.9 Å²	122.9	92%	0.917	74%	0.739	S	S	*	*				-155.8	149.9	87.4	-107.3	-172.5	177.3	-170.2	0	112.4
335	S	30.2	Very low	30.9	Very low	74 Å²	74	121.9 Å²	121.9	52%	0.517	73%	0.732	S	S	.	*			trans	-160.1	133.3	-172.1	55.3	0	0	0	0	111.7
336	E	32.1	Very low	30.8	Very low	197 Å²	197	123.1 Å²	123.1	92%	0.921	73%	0.73	S	S	*	*			trans	-163.7	107.9	168.7	-102.1	158.5	-136.8	0	0	105
337	N	30	Very low	30.6	Very low	130 Å²	130	123.5 Å²	123.5	70%	0.695	73%	0.728	S	S	*	*			cis	84.5	94.2	10.6	-120.9	34.7	0	0	0	116.8
338	T	34.4	Very low	30.3	Very low	107 Å²	107	124.6 Å²	124.6	66%	0.656	72%	0.722	S	S	*	*			trans	50.9	132.8	133.3	60.8	0	0	0	0	122.4
339	S	30.2	Very low	30.3	Very low	107 Å²	107	128.7 Å²	128.7	75%	0.748	73%	0.729	S	S	*	*				-168.9	132.4	120.3	11.2	0	0	0	0	110.9
340	L	29.8	Very low	29.9	Very low	149 Å²	149	128.2 Å²	128.2	78%	0.78	73%	0.727	S	S	*	*				68.3	145.5	89	-57.8	174.5	0	0	0	113.1	N342	L340-N342 HydrophobicContact CD2-CB 4.33Å
341	V	30.2	Very low	29.8	Very low	129 Å²	129	134 Å²	134	78%	0.782	73%	0.733	S	S	*	*				-149.3	144.6	55.3	173.3	0	0	0	0	109.7
342	N	31.4	Very low	30.2	Very low	106 Å²	106	132.3 Å²	132.3	57%	0.567	72%	0.72	S	S	*	*			cis	93.1	76.7	13.5	-159.9	82.1	0	0	0	118.1	L340 I344	L340-N342 HydrophobicContact CD2-CB 4.33Å; N342-I344 WeakPolarHBondContact O-CD1 3.44Å
343	C	29.4	Very low	30	Very low	117 Å²	117	131.5 Å²	131.5	79%	0.791	72%	0.717	S	S	*	*			trans	-120.6	130.3	158	-60.7	0	0	0	0	107.5
344	I	29.1	Very low	30.1	Very low	133 Å²	133	133 Å²	133	68%	0.682	72%	0.718	S	S	*	*			cis	69.7	122.1	40.7	-44	160	0	0	0	108.4	N342	N342-I344 WeakPolarHBondContact O-CD1 3.44Å
345	S	28.1	Very low	29.8	Very low	85 Å²	85	124.6 Å²	124.6	59%	0.594	68%	0.684	S	S	*	*			cis	-152.9	175.1	28.8	-28.7	0	0	0	0	115.1
346	D	29.3	Very low	29.8	Very low	142 Å²	142	126.1 Å²	126.1	76%	0.759	68%	0.683	S	S	*	*			trans	64.9	141.8	138.3	-57.7	-20.1	0	0	0	122.2
347	T	28.1	Very low	29.5	Very low	106 Å²	106	121.9 Å²	121.9	65%	0.65	66%	0.663	S	S	*	*			cis	-162.5	155	-13.6	18	0	0	0	0	110.9
348	I	28.7	Very low	29.4	Very low	150 Å²	150	118.9 Å²	118.9	77%	0.769	65%	0.652	S	S	*	*			trans	62.9	147.6	145.7	-68.2	164.5	0	0	0	117.2
349	L	28	Very low	29.1	Very low	146 Å²	146	119.5 Å²	119.5	76%	0.764	66%	0.655	S	S	*	*			cis	-168	177.7	-32.3	-143.9	65.8	0	0	0	104.2
350	N	27.3	Very low	28.9	Very low	146 Å²	146	119.4 Å²	119.4	78%	0.781	66%	0.655	S	S	*	*			cis	-154.3	-154.1	9	-161.6	-15.5	0	0	0	109.2
351	R	28.7	Very low	28.8	Very low	227 Å²	227	118.8 Å²	118.8	86%	0.857	65%	0.652	S	S	*	*			trans	-131.9	-161.1	-176.7	-147.5	-162.4	165.3	-162.6	-1.2	111.2
352	P	35.3	Very low	29	Very low	82 Å²	82	119.4 Å²	119.4	53%	0.532	65%	0.65	S	S	.	*				-124.5	-168.7	-111.8	44.4	-29.1	0	0	0	117.8
353	S	28.8	Very low	28.9	Very low	85 Å²	85	122 Å²	122	59%	0.594	66%	0.659	S	S	*	*			trans	92.8	122.8	142.5	-74.7	0	0	0	0	122.7	R989	S353-R989 PolarHBondContact O-NH2 3.3Å
354	K	30.2	Very low	29.3	Very low	164 Å²	164	124.3 Å²	124.3	71%	0.713	66%	0.662	S	S	*	*				58.4	139.2	128.7	-96.1	-175.4	178	-173.7	0	118.5	R989	K354-R989 PolarHBondContact O-NH1 2.86Å
355	V	26.8	Very low	29.3	Very low	35 Å²	35	124 Å²	124	21%	0.212	66%	0.662	C	S	.	*			cis	-156.4	106.1	23.5	175	0	0	0	0	112.9	Y901	V355-Y901 HydrophobicContact CB-CD1 4.42Å; V355-Y901 HydrophobicContact CB-CD2 3.95Å; V355-Y901 HydrophobicContact CB-CE1 4.05Å; V355-Y901 HydrophobicContact CB-CE2 3.56Å; V355-Y901 HydrophobicContact CB-CG 4.36Å; V355-Y901 HydrophobicContact CG1-CD1 3.98Å; V355-Y901 HydrophobicContact CG1-CD2 4.24Å; V355-Y901 HydrophobicContact CG1-CE1 3.88Å; V355-Y901 HydrophobicContact CG1-CE2 4.18Å; V355-Y901 HydrophobicContact CG1-CG 4.14Å; V355-Y901 HydrophobicContact CG2-CE1 4.2Å; V355-Y901 HydrophobicContact CG2-CE2 4.08Å; V355-Y901 WeakPolarHBondContact CG2-OH 3.29Å; V355-Y901 WeakPolarHBondContact O-CD2 3.38Å
356	H	29.6	Very low	29.5	Very low	106 Å²	106	126.1 Å²	126.1	49%	0.491	67%	0.671	S	S	.	*			trans	79	0	131.6	-49.5	-173	0	0	0	122.8	V899 I900	H356-V899 VanDerWaalsContact CA-CG1 3.44Å; H356-V899 HydrophobicContact CB-CB 3.42Å; H356-V899 VanDerWaalsContact CB-CB 3.42Å; H356-V899 HydrophobicContact CB-CG1 3.78Å; H356-V899 HydrophobicContact CB-CG2 3.22Å; H356-V899 WeakPolarHBondContact CB-O 3.34Å; H356-V899 WeakPolarHBondContact CD2-CG2 3.44Å; H356-V899 VanDerWaalsContact ND1-CG2 3.3Å; H356-V899 WeakPolarHBondContact ND1-CG2 3.06Å; H356-V899 PolarHBondContact ND1-O 2.89Å; H356-I900 VanDerWaalsContact CB-CA 3.42Å; H356-I900 HydrophobicContact CB-CB 4.48Å; H356-I900 WeakPolarHBondContact O-CG1 3.47Å
357	E	26.2	Very low	29.5	Very low	108 Å²	108	124 Å²	124	51%	0.505	67%	0.667	S	S	.	*				0	-137.4	0	-97.9	171.8	92.5	0	0	101.8	N898 V899 I900	E357-N898 WeakPolarHBondContact CB-O 3.12Å; E357-N898 WeakPolarHBondContact CG-O 3.41Å; E357-V899 HydrophobicContact CB-CG1 4.45Å; E357-I900 VanDerWaalsContact CA-CB 3.49Å; E357-I900 HydrophobicContact CB-CB 3.44Å; E357-I900 VanDerWaalsContact CB-CB 3.44Å; E357-I900 HydrophobicContact CB-CG1 4.5Å; E357-I900 HydrophobicContact CB-CG2 3.81Å; E357-I900 HydrophobicContact CG-CB 4.41Å; E357-I900 PolarHBondContact OE2-N 2.89Å
358	S	27.9	Very low	29.5	Very low	67 Å²	67	125 Å²	125	47%	0.469	67%	0.673	S	S	.	*			cis	-152.3	139.6	-12.7	64.5	0	0	0	0	114.6	I900	S358-I900 WeakPolarHBondContact OG-CG2 3.17Å
359	V	27.1	Very low	29.5	Very low	119 Å²	119	122.4 Å²	122.4	72%	0.721	67%	0.669	S	S	*	*			trans	54.4	134.5	147	179.2	0	0	0	0	122
360	S	27.8	Very low	29.6	Very low	106 Å²	106	120.7 Å²	120.7	74%	0.741	66%	0.664	S	S	*	*			trans	93.5	142.6	166.7	80.4	0	0	0	0	116
361	L	27.6	Very low	29.6	Very low	136 Å²	136	121.5 Å²	121.5	71%	0.712	67%	0.668	S	S	*	*			cis	-159	-169.2	-9.5	-124.7	175.2	0	0	0	110.9
362	N	34.2	Very low	29.7	Very low	141 Å²	141	114 Å²	114	75%	0.754	66%	0.662	S	S	*	*			trans	72.3	96.5	173.3	-53	-4.9	0	0	0	114.3
363	E	29	Very low	29.5	Very low	162 Å²	162	118.6 Å²	118.6	76%	0.757	68%	0.677	S	S	*	*				52.9	117.5	57.6	-60.7	-164.9	130.9	0	0	115.4
364	I	37.3	Very low	29.4	Very low	164 Å²	164	123.5 Å²	123.5	84%	0.841	69%	0.687	S	S	*	*				-156.4	147	115.2	-98.1	156.7	0	0	0	109.4
365	N	29.1	Very low	29.6	Very low	128 Å²	128	121.4 Å²	121.4	68%	0.684	69%	0.689	S	S	*	*			trans	-61	171.5	-176.9	-55.6	-63.8	0	0	0	113.3
366	T	32.2	Very low	30	Very low	129 Å²	129	125.4 Å²	125.4	79%	0.791	71%	0.714	S	S	*	*			cis	-162.7	163.9	31.6	-33.5	0	0	0	0	112.4
367	S	28.9	Very low	30.4	Very low	96 Å²	96	126 Å²	126	67%	0.671	73%	0.726	S	S	*	*			trans	-52.8	171.8	159	-40.6	0	0	0	0	112.7
368	T	28.9	Very low	30.8	Very low	127 Å²	127	124.7 Å²	124.7	78%	0.779	73%	0.734	S	S	*	*			cis	-169.6	148.3	33.4	-18.7	0	0	0	0	112.7
369	S	28.3	Very low	31.2	Very low	97 Å²	97	127.8 Å²	127.8	68%	0.678	75%	0.75	S	S	*	*			trans	71.1	145.2	132.8	-141.1	0	0	0	0	124.6
370	V	30	Very low	31.7	Very low	110 Å²	110	127.8 Å²	127.8	67%	0.667	75%	0.751	S	S	*	*			trans	58.8	125.7	152.7	-73.8	0	0	0	0	123.7
371	D	28.6	Very low	32	Very low	162 Å²	162	128.7 Å²	128.7	87%	0.866	75%	0.752	S	S	*	*			trans	63.4	159.3	135.4	-54.8	-25.4	0	0	0	121.7
372	G	30.5	Very low	32.4	Very low	71 Å²	71	125.9 Å²	125.9	73%	0.732	75%	0.749	S	S	*	*			trans	119.9	57.3	162.8	0	0	0	0	0	118.7
373	Q	29.9	Very low	32.5	Very low	177 Å²	177	126 Å²	126	83%	0.827	75%	0.749	S	S	*	*				29.4	121.8	127.4	-167.2	178.1	53.8	0	0	120.1
374	F	27.7	Very low	32.6	Very low	188 Å²	188	125 Å²	125	83%	0.825	75%	0.754	S	S	*	*			trans	60.5	130.9	157.9	-86.7	-116.7	0	0	0	117.3
375	T	34.5	Very low	32.5	Very low	120 Å²	120	121.9 Å²	121.9	74%	0.736	74%	0.742	S	S	*	*				-165.7	159.3	50.5	-45.7	0	0	0	0	111.7
376	T	35.3	Very low	32.7	Very low	120 Å²	120	121.6 Å²	121.6	74%	0.736	75%	0.745	S	S	*	*			trans	-64.3	174.4	166.3	48.7	0	0	0	0	115
377	P	37.3	Very low	32.8	Very low	117 Å²	117	125.7 Å²	125.7	76%	0.76	75%	0.748	S	S	*	*			cis	-137.8	-175	-20.5	28.3	-5.2	0	0	0	114.7
378	A	34.7	Very low	33	Very low	81 Å²	81	125.4 Å²	125.4	67%	0.669	75%	0.751	S	S	*	*				131.1	125.4	117.3	0	0	0	0	0	118.2
379	T	37.2	Very low	33.1	Very low	132 Å²	132	127.3 Å²	127.3	81%	0.81	76%	0.755	S	S	*	*			trans	60	123.7	154.6	6.4	0	0	0	0	117.7
380	T	36	Very low	33.4	Very low	119 Å²	119	127.6 Å²	127.6	73%	0.73	76%	0.757	S	S	*	*				-170.1	152.4	55.4	-64	0	0	0	0	112.2
381	T	35.7	Very low	33.7	Very low	126 Å²	126	130.5 Å²	130.5	77%	0.773	76%	0.763	S	S	*	*			trans	-32.9	157.1	170.2	52.4	0	0	0	0	119.3
382	A	35.1	Very low	33.8	Very low	77 Å²	77	128 Å²	128	64%	0.636	76%	0.758	S	S	*	*			cis	-171.1	152.2	-10.2	0	0	0	0	0	113.9
383	N	35.8	Very low	34	Very low	142 Å²	142	136 Å²	136	76%	0.759	77%	0.766	S	S	*	*			trans	52.2	96.1	142	-56.5	-1.1	0	0	0	121.1
384	V	32.1	Very low	34	Very low	143 Å²	143	134.2 Å²	134.2	87%	0.867	77%	0.768	S	S	*	*			trans	-121.2	128.7	132.4	176.5	0	0	0	0	106.7
385	V	34.5	Very low	34.3	Very low	97 Å²	97	132.6 Å²	132.6	59%	0.588	77%	0.766	S	S	*	*			trans	-113.8	107	-176.5	179.2	0	0	0	0	110.3	Y387	V385-Y387 HydrophobicContact CG1-CD2 4.1Å; V385-Y387 HydrophobicContact CG1-CE2 3.74Å
386	T	34.3	Very low	34.3	Very low	122 Å²	122	134.5 Å²	134.5	75%	0.748	77%	0.767	S	S	*	*			trans	-89.7	124.5	165.2	-59	0	0	0	0	108.7	A388	T386-A388 PolarHBondContact O-N 3.39Å
387	Y	32.8	Very low	34.3	Very low	216 Å²	216	134.1 Å²	134.1	85%	0.847	77%	0.766	S	S	*	*			trans	-86.3	107.7	169.5	-77.7	-80.6	0	0	0	110.1	V385	V385-Y387 HydrophobicContact CG1-CD2 4.1Å; V385-Y387 HydrophobicContact CG1-CE2 3.74Å
388	A	33.5	Very low	34.3	Very low	90 Å²	90	134.4 Å²	134.4	74%	0.744	77%	0.765	S	S	*	*			trans	-109.4	155.9	166.4	0	0	0	0	0	110	T386	T386-A388 PolarHBondContact O-N 3.39Å
389	I	32	Very low	34.1	Very low	167 Å²	167	139.8 Å²	139.8	86%	0.856	77%	0.774	S	S	*	*			trans	-88.4	136.5	-170.7	-59.8	154.4	0	0	0	109.9
390	S	33.8	Very low	34	Very low	103 Å²	103	138.5 Å²	138.5	72%	0.72	77%	0.77	S	S	*	*			trans	-176.6	130.8	137.5	-97.4	0	0	0	0	115
391	E	35.5	Very low	33.9	Very low	171 Å²	171	141.8 Å²	141.8	80%	0.799	78%	0.777	S	S	*	*			trans	61.3	116.5	140.3	-57.9	-162.3	146.4	0	0	123.8
392	S	31.6	Very low	34	Very low	108 Å²	108	142.3 Å²	142.3	76%	0.755	78%	0.78	S	S	*	*				61.4	89.9	120.3	-52.5	0	0	0	0	120.1
393	R	34.8	Very low	34	Very low	241 Å²	241	145.8 Å²	145.8	91%	0.909	79%	0.788	S	S	*	*			trans	-133.2	130.2	147.1	-78.1	-163.9	172.9	-137.6	-3.6	113.1
394	T	30.8	Very low	34.1	Very low	139 Å²	139	150.8 Å²	150.8	85%	0.853	80%	0.796	S	S	*	*			trans	-61.8	129.4	169.9	-48.2	0	0	0	0	110.8
395	I	33.2	Very low	34.3	Very low	154 Å²	154	150.8 Å²	150.8	79%	0.79	79%	0.79	S	S	*	*			trans	-126.2	123.5	169.9	-62.6	-179.5	0	0	0	108.2
396	Q	34.8	Very low	34.3	Very low	160 Å²	160	151.2 Å²	151.2	75%	0.748	80%	0.795	S	S	*	*			trans	-79.9	151.4	173.2	-67.6	-170.7	1.6	0	0	110.9	V398	Q396-V398 PolarHBondContact O-N 3.31Å
397	P	35.6	Very low	34.3	Very low	112 Å²	112	152.5 Å²	152.5	73%	0.727	80%	0.795	S	S	*	*			trans	-70.1	100.5	174.7	29.2	-34.2	0	0	0	110.9	F399	P397-F399 PolarHBondContact O-N 3.13Å
398	V	35.6	Very low	34.3	Very low	123 Å²	123	147.8 Å²	147.8	75%	0.745	79%	0.789	S	S	*	*			trans	-72.6	113	170.3	177.5	0	0	0	0	109.2	Q396 S400	Q396-V398 PolarHBondContact O-N 3.31Å; V398-S400 PolarHBondContact O-N 2.74Å
399	F	31.9	Very low	34.3	Very low	194 Å²	194	149.5 Å²	149.5	85%	0.851	79%	0.79	S	S	*	*			trans	-72.2	88.1	172.4	-83	-94	0	0	0	111	P397	P397-F399 PolarHBondContact O-N 3.13Å
400	S	34.5	Very low	34.3	Very low	104 Å²	104	146.8 Å²	146.8	73%	0.727	78%	0.782	S	S	*	*			trans	-78.7	118.1	169.2	-67.7	0	0	0	0	110.7	V398	V398-S400 PolarHBondContact O-N 2.74Å
401	Q	33.4	Very low	34	Very low	189 Å²	189	149.9 Å²	149.9	88%	0.883	79%	0.789	S	S	*	*			trans	-68.4	132.4	-177.2	-64.2	166.9	-42.5	0	0	111.9
402	V	37.9	Very low	34	Very low	137 Å²	137	147.6 Å²	147.6	83%	0.83	79%	0.786	S	S	*	*			trans	-126.3	120.1	161.7	-180	0	0	0	0	108	R404	V402-R404 PolarHBondContact O-N 3.27Å
403	N	35.8	Very low	34	Very low	149 Å²	149	148.2 Å²	148.2	80%	0.797	79%	0.791	S	S	*	*			trans	-61.4	116.3	-174.8	-77.3	-24.1	0	0	0	112	I405	N403-I405 PolarHBondContact O-N 2.89Å
404	R	36.8	Very low	33.8	Very low	248 Å²	248	140 Å²	140	94%	0.936	78%	0.781	S	S	*	*			trans	-76.1	103.6	158.5	-77.1	-168.8	176.5	-163.3	0.4	108.9	V402	V402-R404 PolarHBondContact O-N 3.27Å
405	I	37.4	Very low	34	Very low	142 Å²	142	143.7 Å²	143.7	73%	0.728	79%	0.785	S	S	*	*			trans	-67.1	125.7	166	-60.2	172.9	0	0	0	107.9	N403 I407	N403-I405 PolarHBondContact O-N 2.89Å; I405-I407 PolarHBondContact O-N 3.09Å
406	P	33.3	Very low	33.8	Very low	107 Å²	107	142.1 Å²	142.1	70%	0.695	78%	0.783	S	S	*	*			trans	-75.6	110.5	176	29.7	-32.3	0	0	0	110.1	T408	P406-T408 VanDerWaalsContact C-N 3.34Å; P406-T408 PolarHBondContact O-N 3.11Å
407	I	36	Very low	33.8	Very low	148 Å²	148	142.9 Å²	142.9	76%	0.759	79%	0.791	S	S	*	*			trans	-79.3	88.1	170.3	-59.9	-178.7	0	0	0	108.4	I405 T409	I405-I407 PolarHBondContact O-N 3.09Å; I407-T409 HydrophobicContact CG2-CG2 4.14Å; I407-T409 PolarHBondContact O-N 2.98Å
408	T	31.5	Very low	33.5	Very low	117 Å²	117	144 Å²	144	72%	0.718	79%	0.791	S	S	*	*			trans	-82.8	93.4	170.6	-51.6	0	0	0	0	109.2	P406 T410	P406-T408 VanDerWaalsContact C-N 3.34Å; P406-T408 PolarHBondContact O-N 3.11Å; T408-T410 PolarHBondContact O-N 3.34Å
409	T	33.9	Very low	33.4	Very low	126 Å²	126	143.3 Å²	143.3	77%	0.773	79%	0.791	S	S	*	*			trans	-81.3	102	173.1	29.7	0	0	0	0	111	I407	I407-T409 HydrophobicContact CG2-CG2 4.14Å; I407-T409 PolarHBondContact O-N 2.98Å
410	T	31.3	Very low	33.4	Very low	110 Å²	110	138.1 Å²	138.1	68%	0.675	78%	0.779	S	S	*	*			trans	-61.5	132.7	-174.1	-39.7	0	0	0	0	113.4	T408 T412	T408-T410 PolarHBondContact O-N 3.34Å; T410-T412 PolarHBondContact O-N 3.37Å; T410-T412 VanDerWaalsContact O-N 3.12Å; T410-T412 PolarHBondContact O-OG1 3.18Å
411	I	29.5	Very low	33.3	Very low	169 Å²	169	139.2 Å²	139.2	87%	0.867	78%	0.777	S	S	*	*			trans	-58.5	115.2	166	-57.2	170.7	0	0	0	108.2
412	T	33.7	Very low	33.3	Very low	122 Å²	122	140.1 Å²	140.1	75%	0.748	77%	0.774	S	S	*	*			trans	-129.2	131.6	179.8	-51.9	0	0	0	0	110.1	T410	T410-T412 PolarHBondContact O-N 3.37Å; T410-T412 VanDerWaalsContact O-N 3.12Å; T410-T412 PolarHBondContact O-OG1 3.18Å
413	S	32	Very low	33.1	Very low	122 Å²	122	138.5 Å²	138.5	85%	0.853	77%	0.766	S	S	*	*			trans	-73.8	147.1	-164.7	-53.9	0	0	0	0	115.2
414	G	31.7	Very low	32.7	Very low	68 Å²	68	137.8 Å²	137.8	70%	0.701	77%	0.767	S	S	*	*			trans	106	104	134	0	0	0	0	0	118.3
415	K	35.2	Very low	32.4	Very low	216 Å²	216	131.8 Å²	131.8	94%	0.939	76%	0.758	S	S	*	*				-156.8	143.2	117.4	-107.9	162.6	-174.3	176.5	0	110.5
416	V	28.2	Very low	32.2	Very low	121 Å²	121	133.6 Å²	133.6	73%	0.733	76%	0.763	S	S	*	*			trans	-126.3	120.8	-169.9	173.8	0	0	0	0	110.1	N418	V416-N418 HydrophobicContact CG1-CB 4.25Å
417	L	35.7	Very low	32	Very low	177 Å²	177	131.6 Å²	131.6	93%	0.927	76%	0.761	S	S	*	*			trans	-148.2	104.9	160.8	-68.4	177.3	0	0	0	105
418	N	28.8	Very low	31.9	Very low	135 Å²	135	132 Å²	132	72%	0.722	77%	0.77	S	S	*	*			cis	86.5	76	31.5	-164.1	39.5	0	0	0	115.8	V416	V416-N418 HydrophobicContact CG1-CB 4.25Å
419	S	32.9	Very low	31.7	Very low	108 Å²	108	133.5 Å²	133.5	76%	0.755	77%	0.774	S	S	*	*			trans	-172.4	86.1	152.9	54	0	0	0	0	108.1
420	S	32.5	Very low	31.7	Very low	85 Å²	85	134.7 Å²	134.7	59%	0.594	78%	0.775	S	S	*	*				80.1	134.4	61.8	82.8	0	0	0	0	114.8
421	N	32.8	Very low	31.7	Very low	127 Å²	127	134 Å²	134	68%	0.679	77%	0.774	S	S	*	*			trans	74.8	140.6	151.4	-60	-4.2	0	0	0	119.4
422	Y	31.7	Very low	31.9	Very low	209 Å²	209	131.1 Å²	131.1	82%	0.82	77%	0.769	S	S	*	*			cis	-145.6	169	-20	-107.3	-75.7	0	0	0	106.8
423	P	34	Very low	32.1	Very low	103 Å²	103	133.1 Å²	133.1	67%	0.669	78%	0.775	S	S	*	*			trans	-104.4	170.7	-159.2	41.3	-37.9	0	0	0	116.8
424	T	27.6	Very low	32.6	Very low	134 Å²	134	132.4 Å²	132.4	82%	0.822	77%	0.767	S	S	*	*			trans	10.9	122.3	144.3	-47	0	0	0	0	119.8
425	V	31.7	Very low	32.8	Very low	121 Å²	121	134.3 Å²	134.3	73%	0.733	77%	0.769	S	S	*	*			trans	-166.7	148.2	137.5	130.2	0	0	0	0	109.7
426	H	32	Very low	32.9	Very low	181 Å²	181	129.1 Å²	129.1	84%	0.838	76%	0.76	S	S	*	*			trans	4.5	140.7	161.2	-51.3	68.9	0	0	0	118.8
427	G	29.7	Very low	33.2	Very low	64 Å²	64	128.4 Å²	128.4	66%	0.66	76%	0.761	S	S	*	*			cis	154.5	-159.6	17.9	0	0	0	0	0	109.4
428	V	33.7	Very low	33.2	Very low	157 Å²	157	125.5 Å²	125.5	95%	0.952	76%	0.756	S	S	*	*			trans	57	123.3	172.7	-66.1	0	0	0	0	121
429	N	27.4	Very low	33.7	Very low	148 Å²	148	122.7 Å²	122.7	79%	0.791	75%	0.751	S	S	*	*			trans	-55.5	-176.3	169.7	-166.3	5.6	0	0	0	116.2
430	L	33.4	Very low	33.9	Very low	152 Å²	152	125.6 Å²	125.6	80%	0.796	75%	0.752	S	S	*	*			trans	86	148.7	176.3	-53.8	158.8	0	0	0	115
431	S	31.6	Very low	33.9	Very low	94 Å²	94	127.5 Å²	127.5	66%	0.657	76%	0.76	S	S	*	*			cis	-172.7	174	-26.9	53.1	0	0	0	0	108.9
432	S	34	Very low	33.9	Very low	109 Å²	109	126.1 Å²	126.1	76%	0.762	76%	0.761	S	S	*	*			trans	62.7	126.9	175.5	34.7	0	0	0	0	116.5
433	L	37.8	Very low	34	Very low	165 Å²	165	126.1 Å²	126.1	86%	0.864	77%	0.768	S	S	*	*			cis	75.7	145.4	24.3	-145.1	86.4	0	0	0	113.7
434	P	42.8	Very low	33.9	Very low	106 Å²	106	128.7 Å²	128.7	69%	0.688	77%	0.771	S	S	*	*				-131.4	-171.7	-60.1	42.6	-29.5	0	0	0	112.1
435	S	35	Very low	34.1	Very low	108 Å²	108	130.7 Å²	130.7	76%	0.755	78%	0.776	S	S	*	*			trans	-174.2	118.4	142.4	-84.6	0	0	0	0	109.7
436	S	36.7	Very low	34.1	Very low	107 Å²	107	128.9 Å²	128.9	75%	0.748	77%	0.765	S	S	*	*				91.7	137.4	96.3	71.9	0	0	0	0	113.8
437	S	35.1	Very low	34.2	Very low	106 Å²	106	127.2 Å²	127.2	74%	0.741	77%	0.767	S	S	*	*			cis	-177.2	160.8	-10.2	51.1	0	0	0	0	110.9
438	S	36.7	Very low	34.3	Very low	117 Å²	117	131.1 Å²	131.1	82%	0.818	77%	0.768	S	S	*	*			trans	71.2	144.2	142.6	-164.6	0	0	0	0	119.4
439	A	37.8	Very low	34.3	Very low	75 Å²	75	132.3 Å²	132.3	62%	0.62	77%	0.766	S	S	*	*			cis	-167.3	178.7	-23.3	0	0	0	0	0	111
440	H	37.5	Very low	34.6	Very low	169 Å²	169	131.9 Å²	131.9	78%	0.782	76%	0.758	S	S	*	*			trans	-7.8	164.6	155	-51	-58.4	0	0	0	120.8
441	T	34	Very low	34.6	Very low	125 Å²	125	134.4 Å²	134.4	77%	0.767	76%	0.757	S	S	*	*			cis	-136.9	136.4	20.2	48.6	0	0	0	0	111.1
442	S	31.8	Very low	34.7	Very low	99 Å²	99	135 Å²	135	69%	0.692	75%	0.753	S	S	*	*				51.9	104.2	79.1	-56.6	0	0	0	0	115.8
443	Q	33.9	Very low	34.8	Very low	209 Å²	209	135.5 Å²	135.5	98%	0.977	75%	0.754	S	S	*	*			trans	-156.7	163.6	131.5	-114.1	173.5	69.8	0	0	111.1
444	H	31.6	Very low	34.5	Very low	157 Å²	157	133.6 Å²	133.6	73%	0.727	74%	0.744	S	S	*	*			trans	-147.2	135.1	-149.9	164.5	-77	0	0	0	111.4	V446	H444-V446 WeakPolarHBondContact NE2-CG2 2.94Å
445	L	32.1	Very low	34.1	Very low	175 Å²	175	135.5 Å²	135.5	92%	0.916	75%	0.749	S	S	*	*			trans	-148.8	139.7	161.1	-109.1	170.5	0	0	0	110.4
446	V	31.9	Very low	34	Very low	84 Å²	84	137.8 Å²	137.8	51%	0.509	75%	0.752	S	S	.	*			trans	-122.4	139.7	-172.7	165	0	0	0	0	109.3	H444 Q448	H444-V446 WeakPolarHBondContact NE2-CG2 2.94Å; V446-Q448 HydrophobicContact CG1-CB 4.25Å
447	V	34.5	Very low	33.7	Very low	146 Å²	146	140.6 Å²	140.6	89%	0.885	76%	0.757	S	S	*	*			trans	-126.5	118.4	156.1	-179.8	0	0	0	0	108.1
448	Q	32.1	Very low	33.5	Very low	146 Å²	146	142.4 Å²	142.4	68%	0.682	76%	0.759	S	S	*	*			trans	-99.7	120.2	-171.5	172.8	177.6	-46.2	0	0	110	V446 H450	V446-Q448 HydrophobicContact CG1-CB 4.25Å; Q448-H450 HydrophobicContact CG-CB 4.48Å
449	M	31.8	Very low	33.4	Very low	182 Å²	182	141.3 Å²	141.3	90%	0.897	75%	0.751	S	S	*	*			trans	-99.3	92.6	165	-74.8	-130.6	-59.8	0	0	109.8
450	H	33.9	Very low	33	Very low	139 Å²	139	141.6 Å²	141.6	64%	0.644	75%	0.749	S	S	*	*			trans	-79.5	131.9	173.4	-153.2	-107.5	0	0	0	109.9	Q448	Q448-H450 HydrophobicContact CG-CB 4.48Å
451	R	34	Very low	32.9	Very low	204 Å²	204	141.4 Å²	141.4	77%	0.77	75%	0.748	S	S	*	*			trans	-136.1	113.1	163.5	-78.2	-165.5	168.2	-155.7	-9.6	108.9	I121	I121-R451 VanDerWaalsContact CD1-NH2 3.31Å
452	N	33.2	Very low	32.8	Very low	108 Å²	108	143.5 Å²	143.5	58%	0.578	75%	0.749	S	S	*	*			trans	-88.8	137.3	-175.9	-162.7	40	0	0	0	110.3	D454	N452-D454 PolarHBondContact ND2-OD2 2.76Å
453	P	35.8	Very low	32.9	Very low	118 Å²	118	144 Å²	144	77%	0.766	75%	0.748	S	S	*	*			trans	-108.9	68.3	-178.9	39.9	-31.2	0	0	0	112.6
454	D	33.3	Very low	32.8	Very low	125 Å²	125	140.6 Å²	140.6	67%	0.668	74%	0.736	S	S	*	*			trans	-109.5	114.7	168.5	-64.8	-49.8	0	0	0	108.7	N452	N452-D454 PolarHBondContact ND2-OD2 2.76Å
455	D	33.5	Very low	32.7	Very low	147 Å²	147	139 Å²	139	79%	0.786	74%	0.737	S	S	*	*				-179.2	157.3	98.5	-129.5	-36.5	0	0	0	114.3
456	L	33	Very low	32.8	Very low	155 Å²	155	137.4 Å²	137.4	81%	0.812	74%	0.735	S	S	*	*			trans	57.4	112.9	162.9	-84.6	139.1	0	0	0	122
457	L	30.2	Very low	33	Very low	166 Å²	166	138.2 Å²	138.2	87%	0.869	74%	0.74	S	S	*	*			trans	-91.6	149.7	158	-58.2	103.2	0	0	0	111.9
458	D	32	Very low	33	Very low	144 Å²	144	138 Å²	138	77%	0.77	73%	0.73	S	S	*	*			trans	-166.1	150.9	141.9	-144.3	16	0	0	0	108.5
459	S	33.1	Very low	33	Very low	95 Å²	95	140.8 Å²	140.8	66%	0.664	73%	0.734	S	S	*	*			cis	-146.7	177.1	-2	-150.6	0	0	0	0	112.9
460	S	29.9	Very low	32.9	Very low	80 Å²	80	137.8 Å²	137.8	56%	0.559	73%	0.729	S	S	*	*			trans	-85.5	153	-169.1	68	0	0	0	0	117.4
461	Q	35.1	Very low	32.8	Very low	166 Å²	166	136.5 Å²	136.5	78%	0.776	74%	0.736	S	S	*	*				178.5	126.4	122.4	-94.1	157	89.6	0	0	110.2
462	Q	32.7	Very low	32.4	Very low	169 Å²	169	135 Å²	135	79%	0.79	74%	0.742	S	S	*	*				71.3	138.1	78	-68.3	-170.8	39.9	0	0	113.1
463	V	32.4	Very low	32.4	Very low	108 Å²	108	137.9 Å²	137.9	66%	0.655	76%	0.756	S	S	*	*			cis	-160.5	166	14.4	82.6	0	0	0	0	113.8
464	L	32.5	Very low	32	Very low	139 Å²	139	138.3 Å²	138.3	73%	0.728	75%	0.752	S	S	*	*			trans	46.6	126.9	165.2	-75.5	126	0	0	0	119.7
465	T	30.5	Very low	32.1	Very low	123 Å²	123	137.7 Å²	137.7	76%	0.755	75%	0.754	S	S	*	*			cis	90.6	110.6	21.2	76.3	0	0	0	0	118.5
466	T	33.7	Very low	32.1	Very low	142 Å²	142	135.9 Å²	135.9	87%	0.871	75%	0.749	S	S	*	*			trans	-145.8	170.9	161.3	-168.6	0	0	0	0	111.2
467	T	35	Very low	32	Very low	100 Å²	100	135.8 Å²	135.8	61%	0.613	75%	0.749	S	S	*	*			trans	-154	131.6	-142.1	-60.4	0	0	0	0	117.2
468	Q	34.4	Very low	32	Very low	143 Å²	143	132.7 Å²	132.7	67%	0.668	74%	0.741	S	S	*	*			trans	74.6	159.1	156.4	-75.6	166.7	37.2	0	0	119.2
469	R	33.5	Very low	31.9	Very low	204 Å²	204	132.2 Å²	132.2	77%	0.77	74%	0.744	S	S	*	*			cis	-162.2	138.3	13.9	-135.6	158.7	-175.1	157.2	1.4	114.8
470	C	29.3	Very low	31.5	Very low	118 Å²	118	138.1 Å²	138.1	80%	0.797	75%	0.753	S	S	*	*			trans	51	164.8	149.3	-58.3	0	0	0	0	120.9
471	S	31	Very low	31.5	Very low	113 Å²	113	140.7 Å²	140.7	79%	0.79	77%	0.765	S	S	*	*			cis	-144.6	165.3	8.6	-55.6	0	0	0	0	111.7
472	L	26.9	Very low	31.1	Very low	172 Å²	172	138.4 Å²	138.4	90%	0.901	77%	0.766	S	S	*	*			trans	-89.6	146.4	171.6	-97.1	69.2	0	0	0	113.2
473	I	32.3	Very low	31.2	Very low	168 Å²	168	138.2 Å²	138.2	86%	0.862	77%	0.765	S	S	*	*			trans	-135.8	144.4	156.8	-64.3	-176.8	0	0	0	108.5
474	N	27.9	Very low	31.2	Very low	127 Å²	127	142 Å²	142	68%	0.679	78%	0.775	S	S	*	*			trans	-97.5	146.3	-180	-178	26.3	0	0	0	110.4
475	P	36.2	Very low	31.3	Very low	112 Å²	112	143.7 Å²	143.7	73%	0.727	78%	0.784	S	S	*	*				-143.5	149.2	120.3	37.1	-23.9	0	0	0	115.6
476	T	32	Very low	31.4	Very low	110 Å²	110	143.6 Å²	143.6	68%	0.675	78%	0.783	S	S	*	*			trans	-93.2	149.5	155.8	49	0	0	0	0	110.1
477	N	31.9	Very low	31.4	Very low	153 Å²	153	142.9 Å²	142.9	82%	0.818	78%	0.781	S	S	*	*			trans	103.1	137.8	-168.6	-62.3	-21.8	0	0	0	111.4
478	S	29.5	Very low	31.2	Very low	100 Å²	100	144.2 Å²	144.2	70%	0.699	79%	0.789	S	S	*	*			cis	-170.1	172.3	-9.2	45.8	0	0	0	0	110.8
479	V	31	Very low	31.1	Very low	135 Å²	135	143.1 Å²	143.1	82%	0.818	79%	0.792	S	S	*	*			trans	80.2	137	167.9	-171.3	0	0	0	0	116.4
480	Y	24.2	Very low	30.9	Very low	218 Å²	218	139.5 Å²	139.5	86%	0.855	79%	0.793	S	S	*	*			trans	-94.3	141.3	172.4	-83.1	-109.6	0	0	0	111
481	V	30.3	Very low	31	Very low	135 Å²	135	144.8 Å²	144.8	82%	0.818	80%	0.796	S	S	*	*			trans	-133.4	137.5	143.2	-178.2	0	0	0	0	106.8
482	C	26.7	Very low	31.1	Very low	117 Å²	117	147.4 Å²	147.4	79%	0.791	80%	0.8	S	S	*	*			trans	-138	92.9	-173.5	-178.3	0	0	0	0	110.8
483	E	33.1	Very low	31.1	Very low	165 Å²	165	144.5 Å²	144.5	77%	0.771	79%	0.793	S	S	*	*			trans	-124.4	115.2	173	-66.5	-164.3	157.1	0	0	110.8
484	H	34.4	Very low	31	Very low	188 Å²	188	141.9 Å²	141.9	87%	0.87	79%	0.79	S	S	*	*			trans	173.9	93.7	131	-90.5	-57.2	0	0	0	108.6
485	L	33.4	Very low	31.2	Very low	174 Å²	174	141 Å²	141	91%	0.911	79%	0.794	S	S	*	*			trans	-81.9	122.4	172.5	-85.9	153.1	0	0	0	110
486	T	33.1	Very low	31	Very low	121 Å²	121	140.5 Å²	140.5	74%	0.742	79%	0.793	S	S	*	*			trans	-74.9	123.2	166.9	37	0	0	0	0	110	T488	T486-T488 PolarHBondContact O-N 3.47Å
487	P	34.3	Very low	31.1	Very low	127 Å²	127	140.8 Å²	140.8	83%	0.825	80%	0.799	S	S	*	*			trans	-79.8	89	-174.8	31.5	-34.9	0	0	0	111.6
488	T	30.3	Very low	31.3	Very low	128 Å²	128	138.9 Å²	138.9	79%	0.785	80%	0.795	S	S	*	*			trans	-78.9	130	166.1	-58.8	0	0	0	0	109.9	T486	T486-T488 PolarHBondContact O-N 3.47Å
489	V	31.2	Very low	31.4	Very low	121 Å²	121	138.3 Å²	138.3	73%	0.733	79%	0.791	S	S	*	*			trans	-63.5	133.6	-170.2	178.4	0	0	0	0	112.6	R491	V489-R491 HydrophobicContact CG1-CG 4.36Å
490	T	31	Very low	31.6	Very low	128 Å²	128	140.8 Å²	140.8	79%	0.785	79%	0.794	S	S	*	*			trans	-141	103.7	157.3	-63.4	0	0	0	0	108.9
491	R	31	Very low	32	Very low	228 Å²	228	135.7 Å²	135.7	86%	0.86	79%	0.785	S	S	*	*			trans	-94.2	117.6	171.3	-75.3	-170	178.3	-159.4	1.4	109.9	V489	V489-R491 HydrophobicContact CG1-CG 4.36Å
492	L	31.8	Very low	32.2	Very low	168 Å²	168	136.7 Å²	136.7	88%	0.88	79%	0.786	S	S	*	*			trans	-123.1	133.6	153.9	-81.2	170.9	0	0	0	108
493	C	28.2	Very low	32.3	Very low	111 Å²	111	137.6 Å²	137.6	75%	0.75	78%	0.783	S	S	*	*			trans	-89.6	147.9	-174.2	-57	0	0	0	0	111.3
494	S	28.6	Very low	32.2	Very low	114 Å²	114	139.1 Å²	139.1	80%	0.797	79%	0.788	S	S	*	*				153.4	123.1	115.1	-68.1	0	0	0	0	113.1
495	S	32.6	Very low	32	Very low	108 Å²	108	136.5 Å²	136.5	76%	0.755	78%	0.778	S	S	*	*				161.8	136.5	117.3	61.8	0	0	0	0	113.1
496	S	32.9	Very low	32.1	Very low	102 Å²	102	134.3 Å²	134.3	71%	0.713	77%	0.772	S	S	*	*			trans	48.6	114.5	158	50.5	0	0	0	0	119.5
497	S	33	Very low	32	Very low	116 Å²	116	135.9 Å²	135.9	81%	0.811	78%	0.776	S	S	*	*				75.8	150.4	56.6	-59.5	0	0	0	0	114.2
498	P	35.9	Very low	31.8	Very low	112 Å²	112	134.4 Å²	134.4	73%	0.727	77%	0.769	S	S	*	*			cis	-135.1	175.8	6.6	40	-21.6	0	0	0	117.3
499	S	32.1	Very low	31.9	Very low	88 Å²	88	134.9 Å²	134.9	62%	0.615	77%	0.767	S	S	*	*			trans	48.3	119.8	145	61	0	0	0	0	122.4
500	H	35.2	Very low	32.1	Very low	188 Å²	188	139.3 Å²	139.3	87%	0.87	78%	0.776	S	S	*	*				-154.3	166	93.6	-103.8	-74.3	0	0	0	111.1
501	T	32.1	Very low	32.2	Very low	111 Å²	111	140.6 Å²	140.6	68%	0.681	78%	0.778	S	S	*	*			trans	-114.7	142.9	-161.5	50	0	0	0	0	114
502	N	34.4	Very low	32.1	Very low	156 Å²	156	139.8 Å²	139.8	83%	0.834	78%	0.776	S	S	*	*				-165.6	157.3	122.5	-95.9	-27.3	0	0	0	111.7
503	N	29.1	Very low	32.1	Very low	136 Å²	136	139.6 Å²	139.6	73%	0.727	77%	0.771	S	S	*	*			trans	-101.3	156.2	-167.6	-54.8	-65.6	0	0	0	112.6
504	F	31.4	Very low	32.1	Very low	197 Å²	197	139.2 Å²	139.2	86%	0.864	77%	0.767	S	S	*	*				-165.1	96.9	123.8	-102.2	-65.2	0	0	0	112.9
505	I	31.5	Very low	32.3	Very low	132 Å²	132	140.6 Å²	140.6	68%	0.677	76%	0.764	S	S	*	*			trans	17.5	116.2	136.3	-36.6	176.3	0	0	0	115.4
506	T	34	Very low	32.2	Very low	128 Å²	128	140.7 Å²	140.7	79%	0.785	76%	0.764	S	S	*	*				-159.7	134.4	79.8	30.7	0	0	0	0	116.2
507	N	32.4	Very low	32	Very low	155 Å²	155	144.7 Å²	144.7	83%	0.829	76%	0.764	S	S	*	*			trans	21.3	103	152.1	-62.7	-10	0	0	0	121.4
508	S	29.6	Very low	31.8	Very low	96 Å²	96	143.9 Å²	143.9	67%	0.671	76%	0.758	S	S	*	*			trans	-80	164	139.6	59.6	0	0	0	0	111.3
509	N	32.6	Very low	31.6	Very low	137 Å²	137	145.7 Å²	145.7	73%	0.733	76%	0.761	S	S	*	*				149.5	113.7	129.3	-74.5	-20.5	0	0	0	114.5
510	K	34.7	Very low	31.5	Very low	215 Å²	215	149.6 Å²	149.6	94%	0.935	77%	0.774	S	S	*	*				-153.4	117.3	129.5	-116.2	171.8	-175.1	176.6	0	109.9
511	L	32.7	Very low	31.3	Very low	155 Å²	155	147.2 Å²	147.2	81%	0.812	77%	0.768	S	S	*	*			trans	-89.3	157.1	-178	-87.8	157.5	0	0	0	111.8
512	Y	28.7	Very low	31.2	Very low	211 Å²	211	148.6 Å²	148.6	83%	0.827	77%	0.771	S	S	*	*			trans	-25.6	138.4	158.5	-78.9	-107.1	0	0	0	115.7
513	Q	31.9	Very low	31.1	Very low	164 Å²	164	147.6 Å²	147.6	77%	0.766	77%	0.771	S	S	*	*				-149.7	136.6	119.4	-76.6	-149.7	-6.8	0	0	111	I515	Q513-I515 HydrophobicContact CB-CG1 4.44Å
514	P	28.5	Very low	31.3	Very low	103 Å²	103	148.6 Å²	148.6	67%	0.669	77%	0.774	S	S	*	*			trans	-87.5	125.6	163.9	33.3	-28.6	0	0	0	110
515	I	32.9	Very low	31.2	Very low	143 Å²	143	142.6 Å²	142.6	73%	0.733	77%	0.768	S	S	*	*			trans	-126.8	139.4	176.7	-63.7	-177.3	0	0	0	110.8	Q513	Q513-I515 HydrophobicContact CB-CG1 4.44Å
516	S	31.8	Very low	31.4	Very low	110 Å²	110	143.8 Å²	143.8	77%	0.769	77%	0.774	S	S	*	*			trans	-59.2	158.1	-170.5	-51.9	0	0	0	0	116.1
517	R	27.1	Very low	31.3	Very low	186 Å²	186	146.9 Å²	146.9	70%	0.702	78%	0.777	S	S	*	*			trans	-61.9	129.9	164.7	-64.2	171.4	168.4	-163.7	-8.1	111.5	S649	R517-S649 PolarHBondContact NH1-O 3.24Å; R517-S649 PolarHBondContact NH1-OG 2.94Å
518	S	30.2	Very low	31.4	Very low	98 Å²	98	150.6 Å²	150.6	69%	0.685	78%	0.779	S	S	*	*			trans	-163.5	138.8	148.7	56	0	0	0	0	111.4
519	N	30	Very low	31.6	Very low	150 Å²	150	154 Å²	154	80%	0.802	78%	0.784	S	S	*	*			trans	57.1	98.5	163.3	-55	-8.4	0	0	0	117.6
520	L	29.8	Very low	31.6	Very low	170 Å²	170	155.5 Å²	155.5	89%	0.89	79%	0.787	S	S	*	*				-62.7	128.1	129.8	-85.1	67.4	0	0	0	106.9
521	D	31.8	Very low	31.5	Very low	138 Å²	138	151.7 Å²	151.7	74%	0.738	77%	0.772	S	S	*	*			trans	-168.1	137.9	146.3	-118.3	-24.2	0	0	0	111.6
522	N	30.4	Very low	31.6	Very low	140 Å²	140	151.1 Å²	151.1	75%	0.749	77%	0.765	S	S	*	*			trans	63.5	128.6	-179.1	-48.3	-73.6	0	0	0	114.2
523	V	31.2	Very low	31.9	Very low	136 Å²	136	148.3 Å²	148.3	82%	0.824	76%	0.759	S	S	*	*				-134.5	116.5	51.3	-179.6	0	0	0	0	112.9
524	I	33.5	Very low	32	Very low	156 Å²	156	149 Å²	149	80%	0.8	76%	0.762	S	S	*	*			trans	-126.8	111.8	146.1	-66.7	-178.8	0	0	0	106.3
525	G	30.5	Very low	32.4	Very low	71 Å²	71	148.4 Å²	148.4	73%	0.732	76%	0.759	S	S	*	*			trans	-85.8	120.2	-173.1	0	0	0	0	0	113.1
526	I	35.5	Very low	32.3	Very low	157 Å²	157	152.4 Å²	152.4	81%	0.805	77%	0.765	S	S	*	*			trans	-123.8	127	164.1	-59.5	-177.6	0	0	0	109
527	K	32.1	Very low	32.3	Very low	194 Å²	194	153.1 Å²	153.1	84%	0.843	76%	0.764	S	S	*	*			trans	-70.2	143.2	178.4	-61	174.2	179.1	176.6	0	111.2
528	R	34.3	Very low	32.4	Very low	233 Å²	233	151.5 Å²	151.5	88%	0.879	77%	0.769	S	S	*	*				-178.4	129.4	117.2	-93.7	159.9	-145.6	-166.2	7	112.6
529	H	34.4	Very low	32.5	Very low	166 Å²	166	152 Å²	152	77%	0.769	77%	0.772	S	S	*	*			trans	25.8	124.9	149.6	-61	-94.2	0	0	0	121.8
530	H	31.2	Very low	32.5	Very low	170 Å²	170	149.3 Å²	149.3	79%	0.787	77%	0.765	S	S	*	*				15.3	145.9	117.6	-69.2	-71.2	0	0	0	118.8
531	H	33.1	Very low	32.7	Very low	135 Å²	135	148.7 Å²	148.7	63%	0.625	76%	0.761	S	S	*	*			cis	-167.3	141.5	41.1	-150.2	68.2	0	0	0	112.8
532	Q	33.8	Very low	33	Very low	143 Å²	143	147.6 Å²	147.6	67%	0.668	76%	0.759	S	S	*	*			trans	60.9	161.7	155.9	-72.5	-179.2	1.5	0	0	118.6
533	Q	35.5	Very low	33.3	Very low	152 Å²	152	146.5 Å²	146.5	71%	0.71	76%	0.76	S	S	*	*			cis	-152	125.6	-4.1	-122.4	174.4	72.2	0	0	108
534	Q	35	Very low	33.5	Very low	177 Å²	177	144.8 Å²	144.8	83%	0.827	75%	0.754	S	S	*	*				83.6	153.6	111.3	-82.2	-128.3	9.4	0	0	119.2
535	P	37	Very low	33.5	Very low	91 Å²	91	143.9 Å²	143.9	59%	0.591	76%	0.756	S	S	*	*			trans	-146.3	-172.1	-135	44.8	-24.8	0	0	0	119.2
536	R	30.4	Very low	33.5	Very low	228 Å²	228	147.1 Å²	147.1	86%	0.86	76%	0.755	S	S	*	*			trans	74	162.6	167.2	-57.2	171.4	-179.6	-174.3	-0.4	114.2
537	T	32.4	Very low	33.3	Very low	125 Å²	125	144.8 Å²	144.8	77%	0.767	75%	0.753	S	S	*	*			cis	-131.4	147	14.5	42.6	0	0	0	0	111.6
538	L	29	Very low	33.3	Very low	152 Å²	152	142.5 Å²	142.5	80%	0.796	75%	0.749	S	S	*	*				84.4	144	59.2	-116.8	177.9	0	0	0	115.1
539	S	32	Very low	33.1	Very low	107 Å²	107	139.1 Å²	139.1	75%	0.748	74%	0.743	S	S	*	*			trans	77.4	149.3	173.7	80.6	0	0	0	0	118.2
540	S	30.4	Very low	33	Very low	94 Å²	94	135.6 Å²	135.6	66%	0.657	74%	0.737	S	S	*	*			cis	-174.9	167.6	-23.2	51.8	0	0	0	0	113.3
541	I	34.2	Very low	33.1	Very low	157 Å²	157	134.2 Å²	134.2	81%	0.805	74%	0.735	S	S	*	*			trans	113.9	132.1	151.5	-64.4	154	0	0	0	117.1
542	T	37.1	Very low	33	Very low	115 Å²	115	137.3 Å²	137.3	71%	0.706	74%	0.742	S	S	*	*			trans	-130.1	162.6	171.5	53.5	0	0	0	0	110.1
543	P	37.9	Very low	33	Very low	118 Å²	118	137.3 Å²	137.3	77%	0.766	75%	0.747	S	S	*	*				-133.6	151.1	126.1	35.4	-25.4	0	0	0	112.2
544	S	33.6	Very low	32.9	Very low	100 Å²	100	134.4 Å²	134.4	70%	0.699	74%	0.743	S	S	*	*			cis	97	151.8	21.5	-61.5	0	0	0	0	115.1
545	V	34	Very low	33	Very low	136 Å²	136	131.5 Å²	131.5	82%	0.824	74%	0.738	S	S	*	*			trans	82.7	136	171.2	-175.7	0	0	0	0	116.1
546	L	30	Very low	32.9	Very low	139 Å²	139	133.6 Å²	133.6	73%	0.728	75%	0.749	S	S	*	*			cis	-173.8	145.8	-33.3	-119.9	164.1	0	0	0	111.7	I548	L546-I548 HydrophobicContact CD2-CG1 4.38Å
547	S	31.5	Very low	33.1	Very low	109 Å²	109	127.3 Å²	127.3	76%	0.762	74%	0.74	S	S	*	*			trans	-156.5	116	148.5	52	0	0	0	0	108
548	I	33.1	Very low	33.1	Very low	146 Å²	146	125.8 Å²	125.8	75%	0.749	74%	0.735	S	S	*	*				69.6	128.1	57.1	-56.8	170.2	0	0	0	111.5	L546	L546-I548 HydrophobicContact CD2-CG1 4.38Å
549	Q	30.3	Very low	33.4	Very low	162 Å²	162	125.7 Å²	125.7	76%	0.757	73%	0.73	S	S	*	*			cis	169.5	160.4	-28.6	169.8	63.6	5.1	0	0	106.2
550	S	31.7	Very low	33.1	Very low	91 Å²	91	129.5 Å²	129.5	64%	0.636	73%	0.728	S	S	*	*			trans	81.5	158	163.4	88.5	0	0	0	0	118.2
551	L	33.2	Very low	33.1	Very low	142 Å²	142	131.7 Å²	131.7	74%	0.743	73%	0.726	S	S	*	*			cis	-151	129.2	5.9	-130.2	142.5	0	0	0	112.6
552	Y	31.5	Very low	32.9	Very low	199 Å²	199	134.8 Å²	134.8	78%	0.78	73%	0.727	S	S	*	*			trans	24.2	140.7	146.8	-62.7	-120	0	0	0	124.6
553	N	32.8	Very low	32.8	Very low	144 Å²	144	133.6 Å²	133.6	77%	0.77	73%	0.729	S	S	*	*				-175.7	124.3	103	-103.6	-13.4	0	0	0	112
554	S	35	Very low	32.7	Very low	91 Å²	91	133.6 Å²	133.6	64%	0.636	73%	0.729	S	S	*	*				83.6	134.8	88.1	81.8	0	0	0	0	114.3
555	T	35.2	Very low	32.4	Very low	115 Å²	115	138.1 Å²	138.1	71%	0.706	74%	0.739	S	S	*	*			cis	-169.6	151.5	3	6.2	0	0	0	0	112.3
556	T	35.5	Very low	32.5	Very low	136 Å²	136	137.7 Å²	137.7	83%	0.834	74%	0.742	S	S	*	*			trans	63.8	152.5	150.4	49.6	0	0	0	0	120.9
557	S	35.2	Very low	32.5	Very low	96 Å²	96	139.8 Å²	139.8	67%	0.671	75%	0.748	S	S	*	*			cis	-165.7	146.2	-4.7	157.7	0	0	0	0	112.2
558	S	32.1	Very low	32.9	Very low	93 Å²	93	139.5 Å²	139.5	65%	0.65	74%	0.744	S	S	*	*			trans	62.4	156.4	154.1	-64.1	0	0	0	0	119.9
559	Q	34.6	Very low	32.9	Very low	149 Å²	149	137.8 Å²	137.8	70%	0.696	75%	0.745	S	S	*	*			cis	-156.5	131	-17.8	-109.2	178.2	78.3	0	0	106.1
560	R	26.4	Very low	32.9	Very low	188 Å²	188	136.3 Å²	136.3	71%	0.709	75%	0.747	S	S	*	*				89.5	142.1	79.2	-165.1	-175.7	-168.8	-162	5.9	113.8
561	F	29.9	Very low	33	Very low	139 Å²	139	139.2 Å²	139.2	61%	0.61	75%	0.754	S	S	*	*			trans	79.1	146	175.6	-57.7	-65.2	0	0	0	116.8
562	R	30.5	Very low	32.8	Very low	223 Å²	223	137.4 Å²	137.4	84%	0.842	75%	0.753	S	S	*	*			cis	-165.7	152.8	-26.3	-150	178.7	-160.6	160	-0.2	108.8
563	A	35	Very low	33	Very low	90 Å²	90	134.1 Å²	134.1	74%	0.744	75%	0.753	S	S	*	*			trans	-95.7	151.8	168	0	0	0	0	0	111.9
564	P	34.6	Very low	32.8	Very low	118 Å²	118	134.2 Å²	134.2	77%	0.766	75%	0.754	S	S	*	*				-136.2	150.4	112.4	36.5	-24.1	0	0	0	112
565	Q	29	Very low	32.8	Very low	194 Å²	194	138 Å²	138	91%	0.907	76%	0.761	S	S	*	*				61.2	103.5	66.7	-88.6	-165.9	-5.5	0	0	116.3
566	S	35.3	Very low	32.7	Very low	127 Å²	127	137.8 Å²	137.8	89%	0.888	76%	0.76	S	S	*	*			trans	-161.5	144.7	147.9	56.5	0	0	0	0	112.3
567	Q	31.2	Very low	32.8	Very low	183 Å²	183	137 Å²	137	86%	0.855	76%	0.757	S	S	*	*			trans	-137.4	-170.5	176.7	-111.4	-163	5.1	0	0	106.3
568	P	39.8	Very low	32.7	Very low	103 Å²	103	143.9 Å²	143.9	67%	0.669	77%	0.769	S	S	*	*			cis	-135.5	178.5	-49.5	39.8	-24.1	0	0	0	113.3
569	S	32.7	Very low	32.7	Very low	110 Å²	110	147.6 Å²	147.6	77%	0.769	78%	0.776	S	S	*	*			trans	-165.3	124.8	149.7	35.4	0	0	0	0	109.2
570	V	30	Very low	32.5	Very low	132 Å²	132	147.6 Å²	147.6	80%	0.8	78%	0.78	S	S	*	*				68.1	116.8	68.6	179.3	0	0	0	0	110.1
571	I	33	Very low	32.7	Very low	152 Å²	152	143 Å²	143	78%	0.779	78%	0.777	S	S	*	*				-146.7	125.3	64.2	-63.1	164.2	0	0	0	109
572	S	29.8	Very low	32.6	Very low	103 Å²	103	140.9 Å²	140.9	72%	0.72	78%	0.779	S	S	*	*				53.5	137.8	91.7	-134	0	0	0	0	115.8
573	T	35.8	Very low	32.6	Very low	130 Å²	130	136.9 Å²	136.9	80%	0.798	77%	0.773	S	S	*	*			cis	-143.6	170.3	48.2	46.7	0	0	0	0	115.1
574	N	28.6	Very low	32.3	Very low	146 Å²	146	137.9 Å²	137.9	78%	0.781	77%	0.77	S	S	*	*			trans	-107.4	173.4	175.4	-73.6	-45.1	0	0	0	112.5
575	E	34.8	Very low	32.2	Very low	170 Å²	170	139.6 Å²	139.6	79%	0.794	77%	0.767	S	S	*	*				173.3	95.3	128.1	-90.4	-56.5	158.7	0	0	110
576	T	33.4	Very low	32.2	Very low	112 Å²	112	136.5 Å²	136.5	69%	0.687	76%	0.756	S	S	*	*				69.6	129.9	91.2	-25.3	0	0	0	0	118
577	P	36.6	Very low	32.1	Very low	118 Å²	118	139.1 Å²	139.1	77%	0.766	75%	0.754	S	S	*	*			trans	-113.8	166.4	-175.6	41.7	-35.6	0	0	0	117.3
578	R	34.4	Very low	32	Very low	242 Å²	242	137.4 Å²	137.4	91%	0.913	75%	0.751	S	S	*	*			trans	-147	134.2	164.4	-67.7	-170	-178.2	-162.1	0.6	109.4
579	Q	30.4	Very low	32.3	Very low	170 Å²	170	137 Å²	137	79%	0.794	75%	0.748	S	S	*	*				73.2	99.4	59.1	-80.3	-82.8	16.8	0	0	115.2
580	L	32.2	Very low	32.4	Very low	150 Å²	150	140.9 Å²	140.9	79%	0.785	75%	0.751	S	S	*	*				176.7	144.1	123.3	-116.2	76	0	0	0	114.7
581	S	29.1	Very low	32.4	Very low	92 Å²	92	141.3 Å²	141.3	64%	0.643	75%	0.748	S	S	*	*			trans	14.8	150.6	142.3	57.5	0	0	0	0	123.1
582	S	29.3	Very low	32.4	Very low	94 Å²	94	141.7 Å²	141.7	66%	0.657	75%	0.75	S	S	*	*			cis	174.8	178.1	-1.2	51.8	0	0	0	0	113.7
583	I	30	Very low	32.2	Very low	139 Å²	139	145.7 Å²	145.7	71%	0.713	76%	0.755	S	S	*	*			trans	91.8	105.7	141.6	-85.4	166.5	0	0	0	121.1
584	T	29.5	Very low	31.9	Very low	111 Å²	111	143.7 Å²	143.7	68%	0.681	75%	0.752	S	S	*	*			trans	66	161.5	136.8	69.1	0	0	0	0	121.2
585	Q	31	Very low	32	Very low	153 Å²	153	143.2 Å²	143.2	72%	0.715	75%	0.754	S	S	*	*			cis	-166	147.2	-7.1	-122.6	173.6	-32	0	0	111.4
586	I	29.5	Very low	31.9	Very low	129 Å²	129	142.4 Å²	142.4	66%	0.662	75%	0.754	S	S	*	*			trans	63.8	156.6	140.4	-74.3	170.8	0	0	0	117.5
587	Q	33.3	Very low	31.8	Very low	183 Å²	183	142.5 Å²	142.5	86%	0.855	76%	0.757	S	S	*	*			cis	-134.9	-162.9	12.2	-150.6	130.8	21.1	0	0	114
588	N	28.5	Very low	31.4	Very low	147 Å²	147	142.2 Å²	142.2	79%	0.786	75%	0.753	S	S	*	*			trans	-137	-160.6	-162.8	-151	-6.7	0	0	0	111.1
589	P	45.7	Very low	31.1	Very low	95 Å²	95	135.8 Å²	135.8	62%	0.617	74%	0.744	S	S	*	*				-121.4	-169	-116.1	43.3	-27.6	0	0	0	116.2
590	K	35.6	Very low	31.1	Very low	190 Å²	190	132.8 Å²	132.8	83%	0.826	74%	0.741	S	S	*	*			trans	-172.2	124.8	143.5	-97.5	142.2	-171.9	179.6	0	112.1
591	I	29.8	Very low	30.9	Very low	142 Å²	142	132.4 Å²	132.4	73%	0.728	74%	0.74	S	S	*	*				75.3	128.3	76.5	-56.3	168.5	0	0	0	115.7
592	L	32.3	Very low	30.9	Very low	160 Å²	160	134.1 Å²	134.1	84%	0.838	75%	0.747	S	S	*	*			trans	116.4	149.3	160.3	-65.1	-175.9	0	0	0	117
593	K	27.1	Very low	30.9	Very low	186 Å²	186	135.4 Å²	135.4	81%	0.809	75%	0.75	S	S	*	*				-173.4	127	-66.5	169.9	175.7	-177.7	-179.4	0	111.9
594	A	29.1	Very low	30.8	Very low	89 Å²	89	131.2 Å²	131.2	74%	0.736	74%	0.741	S	S	*	*			trans	65	166.1	169.1	0	0	0	0	0	116.1
595	T	30.1	Very low	30.8	Very low	136 Å²	136	129.9 Å²	129.9	83%	0.834	74%	0.736	S	S	*	*			cis	-151.7	151.4	20.5	-54.1	0	0	0	0	112.4
596	L	32.8	Very low	30.6	Very low	152 Å²	152	126.7 Å²	126.7	80%	0.796	73%	0.728	S	S	*	*			trans	-96	153.8	172.2	-71.1	166.5	0	0	0	112.4
597	P	32.6	Very low	30.7	Very low	115 Å²	115	125.8 Å²	125.8	75%	0.747	73%	0.728	S	S	*	*				-144.5	145.6	105.9	19.2	4.1	0	0	0	114.5
598	V	27.9	Very low	30.6	Very low	112 Å²	112	126.4 Å²	126.4	68%	0.679	72%	0.724	S	S	*	*				64.9	132.2	79.7	176	0	0	0	0	113.9
599	C	28.3	Very low	30.6	Very low	106 Å²	106	123.5 Å²	123.5	72%	0.716	72%	0.721	S	S	*	*			cis	-172.8	-173.9	-15.6	-100.3	0	0	0	0	108.7
600	S	29.6	Very low	29.8	Very low	107 Å²	107	124.1 Å²	124.1	75%	0.748	73%	0.727	S	S	*	*			trans	88.2	143.4	151.6	-55.5	0	0	0	0	118.6
601	N	28.9	Very low	29.5	Very low	143 Å²	143	122.3 Å²	122.3	77%	0.765	73%	0.726	S	S	*	*			cis	-175	171.9	-26.5	-121.2	-5.8	0	0	0	110.4
602	V	28.7	Very low	29.6	Very low	128 Å²	128	124.7 Å²	124.7	78%	0.776	74%	0.737	S	S	*	*			trans	71.2	139.1	152	160	0	0	0	0	116.5
603	V	28	Very low	29.5	Very low	121 Å²	121	126.4 Å²	126.4	73%	0.733	74%	0.738	S	S	*	*			cis	-160.7	163.4	-9.7	121.2	0	0	0	0	110.3
604	G	29.5	Very low	29.5	Very low	50 Å²	50	122.8 Å²	122.8	52%	0.515	74%	0.735	S	S	.	*			trans	130.2	94	162.6	0	0	0	0	0	113.1
605	S	28.4	Very low	29.4	Very low	83 Å²	83	124.2 Å²	124.2	58%	0.58	74%	0.739	S	S	*	*				67.8	129.1	69.6	-57	0	0	0	0	114.1
606	T	27.8	Very low	29.3	Very low	87 Å²	87	122.1 Å²	122.1	53%	0.534	73%	0.73	S	S	.	*			cis	-177.1	153.7	-10.1	21.9	0	0	0	0	107.1	I319	I319-T606 WeakPolarHBondContact CG2-OG1 3.36Å
607	T	30.8	Very low	29.2	Very low	110 Å²	110	121.3 Å²	121.3	68%	0.675	73%	0.731	S	S	*	*			trans	-179.8	126.9	152.6	-89.4	0	0	0	0	112.1
608	Y	31.1	Very low	29	Very low	196 Å²	196	122.4 Å²	122.4	77%	0.769	73%	0.729	S	S	*	*			trans	40.5	114.5	157.3	-68	-118.8	0	0	0	118.5
609	A	28.7	Very low	29	Very low	86 Å²	86	123.1 Å²	123.1	71%	0.711	73%	0.729	S	S	*	*				69.9	141.7	57.3	0	0	0	0	0	114.7
610	S	28.4	Very low	29	Very low	107 Å²	107	125.3 Å²	125.3	75%	0.748	73%	0.732	S	S	*	*			cis	177.9	123.9	-23.5	-99.5	0	0	0	0	107
611	N	30.4	Very low	29	Very low	153 Å²	153	125.8 Å²	125.8	82%	0.818	73%	0.731	S	S	*	*			trans	-177.9	108.6	153.3	-100	-22.4	0	0	0	112.1
612	M	31.4	Very low	29.1	Very low	191 Å²	191	122.7 Å²	122.7	94%	0.941	73%	0.725	S	S	*	*			trans	-158.1	135.7	144.8	-93.5	-106	169	0	0	106.8
613	F	30.5	Very low	29.2	Very low	197 Å²	197	124.4 Å²	124.4	86%	0.864	73%	0.73	S	S	*	*			trans	-78.2	135.4	-170.7	-90.7	-108.4	0	0	0	112.3	S615	F613-S615 PolarHBondContact O-N 3.3Å
614	C	25.8	Very low	29.4	Very low	110 Å²	110	125.7 Å²	125.7	74%	0.743	73%	0.733	S	S	*	*			trans	-70.7	123.7	163.9	-69.5	0	0	0	0	110.7
615	S	28.6	Very low	29.4	Very low	119 Å²	119	131.2 Å²	131.2	83%	0.832	75%	0.75	S	S	*	*			trans	-98.9	91.8	151.2	-78.4	0	0	0	0	108.2	F613 V617	F613-S615 PolarHBondContact O-N 3.3Å; S615-V617 PolarHBondContact O-N 3.46Å
616	S	27.8	Very low	29.5	Very low	92 Å²	92	132.6 Å²	132.6	64%	0.643	76%	0.757	S	S	*	*			trans	-75.1	88.6	-174.7	-58	0	0	0	0	112.4	I618	S616-I618 VanDerWaalsContact C-N 3.34Å; S616-I618 PolarHBondContact O-N 2.86Å
617	V	30.1	Very low	29.4	Very low	134 Å²	134	137.4 Å²	137.4	81%	0.812	78%	0.775	S	S	*	*			trans	-82.7	84.6	162.1	-176.8	0	0	0	0	108.4	S615 N619	S615-V617 PolarHBondContact O-N 3.46Å; V617-N619 PolarHBondContact O-N 2.98Å
618	I	28	Very low	29.4	Very low	138 Å²	138	139.8 Å²	139.8	71%	0.708	78%	0.784	S	S	*	*			trans	-77	100.2	171.8	-65.2	171.8	0	0	0	107.6	S616 I620	S616-I618 VanDerWaalsContact C-N 3.34Å; S616-I618 PolarHBondContact O-N 2.86Å; I618-I620 HydrophobicContact CG2-CD1 3.89Å; I618-I620 HydrophobicContact CG2-CG1 3.73Å
619	N	28.8	Very low	29.3	Very low	128 Å²	128	134.1 Å²	134.1	68%	0.684	77%	0.773	S	S	*	*			trans	-106.6	99.5	172.3	-159.4	25	0	0	0	109.3	V617 T621	V617-N619 PolarHBondContact O-N 2.98Å; N619-T621 PolarHBondContact O-N 2.92Å
620	I	27.9	Very low	29.3	Very low	151 Å²	151	136.8 Å²	136.8	77%	0.774	78%	0.775	S	S	*	*			trans	-85.3	88.9	-179.5	-60.9	162.1	0	0	0	108.1	I618	I618-I620 HydrophobicContact CG2-CD1 3.89Å; I618-I620 HydrophobicContact CG2-CG1 3.73Å
621	T	29.6	Very low	29.5	Very low	118 Å²	118	138.7 Å²	138.7	72%	0.724	78%	0.775	S	S	*	*	P	Polyproline II helix	trans	-92.7	126.7	167	40.7	0	0	0	0	110.1	N619	N619-T621 PolarHBondContact O-N 2.92Å
622	A	32	Very low	29.6	Very low	78 Å²	78	137.5 Å²	137.5	65%	0.645	77%	0.769	S	S	*	*	P	Polyproline II helix	trans	-58.2	143.5	-163.5	0	0	0	0	0	116.1	N624	A622-N624 PolarHBondContact O-N 3.18Å; A622-N624 PolarHBondContact O-ND2 2.89Å
623	D	29.6	Very low	29.6	Very low	163 Å²	163	135.9 Å²	135.9	87%	0.872	76%	0.759	S	S	*	*	P	Polyproline II helix	trans	-50.8	125.2	161.5	-60.8	-76.6	0	0	0	110.8
624	N	31.4	Very low	29.7	Very low	149 Å²	149	131 Å²	131	80%	0.797	75%	0.75	S	S	*	*			trans	-128.2	89.2	167.8	-82.2	-89.4	0	0	0	108.8	A622	A622-N624 PolarHBondContact O-N 3.18Å; A622-N624 PolarHBondContact O-ND2 2.89Å
625	L	30.9	Very low	29.9	Very low	166 Å²	166	133 Å²	133	87%	0.869	75%	0.753	S	S	*	*			trans	-72.7	155.8	162.7	-82.1	172.1	0	0	0	110
626	P	29.8	Very low	30.1	Very low	112 Å²	112	139.3 Å²	139.3	73%	0.727	76%	0.759	S	S	*	*			trans	-87.2	160.6	-138.9	31.7	-37.9	0	0	0	115.7	N628	P626-N628 PolarHBondContact O-N 2.87Å
627	M	26.7	Very low	30	Very low	188 Å²	188	141.7 Å²	141.7	93%	0.926	77%	0.77	S	S	*	*			trans	-40.6	117.5	162.6	-63.8	-88.9	-83.9	0	0	112
628	N	31.2	Very low	30.1	Very low	159 Å²	159	140.3 Å²	140.3	85%	0.85	77%	0.766	S	S	*	*			trans	-96.4	144.5	148.8	-166.6	14.6	0	0	0	108.3	P626	P626-N628 PolarHBondContact O-N 2.87Å
629	S	28.6	Very low	30.3	Very low	78 Å²	78	141.2 Å²	141.2	55%	0.545	77%	0.771	S	S	.	*			trans	-107.6	151.3	-161.6	62.7	0	0	0	0	113.6
630	N	28.2	Very low	30.4	Very low	141 Å²	141	142.7 Å²	142.7	75%	0.754	78%	0.778	S	S	*	*			trans	64.6	116.9	158.7	-48.2	-37.5	0	0	0	117.2
631	I	32.8	Very low	30.6	Very low	147 Å²	147	140.9 Å²	140.9	75%	0.754	78%	0.777	S	S	*	*				174.2	131.6	105.7	-88.7	156.7	0	0	0	109.3
632	D	32.2	Very low	30.8	Very low	129 Å²	129	144 Å²	144	69%	0.69	78%	0.783	S	S	*	*			trans	58.9	155	159.2	-68.9	-8.2	0	0	0	121.5
633	Q	31.9	Very low	30.7	Very low	156 Å²	156	146.6 Å²	146.6	73%	0.729	79%	0.786	S	S	*	*			cis	-160.9	161.7	-35.5	-122.6	178.6	75.9	0	0	109.5
634	S	32.4	Very low	30.7	Very low	96 Å²	96	144.5 Å²	144.5	67%	0.671	78%	0.779	S	S	*	*			trans	62.6	115.3	159.1	72	0	0	0	0	121.6
635	N	30	Very low	30.5	Very low	152 Å²	152	147.2 Å²	147.2	81%	0.813	78%	0.784	S	S	*	*				50	106.1	122.5	-51.9	-25.1	0	0	0	121.1
636	R	31.8	Very low	30.4	Very low	251 Å²	251	145.3 Å²	145.3	95%	0.947	77%	0.774	S	S	*	*				-173.5	155.5	93.9	-100.9	-178.5	177.3	-145.8	-1.6	113.9
637	T	27.1	Very low	30.3	Very low	142 Å²	142	145.7 Å²	145.7	87%	0.871	78%	0.776	S	S	*	*			trans	-98	136.8	-176.3	15	0	0	0	0	113.2
638	S	31.2	Very low	30.4	Very low	105 Å²	105	141.9 Å²	141.9	73%	0.734	77%	0.768	S	S	*	*			trans	-166.9	116.5	148.6	57.1	0	0	0	0	115.4
639	L	31.8	Very low	30.2	Very low	157 Å²	157	137.9 Å²	137.9	82%	0.822	75%	0.752	S	S	*	*			trans	70	113.4	134.1	-56.2	172.4	0	0	0	123.1
640	L	30.9	Very low	30.3	Very low	159 Å²	159	138.8 Å²	138.8	83%	0.832	76%	0.758	S	S	*	*			trans	78.2	157	138.9	-86.4	76.8	0	0	0	120.8
641	P	32.8	Very low	30.3	Very low	113 Å²	113	138.7 Å²	138.7	73%	0.734	76%	0.763	S	S	*	*			trans	-129.3	173.7	-145.8	44.1	-29.9	0	0	0	115.9
642	Q	33	Very low	30.1	Very low	182 Å²	182	136.5 Å²	136.5	85%	0.85	76%	0.756	S	S	*	*			trans	-150.8	122.3	159.6	-114	167.4	27.4	0	0	114.8
643	N	31	Very low	29.9	Very low	134 Å²	134	138.4 Å²	138.4	72%	0.717	76%	0.761	S	S	*	*			trans	43.6	86.9	143.5	-58.6	-4	0	0	0	120.8
644	T	29	Very low	29.6	Very low	118 Å²	118	139.3 Å²	139.3	72%	0.724	76%	0.763	S	S	*	*				34.4	99.7	109	-46.5	0	0	0	0	118.3	I646	T644-I646 HydrophobicContact CG2-CD1 4.17Å; T644-I646 HydrophobicContact CG2-CG1 3.66Å
645	F	28.3	Very low	29.5	Very low	207 Å²	207	140 Å²	140	91%	0.908	77%	0.765	S	S	*	*			trans	-94.6	129.3	152.4	-92	-99.2	0	0	0	109.6
646	I	28.7	Very low	29.5	Very low	126 Å²	126	138.7 Å²	138.7	65%	0.646	77%	0.768	S	S	*	*			trans	-104.8	116	-179.1	-53.1	-178	0	0	0	110.5	T644 S648	T644-I646 HydrophobicContact CG2-CD1 4.17Å; T644-I646 HydrophobicContact CG2-CG1 3.66Å; I646-S648 PolarHBondContact O-N 2.8Å; I646-S648 VanDerWaalsContact O-N 3.12Å
647	P	26.5	Very low	29.3	Very low	119 Å²	119	131.9 Å²	131.9	77%	0.773	76%	0.758	S	S	*	*			trans	-82.7	80.9	170.9	33.2	-33	0	0	0	110.4	S649	P647-S649 PolarHBondContact O-N 2.7Å
648	S	29.9	Very low	29.6	Very low	108 Å²	108	132.9 Å²	132.9	76%	0.755	76%	0.757	S	S	*	*			trans	-67.5	86.3	-176.3	-65.1	0	0	0	0	113.4	I646	I646-S648 PolarHBondContact O-N 2.8Å; I646-S648 VanDerWaalsContact O-N 3.12Å
649	S	26.1	Very low	29.6	Very low	75 Å²	75	133.5 Å²	133.5	52%	0.524	76%	0.761	S	S	.	*			trans	-132.2	92.2	161.2	68.8	0	0	0	0	111.6	R517 P647	R517-S649 PolarHBondContact NH1-O 3.24Å; R517-S649 PolarHBondContact NH1-OG 2.94Å; P647-S649 PolarHBondContact O-N 2.7Å
650	S	30.9	Very low	29.6	Very low	97 Å²	97	128.6 Å²	128.6	68%	0.678	75%	0.749	S	S	*	*			trans	-138.2	98.3	172.7	42.4	0	0	0	0	109.5	V652	S650-V652 PolarHBondContact O-N 2.96Å
651	V	27.4	Very low	29.6	Very low	140 Å²	140	128.7 Å²	128.7	85%	0.848	75%	0.75	S	S	*	*			trans	-70.4	113.5	166.5	176.7	0	0	0	0	107.2
652	V	29.8	Very low	29.5	Very low	101 Å²	101	130.2 Å²	130.2	61%	0.612	75%	0.752	S	S	*	*			trans	-110.4	114.4	172.6	-177.4	0	0	0	0	108.4	S650 F654	S650-V652 PolarHBondContact O-N 2.96Å; V652-F654 HydrophobicContact CB-CE2 4.47Å; V652-F654 HydrophobicContact CG1-CD2 4.01Å; V652-F654 HydrophobicContact CG1-CE2 3.54Å; V652-F654 HydrophobicContact CG1-CZ 4.13Å
653	Q	27	Very low	29.4	Very low	168 Å²	168	127.5 Å²	127.5	79%	0.785	75%	0.748	S	S	*	*			trans	-88.2	114.9	-176.9	177.1	180	-32.7	0	0	110
654	F	26.7	Very low	29.3	Very low	175 Å²	175	127.8 Å²	127.8	77%	0.768	75%	0.748	S	S	*	*			trans	-107.1	137.7	171.8	-79.8	-78.1	0	0	0	111.2	V652 S656	V652-F654 HydrophobicContact CB-CE2 4.47Å; V652-F654 HydrophobicContact CG1-CD2 4.01Å; V652-F654 HydrophobicContact CG1-CE2 3.54Å; V652-F654 HydrophobicContact CG1-CZ 4.13Å; F654-S656 PolarHBondContact O-N 3.36Å
655	P	29.4	Very low	29.4	Very low	111 Å²	111	127.2 Å²	127.2	72%	0.721	74%	0.744	S	S	*	*			trans	-83.8	114.4	-177.9	32.1	-33	0	0	0	111.9	S657	P655-S657 PolarHBondContact O-N 3.47Å
656	S	30.3	Very low	29.6	Very low	125 Å²	125	124.7 Å²	124.7	87%	0.874	74%	0.739	S	S	*	*			trans	-88.6	74.4	175.1	59.3	0	0	0	0	111.9	F654	F654-S656 PolarHBondContact O-N 3.36Å
657	S	27.6	Very low	29.7	Very low	107 Å²	107	126.9 Å²	126.9	75%	0.748	75%	0.746	S	S	*	*			trans	-107.3	75.4	172.7	62.5	0	0	0	0	111.6	P655	P655-S657 PolarHBondContact O-N 3.47Å
658	I	34	Very low	30	Very low	163 Å²	163	131.3 Å²	131.3	84%	0.836	75%	0.753	S	S	*	*			trans	-123.7	112.6	164.8	-65.1	-179.2	0	0	0	107.5
659	S	30.2	Very low	29.9	Very low	118 Å²	118	128.9 Å²	128.9	83%	0.825	75%	0.745	S	S	*	*			trans	-75.6	140.2	167.5	45.5	0	0	0	0	109.7
660	G	31.8	Very low	30.1	Very low	55 Å²	55	132.2 Å²	132.2	57%	0.567	76%	0.762	S	S	*	*			trans	-172.3	87.3	-176.1	0	0	0	0	0	110.9	N662	G660-N662 PolarHBondContact O-N 2.79Å
661	N	30.9	Very low	30	Very low	160 Å²	160	132.1 Å²	132.1	86%	0.856	77%	0.767	S	S	*	*			trans	-73.4	71.9	-174	-71.5	-2	0	0	0	112.4
662	N	32	Very low	30.1	Very low	145 Å²	145	135.2 Å²	135.2	78%	0.775	76%	0.764	S	S	*	*			trans	-105.6	79.5	171.3	-75	-36	0	0	0	109.9	G660 I664	G660-N662 PolarHBondContact O-N 2.79Å; N662-I664 PolarHBondContact O-N 3.23Å
663	V	29.1	Very low	30.2	Very low	126 Å²	126	139.4 Å²	139.4	76%	0.764	77%	0.774	S	S	*	*			trans	-72.2	94.8	172.6	-178.9	0	0	0	0	108.7	V665	V663-V665 HydrophobicContact CG1-CG2 4.09Å; V663-V665 PolarHBondContact O-N 2.98Å
664	I	29.7	Very low	30.4	Very low	139 Å²	139	136.7 Å²	136.7	71%	0.713	77%	0.769	S	S	*	*			trans	-74.4	93.5	173.8	-56.5	179.4	0	0	0	108.3	N662 L666	N662-I664 PolarHBondContact O-N 3.23Å; I664-L666 HydrophobicContact CG2-CD2 4.17Å; I664-L666 HydrophobicContact CG2-CG 4.22Å; I664-L666 PolarHBondContact O-N 3.26Å
665	V	32	Very low	30.5	Very low	107 Å²	107	138.1 Å²	138.1	65%	0.648	78%	0.775	S	S	*	*			trans	-69	92.7	171.6	-177.6	0	0	0	0	108.8	V663 H667	V663-V665 HydrophobicContact CG1-CG2 4.09Å; V663-V665 PolarHBondContact O-N 2.98Å; V665-H667 PolarHBondContact O-N 3.26Å
666	L	31.2	Very low	30.5	Very low	154 Å²	154	136.7 Å²	136.7	81%	0.806	76%	0.764	S	S	*	*			trans	-71.1	80.8	169.9	-73.9	178	0	0	0	110	I664 K668	I664-L666 HydrophobicContact CG2-CD2 4.17Å; I664-L666 HydrophobicContact CG2-CG 4.22Å; I664-L666 PolarHBondContact O-N 3.26Å; L666-K668 PolarHBondContact O-N 2.97Å
667	H	30.7	Very low	30.4	Very low	171 Å²	171	136.7 Å²	136.7	79%	0.792	76%	0.761	S	S	*	*			trans	-59	104.9	170.3	-129.8	-90.3	0	0	0	108.9	V665 G669	V665-H667 PolarHBondContact O-N 3.26Å; H667-G669 PolarHBondContact O-N 2.78Å
668	K	32.6	Very low	30.6	Very low	212 Å²	212	137 Å²	137	92%	0.922	76%	0.759	S	S	*	*			trans	-75.2	63	178.1	-165.9	177.5	-179.3	-180	0	110.4	L666 V670	L666-K668 PolarHBondContact O-N 2.97Å; K668-V670 PolarHBondContact O-N 3.16Å; K668-V670 VanDerWaalsContact O-N 3.11Å
669	G	29.5	Very low	30.5	Very low	57 Å²	57	134.2 Å²	134.2	59%	0.588	75%	0.751	S	S	*	*			trans	-67.7	103.8	-174.2	0	0	0	0	0	113	H667	H667-G669 PolarHBondContact O-N 2.78Å
670	V	29.2	Very low	30.4	Very low	145 Å²	145	134.1 Å²	134.1	88%	0.879	75%	0.751	S	S	*	*			trans	45.7	92.6	147.3	-169.4	0	0	0	0	116.5	K668	K668-V670 PolarHBondContact O-N 3.16Å; K668-V670 VanDerWaalsContact O-N 3.11Å
671	A	28	Very low	30.3	Very low	95 Å²	95	139.1 Å²	139.1	79%	0.785	76%	0.763	S	S	*	*			trans	-149.1	13.2	157.4	0	0	0	0	0	115.6	K673	A671-K673 PolarHBondContact O-N 3.01Å
672	R	31.1	Very low	30.2	Very low	206 Å²	206	142.8 Å²	142.8	78%	0.777	76%	0.764	S	S	*	*			trans	-74.9	66.8	163.1	-81.8	-170	177.1	172.4	-0.7	109.7	T674 D787	R672-T674 PolarHBondContact O-N 3.44Å; R672-T674 VanDerWaalsContact O-N 3.15Å; R672-D787 IonicContact CZ-OD2 2.72Å; R672-D787 IonicContact NH1-OD1 2.75Å; R672-D787 IonicContact NH1-OD2 2.71Å; R672-D787 PolarHBondContact NH1-OD2 3.39Å; R672-D787 IonicContact NH2-OD2 3.2Å; R672-D787 PolarHBondContact NH2-OD2 3.18Å
673	K	32.3	Very low	30	Very low	188 Å²	188	143.3 Å²	143.3	82%	0.817	77%	0.766	S	S	*	*			trans	-65.1	105.9	149	-97	-167.4	174	-173.9	0	105.4	A671 F675	A671-K673 PolarHBondContact O-N 3.01Å; K673-F675 PolarHBondContact O-N 3.45Å; K673-F675 VanDerWaalsContact O-N 3.1Å
674	T	29.5	Very low	30	Very low	111 Å²	111	139.9 Å²	139.9	68%	0.681	76%	0.756	S	S	*	*			trans	-57.9	113.5	166.1	34.2	0	0	0	0	108.1	R672 T676	R672-T674 PolarHBondContact O-N 3.44Å; R672-T674 VanDerWaalsContact O-N 3.15Å; T674-T676 PolarHBondContact O-N 3.21Å
675	F	28.5	Very low	29.9	Very low	206 Å²	206	138.5 Å²	138.5	90%	0.904	76%	0.758	S	S	*	*			trans	-74.7	70.9	160.1	-118	-81.2	0	0	0	107.6	K673	K673-F675 PolarHBondContact O-N 3.45Å; K673-F675 VanDerWaalsContact O-N 3.1Å
676	T	30.7	Very low	29.8	Very low	80 Å²	80	140 Å²	140	49%	0.491	77%	0.768	S	S	.	*			trans	-61.7	132.8	157	42.1	0	0	0	0	107.3	T674 T678	T674-T676 PolarHBondContact O-N 3.21Å; T676-T678 PolarHBondContact O-N 3.38Å; T676-T678 PolarHBondContact O-OG1 3.18Å; T676-T678 VanDerWaalsContact O-OG1 3.06Å; T676-T678 PolarHBondContact OG1-OG1 3.2Å
677	P	28.6	Very low	29.8	Very low	125 Å²	125	138.1 Å²	138.1	81%	0.812	76%	0.763	S	S	*	*			trans	-67.4	83.2	163.2	29	-32.3	0	0	0	107.6
678	T	31.8	Very low	29.7	Very low	114 Å²	114	135 Å²	135	70%	0.699	76%	0.757	S	S	*	*			trans	-72.6	120.2	-171.9	-47.6	0	0	0	0	107.8	T676	T676-T678 PolarHBondContact O-N 3.38Å; T676-T678 PolarHBondContact O-OG1 3.18Å; T676-T678 VanDerWaalsContact O-OG1 3.06Å; T676-T678 PolarHBondContact OG1-OG1 3.2Å
679	P	31.2	Very low	29.5	Very low	104 Å²	104	131 Å²	131	68%	0.675	75%	0.751	S	S	*	*			trans	-86.8	166.3	-158.7	34.3	-38.5	0	0	0	113.6
680	S	28.6	Very low	29.5	Very low	116 Å²	116	134.4 Å²	134.4	81%	0.811	76%	0.755	S	S	*	*			trans	59.4	91.7	153.7	-59.3	0	0	0	0	117.8
681	I	30	Very low	29.5	Very low	160 Å²	160	133.2 Å²	133.2	82%	0.821	74%	0.744	S	S	*	*			trans	-115.1	119.4	138.7	-64.4	-175.5	0	0	0	108.7	I683	I681-I683 HydrophobicContact CG2-CG1 4.21Å; I681-I683 PolarHBondContact O-N 3.37Å
682	R	27.3	Very low	29.6	Very low	237 Å²	237	135.4 Å²	135.4	89%	0.894	74%	0.743	S	S	*	*			trans	-85	100.2	172.3	179.5	-168.2	-66	-159.4	-2.1	108.9
683	I	28.6	Very low	29.6	Very low	157 Å²	157	131 Å²	131	81%	0.805	74%	0.739	S	S	*	*			trans	-109.5	129.5	147.7	-54.8	175.9	0	0	0	103.4	I681	I681-I683 HydrophobicContact CG2-CG1 4.21Å; I681-I683 PolarHBondContact O-N 3.37Å
684	G	29	Very low	29.6	Very low	54 Å²	54	130.9 Å²	130.9	56%	0.557	74%	0.741	S	S	*	*			cis	132.2	122.5	23.6	0	0	0	0	0	104.4	T686	G684-T686 PolarHBondContact O-N 3.15Å
685	S	28.3	Very low	29.6	Very low	109 Å²	109	129 Å²	129	76%	0.762	74%	0.737	S	S	*	*			trans	-67.1	119.6	-156.1	52.3	0	0	0	0	114.3	V687	S685-V687 PolarHBondContact O-N 3.46Å
686	T	29.4	Very low	29.6	Very low	140 Å²	140	126.8 Å²	126.8	86%	0.859	73%	0.733	S	S	*	*			trans	-87.5	83.6	156.6	48.5	0	0	0	0	109.5	G684	G684-T686 PolarHBondContact O-N 3.15Å
687	V	30.8	Very low	29.6	Very low	114 Å²	114	128.8 Å²	128.8	69%	0.691	75%	0.745	S	S	*	*			trans	-63.6	130.4	168.6	172.9	0	0	0	0	109.4	S685	S685-V687 PolarHBondContact O-N 3.46Å
688	P	28	Very low	29.7	Very low	104 Å²	104	128.4 Å²	128.4	68%	0.675	75%	0.745	S	S	*	*			trans	-87	158.3	159.5	36.6	-32.9	0	0	0	110.6
689	V	29.3	Very low	29.6	Very low	129 Å²	129	126.1 Å²	126.1	78%	0.782	74%	0.744	S	S	*	*			trans	86.2	114.4	166.1	-173.9	0	0	0	0	117.7
690	N	29.4	Very low	29.5	Very low	128 Å²	128	126.9 Å²	126.9	68%	0.684	75%	0.752	S	S	*	*			trans	92.6	114	146.3	-154	-70.6	0	0	0	120.7
691	N	29	Very low	29.6	Very low	120 Å²	120	132.3 Å²	132.3	64%	0.642	76%	0.756	S	S	*	*			trans	34.4	122.1	145.8	-42.6	-11.3	0	0	0	118.8
692	N	31.1	Very low	29.7	Very low	142 Å²	142	130.5 Å²	130.5	76%	0.759	76%	0.758	S	S	*	*			cis	-161.1	145.4	49.9	-83.7	-71.5	0	0	0	113.8
693	T	31.2	Very low	29.7	Very low	114 Å²	114	127.1 Å²	127.1	70%	0.699	76%	0.758	S	S	*	*			trans	37.6	128.7	137.7	-23.2	0	0	0	0	122.2
694	Q	31.3	Very low	29.7	Very low	184 Å²	184	124.2 Å²	124.2	86%	0.86	76%	0.757	S	S	*	*			trans	79.9	152.8	163.3	-47	-166.5	48	0	0	118.5
695	A	29.7	Very low	29.6	Very low	72 Å²	72	127 Å²	127	60%	0.595	77%	0.768	S	S	*	*			cis	-171.2	117.5	-35.5	0	0	0	0	0	112.7
696	I	28.1	Very low	29.7	Very low	159 Å²	159	127.7 Å²	127.7	82%	0.815	77%	0.767	S	S	*	*			trans	67.1	159.4	141.7	-44.9	165.8	0	0	0	118.5
697	V	32.2	Very low	29.7	Very low	123 Å²	123	125.1 Å²	125.1	75%	0.745	76%	0.76	S	S	*	*			trans	72.9	100.6	172.5	-162.7	0	0	0	0	114.9
698	S	29	Very low	29.5	Very low	117 Å²	117	128.1 Å²	128.1	82%	0.818	76%	0.764	S	S	*	*			cis	76.4	100.5	48.2	-49.8	0	0	0	0	114.7
699	G	31.3	Very low	29.7	Very low	66 Å²	66	128.9 Å²	128.9	68%	0.68	77%	0.769	S	S	*	*			trans	-163.5	115.8	175.7	0	0	0	0	0	113.4
700	S	29	Very low	29.8	Very low	119 Å²	119	128.1 Å²	128.1	83%	0.832	77%	0.77	S	S	*	*			trans	-70.9	137.2	-168.7	-45.3	0	0	0	0	115.3
701	Y	30.9	Very low	29.7	Very low	231 Å²	231	133.1 Å²	133.1	91%	0.906	78%	0.779	S	S	*	*			trans	-138	147.9	161.4	-69.2	-76.2	0	0	0	111.6
702	S	30.9	Very low	29.9	Very low	122 Å²	122	136.2 Å²	136.2	85%	0.853	79%	0.789	S	S	*	*			trans	-90.7	146.8	-159	-53.5	0	0	0	0	115.3	A704	S702-A704 PolarHBondContact O-N 2.85Å
703	N	26.8	Very low	29.8	Very low	166 Å²	166	139.2 Å²	139.2	89%	0.888	80%	0.796	S	S	*	*			trans	-65.9	119.2	175.9	-75.2	-32.8	0	0	0	112.8	S705	N703-S705 PolarHBondContact O-N 3.44Å
704	A	29.6	Very low	29.9	Very low	96 Å²	96	144 Å²	144	79%	0.793	80%	0.801	S	S	*	*			trans	-84.1	96	169.4	0	0	0	0	0	110.8	S702 V706	S702-A704 PolarHBondContact O-N 2.85Å; A704-V706 PolarHBondContact O-N 3.08Å
705	S	27.3	Very low	29.9	Very low	112 Å²	112	142.8 Å²	142.8	78%	0.783	80%	0.799	S	S	*	*			trans	-76.2	109.1	176.3	-173.6	0	0	0	0	111.5	N703 A707	N703-S705 PolarHBondContact O-N 3.44Å; S705-A707 PolarHBondContact O-N 3.06Å; S705-A707 VanDerWaalsContact O-N 3.16Å
706	V	29.3	Very low	30.2	Very low	124 Å²	124	146.8 Å²	146.8	75%	0.752	81%	0.809	S	S	*	*			trans	-84	84.6	172	-177	0	0	0	0	109.1	A704 F708	A704-V706 PolarHBondContact O-N 3.08Å; V706-F708 PolarHBondContact O-N 3.49Å
707	A	29.3	Very low	30.3	Very low	85 Å²	85	142 Å²	142	70%	0.702	80%	0.799	S	S	*	*			trans	-68.1	121.3	177.8	0	0	0	0	0	111.5	S705	S705-A707 PolarHBondContact O-N 3.06Å; S705-A707 VanDerWaalsContact O-N 3.16Å
708	F	25.9	Very low	30.3	Very low	177 Å²	177	144 Å²	144	78%	0.776	81%	0.805	S	S	*	*			trans	-74.5	133.4	170.8	-78.2	-96.5	0	0	0	110.5	V706 S710	V706-F708 PolarHBondContact O-N 3.49Å; F708-S710 PolarHBondContact O-N 2.92Å; F708-S710 VanDerWaalsContact O-N 3.08Å
709	P	33	Very low	30.4	Very low	120 Å²	120	143.9 Å²	143.9	78%	0.779	80%	0.803	S	S	*	*			trans	-75.9	99.7	179	29.5	-34	0	0	0	111.4	R711	P709-R711 PolarHBondContact O-N 3.12Å
710	S	30.5	Very low	30.2	Very low	114 Å²	114	148 Å²	148	80%	0.797	81%	0.81	S	S	*	*			trans	-65.2	86.5	173.5	-58.8	0	0	0	0	112.1	F708 Q712	F708-S710 PolarHBondContact O-N 2.92Å; F708-S710 VanDerWaalsContact O-N 3.08Å; S710-Q712 PolarHBondContact O-N 3.15Å; S710-Q712 VanDerWaalsContact O-N 3.09Å
711	R	28.8	Very low	30.3	Very low	232 Å²	232	148.2 Å²	148.2	88%	0.875	81%	0.807	S	S	*	*			trans	-69.2	104.4	168.3	-92.7	-171.9	174.7	-100.5	-0	110	P709	P709-R711 PolarHBondContact O-N 3.12Å
712	Q	32.2	Very low	30.1	Very low	185 Å²	185	142.4 Å²	142.4	86%	0.864	80%	0.797	S	S	*	*			trans	-61.4	132.9	170.1	-66.9	175.7	-20.3	0	0	110.8	S710 R714	S710-Q712 PolarHBondContact O-N 3.15Å; S710-Q712 VanDerWaalsContact O-N 3.09Å; Q712-R714 PolarHBondContact O-N 3.37Å; Q712-R714 VanDerWaalsContact O-N 3.17Å
713	F	28.3	Very low	30	Very low	206 Å²	206	143.4 Å²	143.4	90%	0.904	80%	0.798	S	S	*	*			trans	-76	97.7	168.8	-72.1	-91.8	0	0	0	109.5	I715	F713-I715 PolarHBondContact O-N 2.9Å
714	R	33.9	Very low	29.9	Very low	214 Å²	214	140.3 Å²	140.3	81%	0.808	79%	0.788	S	S	*	*			trans	-78.8	106.5	166.7	-175.9	-178.5	-81.7	-153.6	-4.1	108.9	Q712 I716	Q712-R714 PolarHBondContact O-N 3.37Å; Q712-R714 VanDerWaalsContact O-N 3.17Å; R714-I716 HydrophobicContact CG-CD1 4.45Å; R714-I716 HydrophobicContact CG-CG1 3.81Å; R714-I716 PolarHBondContact O-N 3.44Å; R714-I716 VanDerWaalsContact O-N 3.14Å
715	I	32.2	Very low	29.6	Very low	158 Å²	158	140.4 Å²	140.4	81%	0.81	78%	0.783	S	S	*	*			trans	-69.2	106.7	167.7	-59.5	175.9	0	0	0	107.7	F713	F713-I715 PolarHBondContact O-N 2.9Å
716	I	34.7	Very low	29.7	Very low	156 Å²	156	142.7 Å²	142.7	80%	0.8	79%	0.786	S	S	*	*			trans	-100.6	98.8	170.7	-56.1	178.1	0	0	0	106.1	R714	R714-I716 HydrophobicContact CG-CD1 4.45Å; R714-I716 HydrophobicContact CG-CG1 3.81Å; R714-I716 PolarHBondContact O-N 3.44Å; R714-I716 VanDerWaalsContact O-N 3.14Å
717	G	31.1	Very low	29.5	Very low	59 Å²	59	141.9 Å²	141.9	61%	0.608	79%	0.786	S	S	*	*			trans	-173.2	9.3	-169.5	0	0	0	0	0	117.5
718	L	31.8	Very low	29.5	Very low	166 Å²	166	142.9 Å²	142.9	87%	0.869	79%	0.788	S	S	*	*			trans	-131.9	121.3	166	-72	176.4	0	0	0	108.6	N720	L718-N720 PolarHBondContact O-N 3.49Å
719	S	30.7	Very low	29.6	Very low	113 Å²	113	140.2 Å²	140.2	79%	0.79	79%	0.786	S	S	*	*			trans	-82.8	111.3	177.5	51.4	0	0	0	0	110.1	T721	S719-T721 PolarHBondContact O-N 3.05Å
720	N	28.2	Very low	29.5	Very low	154 Å²	154	140.2 Å²	140.2	82%	0.824	78%	0.784	S	S	*	*			trans	-63.4	123.3	169.2	-68.3	-12.4	0	0	0	110.1	L718	L718-N720 PolarHBondContact O-N 3.49Å
721	T	29.9	Very low	29.4	Very low	123 Å²	123	143 Å²	143	76%	0.755	78%	0.784	S	S	*	*			trans	-121.6	97.7	159.5	49.1	0	0	0	0	108.4	S719	S719-T721 PolarHBondContact O-N 3.05Å
722	P	27.8	Very low	29.4	Very low	108 Å²	108	138.6 Å²	138.6	70%	0.701	78%	0.783	S	S	*	*			trans	-76.7	130.3	177.2	30.9	-32.3	0	0	0	110.1
723	V	29.3	Very low	29.3	Very low	144 Å²	144	134.3 Å²	134.3	87%	0.873	77%	0.774	S	S	*	*			trans	-106.3	97.6	161.6	-179.2	0	0	0	0	107
724	C	23.3	Very low	29.4	Very low	101 Å²	101	132.3 Å²	132.3	68%	0.682	77%	0.771	S	S	*	*			trans	-70.2	146.6	170.4	-56	0	0	0	0	109.6
725	S	24.6	Very low	29.3	Very low	98 Å²	98	130.9 Å²	130.9	69%	0.685	77%	0.766	S	S	*	*				166.2	157.4	115.9	-72.4	0	0	0	0	111.8
726	N	28.2	Very low	29.2	Very low	160 Å²	160	130.4 Å²	130.4	86%	0.856	77%	0.766	S	S	*	*			trans	71.6	135.9	165.9	-48.9	-26.2	0	0	0	116.7
727	S	25.8	Very low	29.2	Very low	107 Å²	107	128 Å²	128	75%	0.748	76%	0.762	S	S	*	*			cis	159	89.4	-30.9	166.9	0	0	0	0	107.5
728	S	29.9	Very low	29.1	Very low	105 Å²	105	133.8 Å²	133.8	73%	0.734	77%	0.774	S	S	*	*			trans	-166.5	97.8	158.2	45.7	0	0	0	0	107.8
729	T	28.1	Very low	29.3	Very low	122 Å²	122	130.8 Å²	130.8	75%	0.748	76%	0.764	S	S	*	*				74.9	142.9	77.2	59.4	0	0	0	0	114.5
730	V	30.3	Very low	29.2	Very low	120 Å²	120	129.9 Å²	129.9	73%	0.727	76%	0.758	S	S	*	*			trans	83.7	92.6	173.7	-168.2	0	0	0	0	115.6
731	E	28.4	Very low	29.4	Very low	173 Å²	173	131.4 Å²	131.4	81%	0.808	76%	0.76	S	S	*	*				49.5	147.6	117.7	-62.1	165.8	-169.5	0	0	120.2
732	T	29.7	Very low	29.5	Very low	139 Å²	139	131.5 Å²	131.5	85%	0.853	76%	0.76	S	S	*	*			cis	-134.9	161.6	31.5	46.5	0	0	0	0	114.9
733	S	29.3	Very low	29.8	Very low	95 Å²	95	132.6 Å²	132.6	66%	0.664	76%	0.758	S	S	*	*			trans	-132.6	140.7	175.6	55.4	0	0	0	0	111.9
734	I	30.2	Very low	30	Very low	163 Å²	163	136 Å²	136	84%	0.836	76%	0.755	S	S	*	*			trans	-142.8	98	162.7	-54.3	-178	0	0	0	104.7
735	Y	31.8	Very low	30.5	Very low	184 Å²	184	137.4 Å²	137.4	72%	0.722	76%	0.756	S	S	*	*				56.2	115.4	92.3	-82.6	-96.6	0	0	0	113.4
736	N	31.3	Very low	31	Very low	148 Å²	148	139 Å²	139	79%	0.791	76%	0.756	S	S	*	*				77.4	150.1	54	-80.7	-9.7	0	0	0	115.7
737	S	33.7	Very low	31.2	Very low	105 Å²	105	137.6 Å²	137.6	73%	0.734	75%	0.748	S	S	*	*			trans	71	115.6	167.4	31.6	0	0	0	0	119.6
738	E	28.5	Very low	31.7	Very low	181 Å²	181	139.6 Å²	139.6	85%	0.846	75%	0.746	S	S	*	*				-4	162.3	126.1	-69.5	-174.5	113.6	0	0	119.9
739	P	35.7	Very low	31.9	Very low	103 Å²	103	141.4 Å²	141.4	67%	0.669	75%	0.746	S	S	*	*			cis	-139.5	-173.4	-35.8	38	-19.8	0	0	0	112.8
740	S	30.3	Very low	32.3	Very low	95 Å²	95	141.5 Å²	141.5	66%	0.664	75%	0.747	S	S	*	*			trans	58.7	105.1	154.7	56.2	0	0	0	0	121.5
741	H	30.7	Very low	32.5	Very low	186 Å²	186	140.4 Å²	140.4	86%	0.861	74%	0.744	S	S	*	*			trans	79.5	153.5	137.6	-70.8	8.9	0	0	0	121.7
742	V	33.6	Very low	32.9	Very low	124 Å²	124	139.5 Å²	139.5	75%	0.752	74%	0.743	S	S	*	*			trans	84.2	78.7	162.1	-159.3	0	0	0	0	120.3
743	I	32.6	Very low	33.1	Very low	131 Å²	131	140 Å²	140	67%	0.672	74%	0.736	S	S	*	*				68.2	118.7	120.3	-66.5	173.7	0	0	0	121.7
744	R	33.9	Very low	33.2	Very low	215 Å²	215	142.3 Å²	142.3	81%	0.811	74%	0.741	S	S	*	*			trans	81.3	112.8	146.3	-76	168.4	-167.2	155	1.7	124.1
745	N	34.3	Very low	33.5	Very low	131 Å²	131	140.7 Å²	140.7	70%	0.701	74%	0.739	S	S	*	*				85.9	121.2	117	-73.6	19	0	0	0	125.4
746	I	35.8	Very low	33.8	Very low	133 Å²	133	137.4 Å²	137.4	68%	0.682	74%	0.74	S	S	*	*			trans	85.6	116.5	130.8	-63.7	167.6	0	0	0	120.7
747	N	32.3	Very low	33.9	Very low	129 Å²	129	137.2 Å²	137.2	69%	0.69	74%	0.744	S	S	*	*			trans	29.4	161	136.9	-41.3	8.2	0	0	0	121.4
748	E	34.8	Very low	33.6	Very low	150 Å²	150	140.4 Å²	140.4	70%	0.701	75%	0.75	S	S	*	*			cis	-170.3	176.2	18.7	-146.6	161.9	-122.5	0	0	113.5
749	L	35.2	Very low	33.6	Very low	142 Å²	142	141 Å²	141	74%	0.743	76%	0.755	S	S	*	*			trans	70.8	160.6	157.1	-60.1	168.4	0	0	0	122
750	V	37.3	Very low	33.2	Very low	125 Å²	125	142.5 Å²	142.5	76%	0.758	76%	0.762	S	S	*	*			cis	-168.3	146	-44.9	93.4	0	0	0	0	115.2
751	S	33.9	Very low	33.2	Very low	96 Å²	96	144 Å²	144	67%	0.671	77%	0.768	S	S	*	*			trans	60.7	143.9	147.7	-156.2	0	0	0	0	126.4
752	I	35.9	Very low	33.1	Very low	154 Å²	154	141.2 Å²	141.2	79%	0.79	76%	0.764	S	S	*	*				167.5	156.3	120.1	-85.1	170.1	0	0	0	115.5
753	Q	34.9	Very low	32.8	Very low	149 Å²	149	142.1 Å²	142.1	70%	0.696	76%	0.764	S	S	*	*			trans	-36.9	161.3	-176.5	-78.5	88	-52.8	0	0	120.9
754	N	30.9	Very low	32.7	Very low	144 Å²	144	141.7 Å²	141.7	77%	0.77	77%	0.768	S	S	*	*			cis	79.2	148.7	38	-91.3	-63.4	0	0	0	116.2
755	T	35.7	Very low	32.3	Very low	129 Å²	129	138.8 Å²	138.8	79%	0.791	77%	0.767	S	S	*	*			cis	-158.6	172.8	21.5	-4.4	0	0	0	0	111.3
756	P	38.8	Very low	32	Very low	115 Å²	115	136.7 Å²	136.7	75%	0.747	76%	0.762	S	S	*	*			trans	-117.9	176.8	-165.8	43.9	-35.9	0	0	0	118.7
757	T	34.3	Very low	31.8	Very low	144 Å²	144	136.1 Å²	136.1	88%	0.883	77%	0.765	S	S	*	*			trans	-140.7	144.2	170.7	-56.9	0	0	0	0	114.9
758	M	27.4	Very low	31.7	Very low	173 Å²	173	134.5 Å²	134.5	85%	0.852	76%	0.764	S	S	*	*			trans	-42.7	144	-176	-56.1	-64.2	176.3	0	0	121
759	M	28.2	Very low	31.4	Very low	194 Å²	194	133.7 Å²	133.7	96%	0.956	78%	0.775	S	S	*	*			trans	-150	154.5	131.5	-101.5	-158.7	-176.6	0	0	111.3
760	T	26.4	Very low	31.1	Very low	133 Å²	133	131 Å²	131	82%	0.816	77%	0.773	S	S	*	*			trans	-104.1	120.1	-167.8	-52.2	0	0	0	0	113
761	T	30	Very low	30.7	Very low	127 Å²	127	133 Å²	133	78%	0.779	78%	0.78	S	S	*	*			trans	-134.8	135.8	162.3	49.9	0	0	0	0	110.9	N763	T761-N763 PolarHBondContact O-N 3.41Å
762	T	29.1	Very low	30.6	Very low	127 Å²	127	137.3 Å²	137.3	78%	0.779	79%	0.789	S	S	*	*			trans	-75.3	117.4	-177.7	43.8	0	0	0	0	111.8	V764	T762-V764 PolarHBondContact O-N 3.45Å
763	N	28.4	Very low	30.4	Very low	143 Å²	143	138.1 Å²	138.1	77%	0.765	79%	0.794	S	S	*	*			trans	-68.7	108	173.1	-81.9	-29.7	0	0	0	111.7	T761 I765	T761-N763 PolarHBondContact O-N 3.41Å; N763-I765 HydrophobicContact CB-CG1 4.38Å; N763-I765 PolarHBondContact O-N 3.26Å
764	V	28.8	Very low	30.3	Very low	122 Å²	122	137.9 Å²	137.9	74%	0.739	80%	0.796	S	S	*	*			trans	-85.2	85.3	163.2	-178.2	0	0	0	0	108.5	T762 S766	T762-V764 PolarHBondContact O-N 3.45Å; V764-S766 PolarHBondContact O-N 3.22Å
765	I	26.5	Very low	30.4	Very low	155 Å²	155	139.6 Å²	139.6	80%	0.795	80%	0.8	S	S	*	*			trans	-80.3	98.6	166.9	-61	176.2	0	0	0	107.5	N763	N763-I765 HydrophobicContact CB-CG1 4.38Å; N763-I765 PolarHBondContact O-N 3.26Å
766	S	27.9	Very low	30.2	Very low	86 Å²	86	142.2 Å²	142.2	60%	0.601	80%	0.802	S	S	*	*			trans	-122.4	109.4	173.1	-70.2	0	0	0	0	110.4	V764 S768	V764-S766 PolarHBondContact O-N 3.22Å; S766-S768 PolarHBondContact O-N 3.43Å
767	T	30.7	Very low	29.8	Very low	121 Å²	121	141.6 Å²	141.6	74%	0.742	80%	0.797	S	S	*	*			trans	25.2	92	155.8	57	0	0	0	0	116.4
768	S	30.3	Very low	29.7	Very low	96 Å²	96	140.3 Å²	140.3	67%	0.671	79%	0.794	S	S	*	*				41.6	84.8	86.9	78.8	0	0	0	0	114.7	S766 A770	S766-S768 PolarHBondContact O-N 3.43Å; S768-A770 PolarHBondContact O-N 3.21Å; S768-A770 VanDerWaalsContact O-N 3.1Å
769	S	28.2	Very low	30	Very low	133 Å²	133	143.1 Å²	143.1	93%	0.93	80%	0.795	S	S	*	*	S	Bend		50.2	49.2	128.8	-45.9	0	0	0	0	118.9
770	A	29.6	Very low	30.2	Very low	85 Å²	85	140.4 Å²	140.4	70%	0.702	78%	0.783	S	S	*	*			trans	-145.4	41	178.1	0	0	0	0	0	115.1	S768	S768-A770 PolarHBondContact O-N 3.21Å; S768-A770 VanDerWaalsContact O-N 3.1Å
771	N	28.6	Very low	30.6	Very low	168 Å²	168	138 Å²	138	90%	0.898	79%	0.785	S	S	*	*			trans	-143	53.6	179.4	-89.4	-47.8	0	0	0	113.9
772	H	32.3	Very low	31	Very low	186 Å²	186	136.4 Å²	136.4	86%	0.861	78%	0.779	S	S	*	*	S	Bend	trans	-147.6	51.9	170.1	-164.6	-73.6	0	0	0	112.5
773	L	31.6	Very low	31.2	Very low	171 Å²	171	136.9 Å²	136.9	90%	0.895	78%	0.776	S	S	*	*	S	Bend	trans	-166.1	64.5	175.6	-116.7	172	0	0	0	112.5
774	L	31.9	Very low	31.5	Very low	143 Å²	143	137.5 Å²	137.5	75%	0.749	78%	0.778	S	S	*	*			trans	-161.6	34.1	173.1	-115.6	168.9	0	0	0	116.8
775	H	33.7	Very low	32	Very low	181 Å²	181	140.3 Å²	140.3	84%	0.838	78%	0.783	S	S	*	*	S	Bend	trans	-128.3	31.4	175.7	-88.1	-69	0	0	0	115
776	H	31.8	Very low	32.9	Very low	183 Å²	183	137.5 Å²	137.5	85%	0.847	77%	0.773	S	S	*	*			trans	-130.2	35.4	175.4	-68.8	-47.4	0	0	0	113.8
777	T	30.1	Very low	33.5	Very low	102 Å²	102	137.5 Å²	137.5	63%	0.626	77%	0.766	S	S	*	*			trans	-124.4	45	-178.5	55.5	0	0	0	0	112.8
778	S	32.6	Very low	34.3	Very low	118 Å²	118	135 Å²	135	83%	0.825	75%	0.748	S	S	*	*	S	Bend	trans	-129.7	15.8	-179	-47.3	0	0	0	0	114
779	R	33.6	Very low	35	Very low	232 Å²	232	136 Å²	136	88%	0.875	75%	0.746	S	S	*	*			trans	-146.2	11.1	-179.9	-128.3	177.2	-178.7	-163.6	-3.1	116.1	G781	R779-G781 PolarHBondContact O-N 2.77Å; R779-G781 VanDerWaalsContact O-N 3.07Å
780	L	32.7	Very low	35.7	Very low	136 Å²	136	134.5 Å²	134.5	71%	0.712	74%	0.735	S	S	*	*			trans	-84.9	57.2	174.4	-71.3	172.2	0	0	0	111.4	I783	L780-I783 HydrophobicContact CD2-CD1 4.23Å
781	G	35	Very low	36.5	Very low	83 Å²	83	132.6 Å²	132.6	86%	0.856	71%	0.713	S	S	*	*	S	Bend	trans	-95.4	-13.5	175.3	0	0	0	0	0	114.5	R779	R779-G781 PolarHBondContact O-N 2.77Å; R779-G781 VanDerWaalsContact O-N 3.07Å
782	S	38.4	Very low	37.1	Very low	94 Å²	94	131.7 Å²	131.7	66%	0.657	71%	0.708	S	S	*	*	S	Bend	trans	-125.5	-4.8	-163.7	51.1	0	0	0	0	115.9	L784	S782-L784 PolarHBondContact O-N 2.95Å
783	I	33.2	Very low	37.7	Very low	137 Å²	137	129.6 Å²	129.6	70%	0.703	69%	0.694	S	S	*	*			trans	-96.7	63.8	-176.6	-56.2	-177	0	0	0	110.9	L780	L780-I783 HydrophobicContact CD2-CD1 4.23Å
784	L	35.1	Very low	38	Very low	155 Å²	155	127.7 Å²	127.7	81%	0.812	69%	0.685	S	S	*	*			trans	-142.8	50.9	153.4	-84.4	-174.2	0	0	0	109.2	S782 V786	S782-L784 PolarHBondContact O-N 2.95Å; L784-V786 VanDerWaalsContact C-N 3.29Å; L784-V786 PolarHBondContact O-N 3.42Å
785	E	37.5	Very low	38.2	Very low	182 Å²	182	128.4 Å²	128.4	85%	0.85	69%	0.689	S	S	*	*			trans	-71.5	89.9	164.5	-167.5	164.1	-122	0	0	108.3
786	V	46.1	Very low	38.3	Very low	96 Å²	96	125.8 Å²	125.8	58%	0.582	68%	0.677	S	S	*	*			trans	-71.7	130.8	167	178	0	0	0	0	107.2	L784 L788	L784-V786 VanDerWaalsContact C-N 3.29Å; L784-V786 PolarHBondContact O-N 3.42Å; V786-L788 HydrophobicContact CB-CD2 4.49Å; V786-L788 HydrophobicContact CB-CG 4.3Å; V786-L788 HydrophobicContact CG1-CD2 3.91Å; V786-L788 HydrophobicContact CG1-CG 4.18Å; V786-L788 PolarHBondContact O-N 3.23Å
787	D	40	Very low	38.6	Very low	85 Å²	85	120.9 Å²	120.9	46%	0.455	67%	0.668	S	S	.	*			trans	-64.2	76.4	174.9	-67.8	-67.7	0	0	0	110.9	R672 D789	R672-D787 IonicContact CZ-OD2 2.72Å; R672-D787 IonicContact NH1-OD1 2.75Å; R672-D787 IonicContact NH1-OD2 2.71Å; R672-D787 PolarHBondContact NH1-OD2 3.39Å; R672-D787 IonicContact NH2-OD2 3.2Å; R672-D787 PolarHBondContact NH2-OD2 3.18Å; D787-D789 PolarHBondContact O-N 2.72Å
788	L	48.3	Very low	39	Very low	68 Å²	68	121.7 Å²	121.7	36%	0.356	67%	0.669	S	S	.	*	T	Hydrogen-bonded Turn	trans	-80	8.7	179.4	-68	179.4	0	0	0	113.6	A75 V786 S790	A75-L788 HydrophobicContact CB-CD1 3.93Å; V786-L788 HydrophobicContact CB-CD2 4.49Å; V786-L788 HydrophobicContact CB-CG 4.3Å; V786-L788 HydrophobicContact CG1-CD2 3.91Å; V786-L788 HydrophobicContact CG1-CG 4.18Å; V786-L788 PolarHBondContact O-N 3.23Å; L788-S790 PolarHBondContact O-N 3.19Å
789	D	45.6	Very low	39.3	Very low	119 Å²	119	125.1 Å²	125.1	64%	0.636	67%	0.665	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.6	-5.2	167.9	-64.5	-44.6	0	0	0	112.4	R72 D787 D791	R72-D789 IonicContact CZ-OD1 3.93Å; R72-D789 IonicContact NH1-OD1 2.69Å; R72-D789 PolarHBondContact NH1-OD1 3.36Å; R72-D789 IonicContact NH2-OD1 3.69Å; D787-D789 PolarHBondContact O-N 2.72Å; D789-D791 PolarHBondContact O-N 2.82Å; D789-D791 VanDerWaalsContact O-N 3.17Å
790	S	41.4	Very low	39.6	Very low	101 Å²	101	121.7 Å²	121.7	71%	0.706	65%	0.653	S	S	*	*			trans	-83.7	60.5	165.5	-59.9	0	0	0	0	111.7	L788 N792	L788-S790 PolarHBondContact O-N 3.19Å; S790-N792 VanDerWaalsContact C-N 3.33Å; S790-N792 PolarHBondContact O-N 2.96Å
791	D	46.2	Very low	39.9	Very low	45 Å²	45	119 Å²	119	24%	0.241	64%	0.643	C	S	.	*			trans	-60.2	99.9	158.4	-92.3	-31.6	0	0	0	106.9	R31 S69 D789 Y793	R31-D791 IonicContact CZ-OD2 3.83Å; R31-D791 IonicContact NE-OD2 3.83Å; R31-D791 IonicContact NH2-OD2 1.77Å; R31-D791 PolarHBondContact NH2-OD2 3.09Å; S69-D791 VanDerWaalsContact CB-OD1 3.26Å; S69-D791 WeakPolarHBondContact CB-OD1 3.15Å; S69-D791 PolarHBondContact OG-OD1 3.44Å; D789-D791 PolarHBondContact O-N 2.82Å; D789-D791 VanDerWaalsContact O-N 3.17Å; D791-Y793 VanDerWaalsContact C-N 3.27Å; D791-Y793 PolarHBondContact O-N 3.23Å
792	N	41.1	Very low	39.8	Very low	148 Å²	148	121.4 Å²	121.4	79%	0.791	64%	0.636	S	S	*	*			trans	-72.7	82	-177.3	-174.2	33.2	0	0	0	110.5	S790 N794	S790-N792 VanDerWaalsContact C-N 3.33Å; S790-N792 PolarHBondContact O-N 2.96Å; N792-N794 VanDerWaalsContact C-N 3.29Å; N792-N794 PolarHBondContact O-N 3.34Å
793	Y	45.2	Very low	39.6	Very low	142 Å²	142	121.8 Å²	121.8	56%	0.557	64%	0.637	S	S	*	*			trans	-62.9	91.7	168.8	-102.9	-89.8	0	0	0	109.5	D791 D795	D791-Y793 VanDerWaalsContact C-N 3.27Å; D791-Y793 PolarHBondContact O-N 3.23Å; Y793-D795 PolarHBondContact O-N 3.03Å
794	N	39.1	Very low	39.7	Very low	132 Å²	132	123.7 Å²	123.7	71%	0.706	64%	0.643	S	S	*	*			trans	-55.4	131.9	162.7	-156.9	21.7	0	0	0	107.9	N792 Q796	N792-N794 VanDerWaalsContact C-N 3.29Å; N792-N794 PolarHBondContact O-N 3.34Å; N794-Q796 PolarHBondContact O-N 3.02Å
795	D	35.1	Very low	39.5	Very low	158 Å²	158	123.3 Å²	123.3	85%	0.845	64%	0.642	S	S	*	*	S	Bend	trans	-58.3	89.7	-161.6	-77.6	-66.8	0	0	0	114.7	Y793	Y793-D795 PolarHBondContact O-N 3.03Å
796	Q	35.7	Very low	39.1	Very low	126 Å²	126	119.4 Å²	119.4	59%	0.589	64%	0.64	S	S	*	*			trans	-112.7	61.8	167.3	-72.4	-164.9	-14.7	0	0	110.6	N794 N798 Y799	N794-Q796 PolarHBondContact O-N 3.02Å; Q796-N798 PolarHBondContact O-N 3.15Å; Q796-Y799 HydrophobicContact CB-CD2 4.39Å; Q796-Y799 PolarHBondContact O-N 3.24Å; Q796-Y799 VanDerWaalsContact OE1-CD2 3.32Å
797	A	38.3	Very low	38.4	Very low	79 Å²	79	120.4 Å²	120.4	65%	0.653	65%	0.647	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.8	6.3	172.5	0	0	0	0	0	114.7
798	N	38.8	Very low	38.2	Very low	119 Å²	119	123.3 Å²	123.3	64%	0.636	66%	0.661	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99	-15.9	-177.9	-63.9	-5.9	0	0	0	113.7	Q796 Y800 T801	Q796-N798 PolarHBondContact O-N 3.15Å; N798-Y800 VanDerWaalsContact C-N 3.28Å; N798-Y800 PolarHBondContact O-N 2.81Å; N798-T801 WeakPolarHBondContact CA-OG1 3.3Å; N798-T801 PolarHBondContact O-OG1 3.01Å; N798-T801 VanDerWaalsContact O-OG1 3.06Å
799	Y	38.5	Very low	37.5	Very low	191 Å²	191	128.2 Å²	128.2	75%	0.749	68%	0.682	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.6	-2	-172.4	-103.5	-70.5	0	0	0	115.7	Q796	Q796-Y799 HydrophobicContact CB-CD2 4.39Å; Q796-Y799 PolarHBondContact O-N 3.24Å; Q796-Y799 VanDerWaalsContact OE1-CD2 3.32Å
800	Y	40.8	Very low	36.9	Very low	160 Å²	160	126.9 Å²	126.9	63%	0.627	68%	0.681	S	S	*	*	T	Hydrogen-bonded Turn	trans	-125.4	10.2	177.3	-114	-80.6	0	0	0	113.6	N798	N798-Y800 VanDerWaalsContact C-N 3.28Å; N798-Y800 PolarHBondContact O-N 2.81Å
801	T	38.3	Very low	36.5	Very low	80 Å²	80	129.1 Å²	129.1	49%	0.491	69%	0.686	S	S	.	*	T	Hydrogen-bonded Turn	trans	-110.7	-20.3	-175.2	42.9	0	0	0	0	114.8	N798 C803	N798-T801 WeakPolarHBondContact CA-OG1 3.3Å; N798-T801 PolarHBondContact O-OG1 3.01Å; N798-T801 VanDerWaalsContact O-OG1 3.06Å; T801-C803 PolarHBondContact O-N 3.22Å
802	D	33.6	Very low	35.9	Very low	133 Å²	133	135.6 Å²	135.6	71%	0.711	71%	0.712	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.8	-8.2	-176	-79.4	-16.1	0	0	0	114.4	H804	D802-H804 VanDerWaalsContact C-N 3.28Å; D802-H804 PolarHBondContact O-N 3.34Å
803	C	32.8	Very low	35.5	Very low	101 Å²	101	135.1 Å²	135.1	68%	0.682	71%	0.708	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.3	26.3	178.7	49.7	0	0	0	0	114.7	T801	T801-C803 PolarHBondContact O-N 3.22Å
804	H	35.8	Very low	34.9	Very low	178 Å²	178	133.7 Å²	133.7	82%	0.824	71%	0.714	S	S	*	*	S	Bend	trans	-148.2	-6.4	164.7	-118.2	-65.5	0	0	0	117.4	D802	D802-H804 VanDerWaalsContact C-N 3.28Å; D802-H804 PolarHBondContact O-N 3.34Å
805	N	32.1	Very low	34.5	Very low	147 Å²	147	131.8 Å²	131.8	79%	0.786	71%	0.711	S	S	*	*			trans	-115.7	42	-176.8	-85.6	-23.3	0	0	0	113.7	T807	N805-T807 VanDerWaalsContact C-N 3.27Å; N805-T807 PolarHBondContact O-N 3.32Å
806	A	27.9	Very low	34.3	Very low	99 Å²	99	133.3 Å²	133.3	82%	0.818	71%	0.713	S	S	*	*			trans	-83.1	53	-179.2	0	0	0	0	0	113.9
807	T	33	Very low	34	Very low	117 Å²	117	133.5 Å²	133.5	72%	0.718	73%	0.727	S	S	*	*			trans	-137.8	110.5	-177.9	-59.1	0	0	0	0	112.7	N805	N805-T807 VanDerWaalsContact C-N 3.27Å; N805-T807 PolarHBondContact O-N 3.32Å
808	I	34.1	Very low	33.4	Very low	147 Å²	147	135.1 Å²	135.1	75%	0.754	73%	0.733	S	S	*	*			trans	68.1	86.7	159.9	-54.9	170.5	0	0	0	117.3
809	H	33.9	Very low	33	Very low	171 Å²	171	136.4 Å²	136.4	79%	0.792	75%	0.746	S	S	*	*				47.1	102	119.3	-77.3	-82.6	0	0	0	122
810	S	33.2	Very low	32.5	Very low	90 Å²	90	134.7 Å²	134.7	63%	0.629	75%	0.748	S	S	*	*				67.2	134.7	118.9	68.9	0	0	0	0	123.4
811	N	33.8	Very low	32	Very low	149 Å²	149	133.3 Å²	133.3	80%	0.797	76%	0.756	S	S	*	*			trans	80.9	91.4	144.6	-64.9	-14.3	0	0	0	121.5
812	K	33.1	Very low	31.6	Very low	181 Å²	181	135.4 Å²	135.4	79%	0.787	77%	0.769	S	S	*	*				71.7	113.3	108.6	-164.1	179.5	179.9	-176	0	120.1
813	L	32	Very low	31.4	Very low	138 Å²	138	135.5 Å²	135.5	72%	0.723	77%	0.768	S	S	*	*			trans	81.4	109.6	152.1	-102.3	70	0	0	0	121.4
814	T	33.1	Very low	31.3	Very low	111 Å²	111	136.6 Å²	136.6	68%	0.681	77%	0.773	S	S	*	*				52.4	102.5	125.5	57.9	0	0	0	0	122
815	S	30.7	Very low	31.1	Very low	92 Å²	92	135.5 Å²	135.5	64%	0.643	77%	0.769	S	S	*	*				67	125.1	120.8	69.9	0	0	0	0	122.2
816	H	30.7	Very low	31.2	Very low	190 Å²	190	135.2 Å²	135.2	88%	0.88	77%	0.772	S	S	*	*			trans	66.4	133.3	169	-46	-73.9	0	0	0	114.6
817	C	29.4	Very low	31.3	Very low	131 Å²	131	134.4 Å²	134.4	89%	0.885	76%	0.76	S	S	*	*			cis	-141.7	173.3	24.9	-163.6	0	0	0	0	112.3
818	S	25.9	Very low	31.2	Very low	112 Å²	112	136.8 Å²	136.8	78%	0.783	77%	0.768	S	S	*	*			trans	-95.8	125.9	-175.9	-56.3	0	0	0	0	113.6
819	T	31.1	Very low	31.1	Very low	146 Å²	146	134.8 Å²	134.8	90%	0.896	77%	0.767	S	S	*	*			trans	-136.4	140.8	156.6	-64.5	0	0	0	0	109
820	I	27.6	Very low	31.2	Very low	156 Å²	156	133.9 Å²	133.9	80%	0.8	77%	0.766	S	S	*	*			trans	-97.3	140.2	-172.1	-62.5	160.2	0	0	0	110.2
821	V	29.8	Very low	31.1	Very low	131 Å²	131	135 Å²	135	79%	0.794	77%	0.765	S	S	*	*			trans	-163	116.4	136.5	142.1	0	0	0	0	110.3
822	T	30.2	Very low	30.9	Very low	124 Å²	124	134.6 Å²	134.6	76%	0.761	77%	0.768	S	S	*	*			trans	38.6	124.1	149.2	-41.8	0	0	0	0	122.2
823	I	28.9	Very low	30.8	Very low	135 Å²	135	129.6 Å²	129.6	69%	0.692	76%	0.755	S	S	*	*			trans	-125.1	137	167.4	-56.7	168.1	0	0	0	109.3	Q825	I823-Q825 HydrophobicContact CG2-CG 4.03Å
824	P	31.4	Very low	30.7	Very low	123 Å²	123	131.6 Å²	131.6	80%	0.799	76%	0.758	S	S	*	*			trans	-87.8	103.1	160.9	32.8	-27.8	0	0	0	110.3
825	Q	32.2	Very low	30.6	Very low	155 Å²	155	134.9 Å²	134.9	72%	0.724	77%	0.771	S	S	*	*			trans	-83.1	136.5	175.2	-70.8	-172.4	-34.6	0	0	111.7	I823	I823-Q825 HydrophobicContact CG2-CG 4.03Å
826	V	33.2	Very low	30.7	Very low	142 Å²	142	135.9 Å²	135.9	86%	0.861	77%	0.773	S	S	*	*			trans	-114.2	87.2	165.7	-175.3	0	0	0	0	108.3
827	S	31.2	Very low	30.7	Very low	81 Å²	81	133 Å²	133	57%	0.566	77%	0.771	S	S	*	*			trans	-89.7	105.9	-175.1	-57.2	0	0	0	0	111.2	S829	S827-S829 VanDerWaalsContact C-N 3.25Å; S827-S829 PolarHBondContact O-N 3.09Å
828	L	30.4	Very low	31	Very low	168 Å²	168	133.6 Å²	133.6	88%	0.88	76%	0.764	S	S	*	*			trans	-76.4	75.8	170.7	-81.2	171.2	0	0	0	111.2
829	S	30.7	Very low	31.4	Very low	104 Å²	104	136.5 Å²	136.5	73%	0.727	77%	0.765	S	S	*	*			trans	-92.2	105.8	166.3	-62.4	0	0	0	0	109.8	S827 D831	S827-S829 VanDerWaalsContact C-N 3.25Å; S827-S829 PolarHBondContact O-N 3.09Å; S829-D831 PolarHBondContact O-N 3.36Å
830	I	36.6	Very low	31.4	Very low	153 Å²	153	137.5 Å²	137.5	79%	0.785	76%	0.759	S	S	*	*			trans	-84.2	92.1	168.5	-60.4	180	0	0	0	107.7	V832	I830-V832 PolarHBondContact O-N 2.92Å
831	D	30.7	Very low	31.7	Very low	112 Å²	112	137.2 Å²	137.2	60%	0.599	76%	0.759	S	S	*	*			trans	-78.8	109.6	178.9	-178.5	3.1	0	0	0	111	S829 S833	S829-D831 PolarHBondContact O-N 3.36Å; D831-S833 VanDerWaalsContact CG-OG 3.3Å; D831-S833 PolarHBondContact O-N 2.81Å; D831-S833 WeakPolarHBondContact OD1-CB 3.37Å; D831-S833 PolarHBondContact OD1-N 3.23Å; D831-S833 PolarHBondContact OD1-OG 3.01Å; D831-S833 PolarHBondContact OD2-OG 3.45Å
832	V	31.2	Very low	31.8	Very low	141 Å²	141	140.2 Å²	140.2	86%	0.855	76%	0.762	S	S	*	*			trans	-84.8	53.9	-177.6	-167.3	0	0	0	0	110.7	I830	I830-V832 PolarHBondContact O-N 2.92Å
833	S	29.5	Very low	32	Very low	76 Å²	76	139.3 Å²	139.3	53%	0.531	76%	0.758	S	S	.	*			trans	-149.9	41.5	-174.9	76	0	0	0	0	117.9	D831	D831-S833 VanDerWaalsContact CG-OG 3.3Å; D831-S833 PolarHBondContact O-N 2.81Å; D831-S833 WeakPolarHBondContact OD1-CB 3.37Å; D831-S833 PolarHBondContact OD1-N 3.23Å; D831-S833 PolarHBondContact OD1-OG 3.01Å; D831-S833 PolarHBondContact OD2-OG 3.45Å
834	K	29.7	Very low	32.2	Very low	180 Å²	180	139.2 Å²	139.2	78%	0.783	76%	0.764	S	S	*	*			trans	-151.1	79.7	171.1	-105.8	141.1	-170.2	164.2	0	116.4
835	L	31.7	Very low	32.1	Very low	180 Å²	180	139.2 Å²	139.2	94%	0.942	76%	0.761	S	S	*	*			trans	-136.9	98.2	153.2	-85.2	177.2	0	0	0	109.9
836	T	33.3	Very low	32.1	Very low	113 Å²	113	139 Å²	139	69%	0.693	76%	0.764	S	S	*	*			trans	-87.7	131.5	179.9	46.1	0	0	0	0	111.7
837	P	30.3	Very low	31.8	Very low	130 Å²	130	139.3 Å²	139.3	84%	0.844	77%	0.767	S	S	*	*			trans	-83.7	118.3	-176.8	31.9	-33.9	0	0	0	113.1
838	I	34.6	Very low	31.9	Very low	143 Å²	143	142 Å²	142	73%	0.733	78%	0.775	S	S	*	*			trans	-148.3	128.6	179.7	-64.6	-178.3	0	0	0	106.1
839	H	34.3	Very low	32.2	Very low	174 Å²	174	141.9 Å²	141.9	81%	0.806	77%	0.77	S	S	*	*			cis	-151.3	170.8	0.4	-151.7	-105.5	0	0	0	111.3
840	H	31.7	Very low	32.2	Very low	167 Å²	167	141.7 Å²	141.7	77%	0.773	77%	0.769	S	S	*	*			trans	-78.4	147.7	173.8	-82.8	-74.2	0	0	0	114.4
841	N	34.9	Very low	32	Very low	149 Å²	149	139.4 Å²	139.4	80%	0.797	77%	0.766	S	S	*	*			trans	156.8	146.5	139.9	-83.5	-31.6	0	0	0	110.3
842	K	32.1	Very low	32.1	Very low	194 Å²	194	139.8 Å²	139.8	84%	0.843	77%	0.772	S	S	*	*			cis	-159.1	163.4	-19	-132.4	-155.3	175.2	-175.5	0	107.4
843	P	33.5	Very low	32.1	Very low	106 Å²	106	139.2 Å²	139.2	69%	0.688	77%	0.768	S	S	*	*			trans	-108.3	153.9	-166.1	39.3	-33.8	0	0	0	117.3
844	T	33.3	Very low	32.2	Very low	133 Å²	133	142.6 Å²	142.6	82%	0.816	78%	0.781	S	S	*	*			trans	-152.4	121.8	155.1	3.6	0	0	0	0	105.2
845	V	29	Very low	32.3	Very low	122 Å²	122	140.8 Å²	140.8	74%	0.739	78%	0.779	S	S	*	*				63.7	92.7	50.3	-171.5	0	0	0	0	112.2
846	L	31.5	Very low	32.1	Very low	151 Å²	151	138 Å²	138	79%	0.791	76%	0.764	S	S	*	*				-178.9	101.7	126.1	-96	170.9	0	0	0	109
847	T	27.7	Very low	31.7	Very low	148 Å²	148	142.4 Å²	142.4	91%	0.908	77%	0.768	S	S	*	*			trans	-109.6	117.3	158.2	48.1	0	0	0	0	106.6
848	D	34	Very low	31.6	Very low	137 Å²	137	141.9 Å²	141.9	73%	0.733	76%	0.763	S	S	*	*			trans	-127	-178.4	177.7	-145.8	-22.2	0	0	0	109.3
849	E	35.5	Very low	31.3	Very low	167 Å²	167	140.6 Å²	140.6	78%	0.78	76%	0.762	S	S	*	*			trans	66.3	95.3	179.7	-65.6	-55.7	137.2	0	0	115.9
850	S	31.5	Very low	31.1	Very low	100 Å²	100	138.1 Å²	138.1	70%	0.699	76%	0.759	S	S	*	*			trans	-76.2	157.7	168.9	61.5	0	0	0	0	113.7
851	S	32.3	Very low	31	Very low	105 Å²	105	134.8 Å²	134.8	73%	0.734	76%	0.755	S	S	*	*			trans	106.5	150.8	137.1	86	0	0	0	0	120.7
852	V	32.9	Very low	31	Very low	120 Å²	120	134.6 Å²	134.6	73%	0.727	76%	0.759	S	S	*	*			trans	59.1	86.1	163.1	-160.4	0	0	0	0	119.6
853	V	30.1	Very low	30.8	Very low	128 Å²	128	130.8 Å²	130.8	78%	0.776	75%	0.752	S	S	*	*				24.7	104.5	120.7	-174	0	0	0	0	117.7
854	N	32.3	Very low	30.8	Very low	147 Å²	147	132.8 Å²	132.8	79%	0.786	76%	0.757	S	S	*	*			trans	171.5	164.6	149.1	-92.2	-36.6	0	0	0	107.2
855	L	31.5	Very low	30.8	Very low	142 Å²	142	131.3 Å²	131.3	74%	0.743	75%	0.752	S	S	*	*			cis	-171.1	138.8	-23.2	168.2	62.2	0	0	0	105.7
856	L	27.6	Very low	30.9	Very low	122 Å²	122	132 Å²	132	64%	0.639	75%	0.751	S	S	*	*			trans	30.9	115	158.8	-125.9	73.2	0	0	0	121.3
857	R	25.8	Very low	31.1	Very low	205 Å²	205	132.4 Å²	132.4	77%	0.774	75%	0.748	S	S	*	*				28.4	115.8	127.3	177.8	-139.6	-66.4	153.1	-2.5	119.7
858	T	28.1	Very low	31.5	Very low	120 Å²	120	131.2 Å²	131.2	74%	0.736	74%	0.736	S	S	*	*			trans	-165.5	128.7	134.1	18.1	0	0	0	0	109.6
859	T	28	Very low	31.5	Very low	116 Å²	116	131 Å²	131	71%	0.712	73%	0.734	S	S	*	*				48.7	138.4	100.4	70	0	0	0	0	115.2
860	T	30.3	Very low	31.6	Very low	122 Å²	122	131.1 Å²	131.1	75%	0.748	73%	0.734	S	S	*	*				-159.1	138.7	51.3	37.8	0	0	0	0	116.1
861	S	28.7	Very low	31.6	Very low	97 Å²	97	132.7 Å²	132.7	68%	0.678	74%	0.735	S	S	*	*			trans	16.2	145.4	138.6	64.4	0	0	0	0	124.1
862	T	34.5	Very low	31.7	Very low	145 Å²	145	133.8 Å²	133.8	89%	0.89	74%	0.737	S	S	*	*				-152.5	162.8	116.4	12.6	0	0	0	0	111.3
863	T	29.8	Very low	31.7	Very low	114 Å²	114	133.1 Å²	133.1	70%	0.699	74%	0.738	S	S	*	*			trans	-140.7	-176	-167.1	57.5	0	0	0	0	112.9
864	N	33.2	Very low	32	Very low	147 Å²	147	132.3 Å²	132.3	79%	0.786	74%	0.738	S	S	*	*			trans	85.3	146.7	171.3	-43.8	-14	0	0	0	112.6
865	S	32.8	Very low	32.2	Very low	103 Å²	103	128.5 Å²	128.5	72%	0.72	73%	0.734	S	S	*	*			cis	160.3	163.1	-3.6	63.9	0	0	0	0	104.2
866	I	31.8	Very low	32.1	Very low	137 Å²	137	130 Å²	130	70%	0.703	74%	0.741	S	S	*	*			cis	-171.3	164.4	4	-126.4	168.9	0	0	0	107.7
867	H	35.8	Very low	32	Very low	159 Å²	159	134.4 Å²	134.4	74%	0.736	75%	0.751	S	S	*	*			trans	60.6	145.5	168.6	-77.8	-58.9	0	0	0	117.3
868	D	34.5	Very low	32.1	Very low	122 Å²	122	129.7 Å²	129.7	65%	0.652	75%	0.745	S	S	*	*			cis	-173.2	168.5	13.6	-118.7	-15.8	0	0	0	114.6
869	L	35.6	Very low	32.1	Very low	133 Å²	133	131.3 Å²	131.3	70%	0.696	75%	0.748	S	S	*	*			trans	60.2	108.5	153.3	-90.4	79.3	0	0	0	125.2
870	H	37	Very low	32.3	Very low	169 Å²	169	132.9 Å²	132.9	78%	0.782	75%	0.75	S	S	*	*				77.1	105.8	120.6	-85	-125.2	0	0	0	124.7
871	N	30.3	Very low	32.3	Very low	133 Å²	133	133.5 Å²	133.5	71%	0.711	75%	0.749	S	S	*	*				84.6	103.6	111.8	-167	34.3	0	0	0	122.5
872	T	35.5	Very low	32.4	Very low	128 Å²	128	135.5 Å²	135.5	79%	0.785	75%	0.748	S	S	*	*				-177.9	119.7	127.6	19.8	0	0	0	0	109.1
873	S	33.7	Very low	32.3	Very low	107 Å²	107	136 Å²	136	75%	0.748	74%	0.74	S	S	*	*				66.5	125.3	91.6	-156.7	0	0	0	0	114.9
874	S	35.9	Very low	32.3	Very low	111 Å²	111	135.3 Å²	135.3	78%	0.776	74%	0.739	S	S	*	*			cis	-172.6	161	-4.4	41.8	0	0	0	0	112.1
875	G	36	Very low	32.4	Very low	67 Å²	67	135.5 Å²	135.5	69%	0.691	74%	0.74	S	S	*	*			trans	89.1	78	161.7	0	0	0	0	0	116.2
876	L	29.9	Very low	32.3	Very low	172 Å²	172	136.3 Å²	136.3	90%	0.901	74%	0.736	S	S	*	*				91.8	137.8	59.7	-71.3	176	0	0	0	115.8
877	Y	24.3	Very low	32.2	Very low	215 Å²	215	135.7 Å²	135.7	84%	0.843	73%	0.734	S	S	*	*			trans	-150.9	-177.9	-172.4	-134.2	-93.5	0	0	0	106.7
878	T	29.2	Very low	32.2	Very low	106 Å²	106	134.8 Å²	134.8	65%	0.65	74%	0.735	S	S	*	*			trans	75.5	136.1	173	-12.9	0	0	0	0	112.4	I880	T878-I880 HydrophobicContact CG2-CD1 4.42Å
879	I	27	Very low	32	Very low	154 Å²	154	137.9 Å²	137.9	79%	0.79	75%	0.745	S	S	*	*			cis	71.1	150.3	38.3	-53.6	171.4	0	0	0	111.8
880	I	33.2	Very low	31.8	Very low	149 Å²	149	138.8 Å²	138.8	76%	0.764	75%	0.75	S	S	*	*			trans	97.6	123.3	-167.6	-58.1	158.2	0	0	0	110.6	T878	T878-I880 HydrophobicContact CG2-CD1 4.42Å
881	N	30	Very low	31.6	Very low	136 Å²	136	136.4 Å²	136.4	73%	0.727	75%	0.749	S	S	*	*			cis	111.5	125.6	11.4	-166.8	70	0	0	0	113.6
882	E	30.1	Very low	31.5	Very low	139 Å²	139	135.5 Å²	135.5	65%	0.65	74%	0.742	S	S	*	*			trans	70.3	134.9	166.2	-72	-71.4	94.4	0	0	122.5
883	Q	32.1	Very low	31.1	Very low	155 Å²	155	139.1 Å²	139.1	72%	0.724	74%	0.743	S	S	*	*			trans	75.2	96.3	143.2	-69.3	173.5	34.5	0	0	123.8
884	S	30.8	Very low	30.9	Very low	99 Å²	99	138.9 Å²	138.9	69%	0.692	74%	0.742	S	S	*	*				107.2	143.6	111.5	82.7	0	0	0	0	120.6
885	L	34.1	Very low	30.6	Very low	152 Å²	152	142.8 Å²	142.8	80%	0.796	75%	0.747	S	S	*	*			trans	61.4	132.1	155.7	-64.7	164.1	0	0	0	118.9
886	N	31.1	Very low	30.3	Very low	120 Å²	120	143.1 Å²	143.1	64%	0.642	75%	0.751	S	S	*	*			cis	-163.8	167.9	-13.2	-154.6	2.1	0	0	0	110.5
887	N	31	Very low	30.3	Very low	123 Å²	123	138.4 Å²	138.4	66%	0.658	74%	0.744	S	S	*	*			trans	63.2	121.4	162.4	-56.1	-27.9	0	0	0	116.8
888	N	34.2	Very low	30.5	Very low	141 Å²	141	134.7 Å²	134.7	75%	0.754	74%	0.739	S	S	*	*			cis	-149.8	139	34.8	-77.9	-59.6	0	0	0	114.7
889	Q	31.2	Very low	30.6	Very low	187 Å²	187	133.1 Å²	133.1	87%	0.874	73%	0.729	S	S	*	*			trans	57.5	86	147.3	-69.1	178.3	-23	0	0	121.4
890	L	30.8	Very low	30.8	Very low	151 Å²	151	128.7 Å²	128.7	79%	0.791	71%	0.706	S	S	*	*			trans	-73	180	136.4	-78.3	170.6	0	0	0	110.2	M892	L890-M892 HydrophobicContact CD2-CG 4.05Å
891	P	33.4	Very low	30.5	Very low	119 Å²	119	126.7 Å²	126.7	77%	0.773	69%	0.69	S	S	*	*			cis	-133.6	177.2	28	36.7	-14	0	0	0	115.8
892	M	27.6	Very low	30.6	Very low	114 Å²	114	125.9 Å²	125.9	56%	0.562	68%	0.682	S	S	*	*			cis	93	133.6	17.4	-70.9	-65.3	-62.5	0	0	118.5	L890	L890-M892 HydrophobicContact CD2-CG 4.05Å
893	Y	28.3	Very low	30.6	Very low	204 Å²	204	127.2 Å²	127.2	80%	0.8	68%	0.681	S	S	*	*			trans	67.1	158.1	168.2	-60.6	-62.1	0	0	0	117.3
894	S	29.7	Very low	30.5	Very low	103 Å²	103	125.9 Å²	125.9	72%	0.72	68%	0.675	S	S	*	*			cis	-154.5	175.5	-9.3	-126.9	0	0	0	0	114.3
895	E	29.4	Very low	30.5	Very low	192 Å²	192	129 Å²	129	90%	0.897	68%	0.678	S	S	*	*			trans	-33.1	142.7	159.8	180	175.4	-136.6	0	0	118.1
896	G	28.8	Very low	30.4	Very low	75 Å²	75	125.5 Å²	125.5	77%	0.773	67%	0.667	S	S	*	*			trans	124.5	123.3	149.5	0	0	0	0	0	118.9
897	G	29.7	Very low	30.5	Very low	73 Å²	73	128.9 Å²	128.9	75%	0.753	68%	0.676	S	S	*	*			trans	87.2	94.8	141.7	0	0	0	0	0	120.5
898	N	29.6	Very low	30.7	Very low	137 Å²	137	129.5 Å²	129.5	73%	0.733	68%	0.684	S	S	*	*				55.4	103.1	129.8	-81.7	-15.6	0	0	0	121.6	E357	E357-N898 WeakPolarHBondContact CB-O 3.12Å; E357-N898 WeakPolarHBondContact CG-O 3.41Å
899	V	30.2	Very low	30.5	Very low	73 Å²	73	127.8 Å²	127.8	44%	0.442	69%	0.69	S	S	.	*				151.3	0	112.2	107.1	0	0	0	0	122.4	H356 E357	H356-V899 VanDerWaalsContact CA-CG1 3.44Å; H356-V899 HydrophobicContact CB-CB 3.42Å; H356-V899 VanDerWaalsContact CB-CB 3.42Å; H356-V899 HydrophobicContact CB-CG1 3.78Å; H356-V899 HydrophobicContact CB-CG2 3.22Å; H356-V899 WeakPolarHBondContact CB-O 3.34Å; H356-V899 WeakPolarHBondContact CD2-CG2 3.44Å; H356-V899 VanDerWaalsContact ND1-CG2 3.3Å; H356-V899 WeakPolarHBondContact ND1-CG2 3.06Å; H356-V899 PolarHBondContact ND1-O 2.89Å; E357-V899 HydrophobicContact CB-CG1 4.45Å
900	I	30.7	Very low	30.7	Very low	60 Å²	60	122.8 Å²	122.8	31%	0.308	69%	0.688	S	S	.	*				0	-133	0	-135.9	-139.5	0	0	0	124.8	H356 E357 S358	H356-I900 VanDerWaalsContact CB-CA 3.42Å; H356-I900 HydrophobicContact CB-CB 4.48Å; H356-I900 WeakPolarHBondContact O-CG1 3.47Å; E357-I900 VanDerWaalsContact CA-CB 3.49Å; E357-I900 HydrophobicContact CB-CB 3.44Å; E357-I900 VanDerWaalsContact CB-CB 3.44Å; E357-I900 HydrophobicContact CB-CG1 4.5Å; E357-I900 HydrophobicContact CB-CG2 3.81Å; E357-I900 HydrophobicContact CG-CB 4.41Å; E357-I900 PolarHBondContact OE2-N 2.89Å; S358-I900 WeakPolarHBondContact OG-CG2 3.17Å
901	Y	27.6	Very low	30.7	Very low	108 Å²	108	120.6 Å²	120.6	42%	0.424	69%	0.691	S	S	.	*			trans	-177.9	130.3	-145.1	-113.5	-4	0	0	0	110.5	V355	V355-Y901 HydrophobicContact CB-CD1 4.42Å; V355-Y901 HydrophobicContact CB-CD2 3.95Å; V355-Y901 HydrophobicContact CB-CE1 4.05Å; V355-Y901 HydrophobicContact CB-CE2 3.56Å; V355-Y901 HydrophobicContact CB-CG 4.36Å; V355-Y901 HydrophobicContact CG1-CD1 3.98Å; V355-Y901 HydrophobicContact CG1-CD2 4.24Å; V355-Y901 HydrophobicContact CG1-CE1 3.88Å; V355-Y901 HydrophobicContact CG1-CE2 4.18Å; V355-Y901 HydrophobicContact CG1-CG 4.14Å; V355-Y901 HydrophobicContact CG2-CE1 4.2Å; V355-Y901 HydrophobicContact CG2-CE2 4.08Å; V355-Y901 WeakPolarHBondContact CG2-OH 3.29Å; V355-Y901 WeakPolarHBondContact O-CD2 3.38Å
902	Q	31.9	Very low	30.5	Very low	118 Å²	118	120 Å²	120	55%	0.551	70%	0.697	S	S	*	*			trans	69.9	137.1	139.2	-105.1	155.5	96.5	0	0	118.9
903	R	29.9	Very low	30.7	Very low	167 Å²	167	118.6 Å²	118.6	63%	0.63	70%	0.703	S	S	*	*			cis	-164.9	121.8	35.7	-174.3	172.1	-145.6	91.4	38.5	114.2
904	E	30.8	Very low	30.7	Very low	128 Å²	128	117.4 Å²	117.4	60%	0.598	71%	0.707	S	S	*	*			trans	60.5	176.5	151.6	-64.8	164.6	-147.2	0	0	114.8
905	Q	30.8	Very low	30.7	Very low	164 Å²	164	116.3 Å²	116.3	77%	0.766	70%	0.699	S	S	*	*			cis	-152	154.2	-12.1	-128.1	174.9	92.9	0	0	104.1
906	S	32.4	Very low	30.8	Very low	79 Å²	79	113.5 Å²	113.5	55%	0.552	70%	0.696	S	S	*	*			cis	177.2	167.9	31.4	57.3	0	0	0	0	109.7
907	K	32.1	Very low	30.8	Very low	191 Å²	191	113.3 Å²	113.3	83%	0.83	69%	0.687	S	S	*	*			trans	66.6	152.1	158.3	-64.2	165.2	-177.3	173.5	0	116.9
908	T	35.4	Very low	30.8	Very low	135 Å²	135	115.7 Å²	115.7	83%	0.828	69%	0.687	S	S	*	*			cis	-141.5	158.2	1.6	-16.7	0	0	0	0	112.9
909	A	31	Very low	31.2	Very low	106 Å²	106	115.1 Å²	115.1	88%	0.876	69%	0.689	S	S	*	*			trans	-60.8	163	-179.4	0	0	0	0	0	117
910	G	34.7	Very low	31.3	Very low	81 Å²	81	118.5 Å²	118.5	84%	0.835	70%	0.704	S	S	*	*			trans	173.7	75.1	170.7	0	0	0	0	0	111.9
911	A	30.9	Very low	31.5	Very low	105 Å²	105	120 Å²	120	87%	0.868	72%	0.72	S	S	*	*			trans	-86	156.4	-175.4	0	0	0	0	0	113.2
912	A	30.3	Very low	31.9	Very low	108 Å²	108	119.5 Å²	119.5	89%	0.893	73%	0.733	S	S	*	*			trans	-69.7	150.4	-174.5	0	0	0	0	0	114.1
913	A	30.3	Very low	31.9	Very low	84 Å²	84	122.9 Å²	122.9	69%	0.694	75%	0.748	S	S	*	*			trans	-148.1	142.3	167.3	0	0	0	0	0	110
914	M	29.5	Very low	31.9	Very low	178 Å²	178	123.8 Å²	123.8	88%	0.877	76%	0.757	S	S	*	*			trans	68	148.4	160.1	-63.3	172.6	66.9	0	0	116.9
915	S	29.6	Very low	31.8	Very low	80 Å²	80	123.5 Å²	123.5	56%	0.559	77%	0.767	S	S	*	*			cis	-167	158.7	-14	-107.6	0	0	0	0	111.1
916	T	30.4	Very low	31.8	Very low	133 Å²	133	121.3 Å²	121.3	82%	0.816	76%	0.76	S	S	*	*			trans	56.8	148	146	54.5	0	0	0	0	120.8
917	A	29.3	Very low	31.6	Very low	72 Å²	72	124.9 Å²	124.9	60%	0.595	77%	0.768	S	S	*	*			cis	-172.6	-171.4	-16.8	0	0	0	0	0	107.8
918	T	30.1	Very low	31.4	Very low	122 Å²	122	124.2 Å²	124.2	75%	0.748	77%	0.772	S	S	*	*			trans	42.4	128.4	145.5	50.6	0	0	0	0	118.6
919	T	36.6	Very low	31	Very low	126 Å²	126	123.4 Å²	123.4	77%	0.773	77%	0.767	S	S	*	*			cis	178.6	169.7	32	2.2	0	0	0	0	106.6
920	D	33.7	Very low	30.7	Very low	144 Å²	144	122.4 Å²	122.4	77%	0.77	75%	0.754	S	S	*	*			cis	-155.7	177.5	4.6	-157.7	-1.1	0	0	0	110.6
921	S	34.9	Very low	30.2	Very low	92 Å²	92	129.3 Å²	129.3	64%	0.643	76%	0.755	S	S	*	*			trans	41	135.6	139	-170.7	0	0	0	0	121.2
922	S	36.2	Very low	30	Very low	97 Å²	97	130.2 Å²	130.2	68%	0.678	75%	0.745	S	S	*	*			cis	-159.7	143	-5.2	33.6	0	0	0	0	107.6
923	Q	31.8	Very low	29.8	Very low	188 Å²	188	131.8 Å²	131.8	88%	0.879	74%	0.738	S	S	*	*				58.8	97.6	65.6	-79.4	-165.3	-13.7	0	0	116.3
924	K	30.1	Very low	29.8	Very low	186 Å²	186	134.9 Å²	134.9	81%	0.809	74%	0.744	S	S	*	*				-160.9	121.3	118.8	-117	-172	-179.3	-170	0	113.2	I926	K924-I926 HydrophobicContact CD-CD1 4.22Å
925	C	28.8	Very low	29.7	Very low	122 Å²	122	131.4 Å²	131.4	82%	0.824	73%	0.732	S	S	*	*			trans	-82	154.9	146.7	-49	0	0	0	0	107.9
926	I	29	Very low	29.8	Very low	119 Å²	119	135.6 Å²	135.6	61%	0.61	75%	0.747	S	S	*	*			trans	-171.1	148.8	151.3	-108.4	153.5	0	0	0	113.2	K924	K924-I926 HydrophobicContact CD-CD1 4.22Å
927	E	30	Very low	29.8	Very low	153 Å²	153	132 Å²	132	72%	0.715	74%	0.736	S	S	*	*			trans	45.3	119.3	159.8	-73.9	148.8	-161.5	0	0	123.8
928	L	26	Very low	29.8	Very low	177 Å²	177	134.3 Å²	134.3	93%	0.927	75%	0.747	S	S	*	*				-69.2	108.6	129.1	-71.8	160.9	0	0	0	109.5
929	T	27.9	Very low	29.7	Very low	118 Å²	118	133 Å²	133	72%	0.724	74%	0.743	S	S	*	*			trans	-159.6	167.8	149.6	4.3	0	0	0	0	114.8
930	S	24.6	Very low	29.3	Very low	85 Å²	85	132.2 Å²	132.2	59%	0.594	74%	0.742	S	S	*	*			trans	-79	160.4	-171.6	52.3	0	0	0	0	117.2
931	W	24.5	Very low	29.1	Very low	227 Å²	227	134.2 Å²	134.2	86%	0.86	74%	0.744	S	S	*	*			trans	82.4	114.4	140.1	-73.9	-7.2	0	0	0	121.9
932	N	26.4	Very low	28.9	Very low	124 Å²	124	134.7 Å²	134.7	66%	0.663	75%	0.747	S	S	*	*				71.3	140.2	122.7	-67.8	10.2	0	0	0	122.3
933	N	26.2	Very low	28.9	Very low	140 Å²	140	134 Å²	134	75%	0.749	75%	0.747	S	S	*	*			trans	65.1	123.5	162.2	-52	-9.6	0	0	0	113.4
934	D	30.2	Very low	28.9	Very low	150 Å²	150	131.1 Å²	131.1	80%	0.802	74%	0.743	S	S	*	*				-152	174.9	57.3	-92.1	-38.8	0	0	0	111.1
935	T	27.4	Very low	29.1	Very low	104 Å²	104	128 Å²	128	64%	0.638	74%	0.74	S	S	*	*			cis	-173.3	170.9	-31.1	-93.7	0	0	0	0	105.9
936	I	32.5	Very low	29.3	Very low	169 Å²	169	126.9 Å²	126.9	87%	0.867	73%	0.729	S	S	*	*			trans	74.2	130.5	-175.3	-40.7	175.2	0	0	0	112.7
937	G	29.5	Very low	29.4	Very low	56 Å²	56	127 Å²	127	58%	0.577	74%	0.736	S	S	*	*			cis	153.3	151	-7.1	0	0	0	0	0	112.3
938	S	29.9	Very low	29.6	Very low	121 Å²	121	124.8 Å²	124.8	85%	0.846	73%	0.733	S	S	*	*			trans	66.8	152.9	176.2	80.9	0	0	0	0	116.7
939	S	27.6	Very low	29.9	Very low	94 Å²	94	122.1 Å²	122.1	66%	0.657	72%	0.724	S	S	*	*			cis	-169.3	126.3	-26	48.4	0	0	0	0	111.6
940	C	27.8	Very low	30.3	Very low	110 Å²	110	121.7 Å²	121.7	74%	0.743	72%	0.721	S	S	*	*			trans	62.9	173.8	155	-48.5	0	0	0	0	116.2
941	F	30.3	Very low	30.8	Very low	187 Å²	187	123.2 Å²	123.2	82%	0.82	73%	0.727	S	S	*	*			cis	-130.3	166.7	0.8	-117	-77.3	0	0	0	111.5
942	S	30.4	Very low	31.4	Very low	102 Å²	102	117.6 Å²	117.6	71%	0.713	72%	0.718	S	S	*	*			trans	-24.1	160.7	164.4	-51.9	0	0	0	0	118
943	A	35.3	Very low	31.8	Very low	82 Å²	82	117.5 Å²	117.5	68%	0.678	72%	0.722	S	S	*	*			cis	-159	147.9	40.4	0	0	0	0	0	112.6
944	T	32.6	Very low	32.3	Very low	128 Å²	128	115.2 Å²	115.2	79%	0.785	72%	0.717	S	S	*	*				67.3	120.7	98.3	-59.1	0	0	0	0	111.8
945	T	33.9	Very low	32.5	Very low	121 Å²	121	112.9 Å²	112.9	74%	0.742	71%	0.712	S	S	*	*			cis	177.7	164.3	17	-113.2	0	0	0	0	108.6
946	T	32.7	Very low	32.8	Very low	97 Å²	97	112.5 Å²	112.5	60%	0.595	71%	0.714	S	S	*	*			cis	-170.5	152.9	-21.4	-75.8	0	0	0	0	107.6
947	T	31.8	Very low	32.8	Very low	123 Å²	123	109.5 Å²	109.5	76%	0.755	71%	0.708	S	S	*	*			trans	64.8	159.9	162.8	42.9	0	0	0	0	118.9
948	T	33.8	Very low	33.1	Very low	106 Å²	106	111.5 Å²	111.5	65%	0.65	71%	0.713	S	S	*	*			cis	-151.4	138	6	-7.9	0	0	0	0	111.3
949	T	33.3	Very low	33.5	Very low	120 Å²	120	111.1 Å²	111.1	74%	0.736	71%	0.71	S	S	*	*			trans	46.5	155	137.8	55.7	0	0	0	0	122.1
950	T	35.3	Very low	34	Very low	109 Å²	109	110.2 Å²	110.2	67%	0.669	72%	0.716	S	S	*	*			cis	-158.9	163.8	22.3	-18.3	0	0	0	0	111.9
951	T	36.1	Very low	34.5	Very low	117 Å²	117	109.8 Å²	109.8	72%	0.718	71%	0.714	S	S	*	*			trans	62.4	135.2	148.9	46.9	0	0	0	0	121.3
952	T	36.1	Very low	35	Very low	110 Å²	110	109.6 Å²	109.6	68%	0.675	71%	0.713	S	S	*	*			cis	-170.9	147	-17.2	11.1	0	0	0	0	109.9
953	T	35.6	Very low	35.4	Very low	122 Å²	122	110.1 Å²	110.1	75%	0.748	71%	0.712	S	S	*	*			trans	49.4	147.7	144.3	58.9	0	0	0	0	122.5
954	S	35.8	Very low	35.3	Very low	91 Å²	91	113.3 Å²	113.3	64%	0.636	72%	0.716	S	S	*	*			cis	-177.5	172.1	-15.4	52.8	0	0	0	0	109.4
955	S	34.7	Very low	35.6	Very low	101 Å²	101	110.7 Å²	110.7	71%	0.706	72%	0.715	S	S	*	*			trans	53.9	145.9	140.7	60.3	0	0	0	0	121.6
956	S	33.9	Very low	35.5	Very low	97 Å²	97	115.5 Å²	115.5	68%	0.678	72%	0.719	S	S	*	*			cis	178.5	175.5	-13.8	52.1	0	0	0	0	108
957	S	33.7	Very low	35.7	Very low	105 Å²	105	117.8 Å²	117.8	73%	0.734	73%	0.727	S	S	*	*			trans	62.4	151	148.9	45.6	0	0	0	0	120
958	S	35.7	Very low	35.8	Very low	99 Å²	99	120.7 Å²	120.7	69%	0.692	73%	0.732	S	S	*	*			cis	-170.5	171.4	-15.5	52.1	0	0	0	0	110.6
959	S	36.4	Very low	36	Very low	112 Å²	112	119.2 Å²	119.2	78%	0.783	74%	0.738	S	S	*	*			trans	47.6	112.4	147.2	58.3	0	0	0	0	119.1
960	G	38.3	Very low	35.9	Very low	75 Å²	75	121.5 Å²	121.5	77%	0.773	75%	0.746	S	S	*	*				127.7	170.6	74.4	0	0	0	0	0	109.2
961	S	39.5	Very low	36.2	Very low	101 Å²	101	120.9 Å²	120.9	71%	0.706	74%	0.744	S	S	*	*			cis	-163.6	153.7	7.4	-138.9	0	0	0	0	110.6
962	K	39.5	Very low	36	Very low	184 Å²	184	121.2 Å²	121.2	80%	0.8	75%	0.746	S	S	*	*			trans	38.9	140.7	133.6	-67.7	176.2	-177.4	177.4	0	120.1
963	T	38.6	Very low	35.6	Very low	112 Å²	112	121.6 Å²	121.6	69%	0.687	75%	0.753	S	S	*	*			cis	-168.4	125.9	39.6	-102.3	0	0	0	0	107.9
964	I	34.8	Very low	35.3	Very low	150 Å²	150	121 Å²	121	77%	0.769	75%	0.754	S	S	*	*				64.8	127.6	89.3	-57.1	160.4	0	0	0	115.8
965	G	38.6	Very low	35.2	Very low	73 Å²	73	121 Å²	121	75%	0.753	75%	0.753	S	S	*	*			trans	142	73.8	170.6	0	0	0	0	0	113
966	R	31.7	Very low	34.8	Very low	222 Å²	222	122.2 Å²	122.2	84%	0.838	76%	0.757	S	S	*	*			cis	85.6	141.8	49.9	-158.6	-172.7	-165.2	-171.8	6.6	112.5
967	L	36.6	Very low	34.9	Very low	144 Å²	144	123 Å²	123	75%	0.754	76%	0.757	S	S	*	*			trans	83.7	148	176.7	-50.5	175.3	0	0	0	115.6
968	Q	34	Very low	34.5	Very low	184 Å²	184	124.8 Å²	124.8	86%	0.86	76%	0.758	S	S	*	*			cis	170	120.3	-39.8	161.9	172.2	-5.9	0	0	107.2
969	G	37.5	Very low	34.3	Very low	76 Å²	76	128.7 Å²	128.7	78%	0.784	76%	0.762	S	S	*	*			trans	-173.7	103.6	-179.7	0	0	0	0	0	110.9
970	N	30.9	Very low	33.9	Very low	167 Å²	167	129.9 Å²	129.9	89%	0.893	76%	0.76	S	S	*	*			trans	-92.3	172.2	-173.2	-126.2	15.2	0	0	0	111.5
971	P	42.7	Very low	33.3	Very low	97 Å²	97	133.8 Å²	133.8	63%	0.63	76%	0.763	S	S	*	*			trans	-91.2	-173.8	-164.5	39.7	-39.1	0	0	0	112.6
972	T	30.7	Very low	33.5	Very low	124 Å²	124	134.5 Å²	134.5	76%	0.761	77%	0.765	S	S	*	*				164.8	146.2	127.8	35.6	0	0	0	0	112.3
973	S	29.1	Very low	33.3	Very low	117 Å²	117	131.4 Å²	131.4	82%	0.818	76%	0.764	S	S	*	*			trans	66.3	164.4	158.1	86.9	0	0	0	0	116.7
974	S	28.9	Very low	32.8	Very low	111 Å²	111	133.4 Å²	133.4	78%	0.776	77%	0.771	S	S	*	*			cis	-154.4	176.7	-4.5	-153	0	0	0	0	110.5
975	S	33.6	Very low	32.7	Very low	89 Å²	89	130.8 Å²	130.8	62%	0.622	77%	0.771	S	S	*	*			trans	65.3	112.9	167.3	-157.5	0	0	0	0	115.4
976	V	27	Very low	32.5	Very low	128 Å²	128	137.1 Å²	137.1	78%	0.776	78%	0.778	S	S	*	*			cis	65.5	81.6	20.2	-164.4	0	0	0	0	114.7	L978	V976-L978 HydrophobicContact CG1-CD1 4.29Å
977	V	34.6	Very low	32.6	Very low	114 Å²	114	134.8 Å²	134.8	69%	0.691	77%	0.769	S	S	*	*			trans	-133	115.9	156.7	179.9	0	0	0	0	109.2	F979	V977-F979 HydrophobicContact CG1-CD2 3.78Å; V977-F979 HydrophobicContact CG1-CE2 4.13Å
978	L	26	Very low	32.4	Very low	142 Å²	142	134 Å²	134	74%	0.743	77%	0.773	S	S	*	*			trans	-99.8	124.3	165.9	-66.7	90.7	0	0	0	109.7	V976	V976-L978 HydrophobicContact CG1-CD1 4.29Å
979	F	30.4	Very low	32.4	Very low	180 Å²	180	130.4 Å²	130.4	79%	0.789	75%	0.751	S	S	*	*			trans	-147.5	120.4	153.9	-76.1	-80	0	0	0	107.2	V977	V977-F979 HydrophobicContact CG1-CD2 3.78Å; V977-F979 HydrophobicContact CG1-CE2 4.13Å
980	N	28	Very low	32.2	Very low	138 Å²	138	136.6 Å²	136.6	74%	0.738	76%	0.757	S	S	*	*				84.6	134.9	60.8	-72.6	-40	0	0	0	113.7
981	N	27.1	Very low	32.3	Very low	156 Å²	156	134.8 Å²	134.8	83%	0.834	74%	0.743	S	S	*	*			trans	-78.5	-173.8	-177.2	-58.9	-73	0	0	0	112.6
982	P	42.7	Very low	32	Very low	116 Å²	116	138 Å²	138	75%	0.753	75%	0.754	S	S	*	*				-112.6	-169.7	-74.2	38.1	-23.2	0	0	0	110.6
983	P	36.6	Very low	32	Very low	120 Å²	120	136.2 Å²	136.2	78%	0.779	75%	0.747	S	S	*	*				-158.1	146.6	98.6	38.3	-18.2	0	0	0	119.4
984	N	27.8	Very low	32.2	Very low	154 Å²	154	136 Å²	136	82%	0.824	75%	0.746	S	S	*	*			trans	7.7	121	137.8	-172.2	7	0	0	0	121.1
985	A	32.9	Very low	32.3	Very low	94 Å²	94	136.9 Å²	136.9	78%	0.777	75%	0.751	S	S	*	*			trans	-153.2	87.1	161.2	0	0	0	0	0	116
986	K	33.3	Very low	32.2	Very low	207 Å²	207	138.8 Å²	138.8	90%	0.9	76%	0.759	S	S	*	*			trans	50.1	136.9	145.4	-62.6	-178	179.5	178.5	0	123.2
987	R	33.5	Very low	32.3	Very low	172 Å²	172	137.7 Å²	137.7	65%	0.649	76%	0.758	S	S	*	*			trans	-94.3	174.3	174	-144.2	-171.6	-158.8	-179.7	5.5	110.9
988	P	34.2	Very low	32.1	Very low	128 Å²	128	136.8 Å²	136.8	83%	0.831	76%	0.756	S	S	*	*				-141.4	172.7	90.8	37	-21.9	0	0	0	115.4
989	R	32.5	Very low	32.2	Very low	109 Å²	109	136.5 Å²	136.5	41%	0.411	76%	0.76	S	S	.	*			trans	-140.5	149.7	174.3	-169.7	-165.7	-156.4	174.4	14.2	107.2	S353 K354 E991	S353-R989 PolarHBondContact O-NH2 3.3Å; K354-R989 PolarHBondContact O-NH1 2.86Å; R989-E991 VanDerWaalsContact CD-OE1 3.29Å; R989-E991 WeakPolarHBondContact CD-OE1 3.29Å; R989-E991 HydrophobicContact CG-CG 4.36Å; R989-E991 IonicContact CZ-OE1 3.16Å; R989-E991 IonicContact NE-OE1 3.3Å; R989-E991 PolarHBondContact NE-OE1 2.67Å; R989-E991 IonicContact NH1-OE1 2.67Å; R989-E991 PolarHBondContact NH1-OE1 3.3Å
990	F	34.8	Very low	32.3	Very low	205 Å²	205	132.1 Å²	132.1	90%	0.899	76%	0.758	S	S	*	*			trans	-129.2	156	157.5	-100.3	-84.9	0	0	0	108.7
991	E	31	Very low	32.3	Very low	130 Å²	130	130.8 Å²	130.8	61%	0.607	76%	0.759	S	S	*	*			trans	-134.3	169.9	-174.9	-56.5	-173.8	-179.8	0	0	109.4	R989	R989-E991 VanDerWaalsContact CD-OE1 3.29Å; R989-E991 WeakPolarHBondContact CD-OE1 3.29Å; R989-E991 HydrophobicContact CG-CG 4.36Å; R989-E991 IonicContact CZ-OE1 3.16Å; R989-E991 IonicContact NE-OE1 3.3Å; R989-E991 PolarHBondContact NE-OE1 2.67Å; R989-E991 IonicContact NH1-OE1 2.67Å; R989-E991 PolarHBondContact NH1-OE1 3.3Å
992	L	36.5	Very low	32.6	Very low	164 Å²	164	131 Å²	131	86%	0.859	76%	0.758	S	S	*	*				-175.9	153.6	128.5	-98.1	159.8	0	0	0	113.6
993	S	32.4	Very low	32	Very low	87 Å²	87	133.6 Å²	133.6	61%	0.608	76%	0.761	S	S	*	*			trans	-23.8	142.1	165.6	48.4	0	0	0	0	118.1
994	S	31.6	Very low	31.7	Very low	113 Å²	113	133 Å²	133	79%	0.79	76%	0.759	S	S	*	*			cis	82.8	111.7	36.4	82.4	0	0	0	0	116.6
995	S	32	Very low	31.9	Very low	128 Å²	128	131.1 Å²	131.1	90%	0.895	76%	0.758	S	S	*	*			trans	-166.8	165.7	149.5	55.1	0	0	0	0	112.2
996	T	30.7	Very low	31.9	Very low	129 Å²	129	138.9 Å²	138.9	79%	0.791	78%	0.778	S	S	*	*			trans	-105	160.4	-158.4	48.3	0	0	0	0	115.7
997	S	29.7	Very low	31.8	Very low	106 Å²	106	135.5 Å²	135.5	74%	0.741	77%	0.772	S	S	*	*				112.4	140.9	129.5	81.3	0	0	0	0	121.2
998	S	29.6	Very low	31.7	Very low	94 Å²	94	133.6 Å²	133.6	66%	0.657	78%	0.778	S	S	*	*			trans	83.6	104.2	138.6	-61.8	0	0	0	0	123.8
999	T	29.4	Very low	31.6	Very low	136 Å²	136	133.9 Å²	133.9	83%	0.834	78%	0.775	S	S	*	*				77.6	160.1	125.8	60.3	0	0	0	0	122.2
1000	A	31.8	Very low	31.5	Very low	89 Å²	89	135.4 Å²	135.4	74%	0.736	80%	0.797	S	S	*	*			trans	67.7	121.1	-173.3	0	0	0	0	0	114.2
1001	S	29.4	Very low	31.3	Very low	109 Å²	109	131 Å²	131	76%	0.762	79%	0.791	S	S	*	*			cis	77.4	146.1	36.5	-52.3	0	0	0	0	114.1
1002	I	32.1	Very low	31.4	Very low	160 Å²	160	131.1 Å²	131.1	82%	0.821	80%	0.803	S	S	*	*			trans	76	136.1	179.8	-53.2	169.7	0	0	0	113
1003	E	30.1	Very low	31	Very low	172 Å²	172	128.7 Å²	128.7	80%	0.804	80%	0.799	S	S	*	*			cis	-160.4	169.3	-27.4	-171.6	153.6	-174.3	0	0	108.6
1004	S	29.9	Very low	30.9	Very low	106 Å²	106	131.9 Å²	131.9	74%	0.741	81%	0.813	S	S	*	*			trans	-66.8	130.2	174.3	175.6	0	0	0	0	112.6
1005	S	32.3	Very low	30.8	Very low	116 Å²	116	133.5 Å²	133.5	81%	0.811	82%	0.815	S	S	*	*			trans	-173	95.7	145.8	-81.3	0	0	0	0	111.9
1006	H	33.3	Very low	30.7	Very low	257 Å²	257	134 Å²	134	100%	1.19	81%	0.808	S	S	*	*				-163.3	0	103.2	-137	-51.1	0	0	0	113.6

Retrieved 1,006 of 1,006 residues in 123.9 ms (Link to these results)

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