A0A5K4EK33_SCHMA Loading...

Putative serine-rich repeat protein 2

AlphaFold DB , UniProt , Accession A0A5K4EK33, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,120 aa.

						>A0A5K4EK33_SCHMA|A0A5K4EK33
MDKKLNTTLFHPALINLTTHLFHNIIEHKINTQNFKCLGLQSIDYEQKENQIEVVLQFDIISSSSSSSSSSSSSSSSSSTNNSLVNNNNTYTECDYTNLFVDRLTEQITPNERKFYNSFNHASSVKHIIDHIYTTNQVTSTDCPKEKQNVTKINSPFVTIVVCCCILTTFFLLVLFLRCRSFIRRKQLLKRRRNPKYLYCSKYSKSKPINHCYIKANNSCYWSPAKPKHSNSFSVWSENQSLKYHQNKHRISSTSSLNQSSSMVNSIPQSRFYQSKNYSKDSNCIHHPYNSSNNVINNSNDRNFIKYNYHQHGEICGTGNHMNTGYLEHCKRINNTKSTMMYPISQRPSKQSNPLAIGNQPIFFNSQKITNENEITDSETPTTEFTESSKSHKSISQINVYRKGRSLSPADITNSKESKFLFSPKPRFSLAESDEMNDQPIENSQSSGFRDVIIDCSSLESAISYPVQNSCSHLNGNKNLDSSFDSRTYQSLMSVYLNDVAQKNRIITPTVTITTTNINNTLSENNTSTNHNICLDNTNYNNVITLPPLNIPNTDTGIIDDGLYNTEKMNSFESNQSTFSINIHHDHIGQHNNFTHDLQSPMIKEKPKRPVLCLFSANKYNQKRHLKRNNSITIDDNHDDNDINDDNNNNNGNIHDVKQDMDVRRLRQGTNISTTKLSVNNQINRITGSSNNINNNNDNICNHNLHLLLSSTNECKSCVNLQAYELSQDRYRNPSSGSTVSQIPRSDLPDVYLNPPSMSTLQSQRSSLCGRSRMELLYVDNELDRTNKPRCKLSTNGIISSSNLGENLSDVIDSDHCFSVQHTNGAGDNWSLVDELVIFPQPQTLGFVRNQTFNAKNTYHQPLPQPSLNLAPSFFKPYQLTDDNFGNLPVKDKEHHISIQQQLRRALSLSSRRKSPRSLNEEIQSIMDKHYEMTGIRMTIGSGSSQKNSTTTKSYINLFGLQTGNKTQPSRPRKRRCSWTFTKDITNEFQTSLKNVSSALHLDCPTFDLFQKKFKPNREKPSVLESLSMTALPCLIPLRPRIQSDATNDMTSINEEFIGRRPERKFHSDLNNIKLIDFRRNSMVTNDKSVIIYGIEKNIRLVKTYYVDTFFEIPSFKHKG
					

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	31.5	Very low	32.8	Very low	239 Å²	239	141.5 Å²	141.5	100%	1.177	71%	0.708	S	S	*	*				0	103.7	0	-74.2	-171.2	-179.5	0	0	109.4
2	D	29.7	Very low	33.5	Very low	156 Å²	156	136.4 Å²	136.4	83%	0.834	69%	0.693	S	S	*	*			trans	-96.8	100.6	-177.8	-72.4	-82.9	0	0	0	111.8	K4	D2-K4 PolarHBondContact O-N 2.96Å
3	K	31.4	Very low	34	Very low	208 Å²	208	127.3 Å²	127.3	90%	0.904	65%	0.651	S	S	*	*			trans	-68.4	86.9	160.6	-79.9	-171.5	174.4	-179.6	0	108.6	L5	K3-L5 PolarHBondContact O-N 3.21Å
4	K	31.5	Very low	34.7	Very low	186 Å²	186	122.7 Å²	122.7	81%	0.809	63%	0.628	S	S	*	*			trans	-52.5	103.6	167.8	-83	-177.7	176.8	174.8	0	108.5	D2 N6	D2-K4 PolarHBondContact O-N 2.96Å; K4-N6 VanDerWaalsContact C-N 3.34Å; K4-N6 PolarHBondContact O-N 2.95Å
5	L	31.2	Very low	35.7	Very low	148 Å²	148	116.3 Å²	116.3	78%	0.775	60%	0.595	S	S	*	*			trans	-72.9	90.8	178	-118.3	166	0	0	0	108.4	K3 T7	K3-L5 PolarHBondContact O-N 3.21Å; L5-T7 HydrophobicContact CD2-CG2 4.14Å; L5-T7 PolarHBondContact O-N 3.15Å; L5-T7 PolarHBondContact O-OG1 3.3Å
6	N	27.6	Very low	36.3	Very low	131 Å²	131	113.6 Å²	113.6	70%	0.701	58%	0.583	S	S	*	*			trans	-59.4	84.8	172.3	-86	-1.7	0	0	0	109.6	K4 T8	K4-N6 VanDerWaalsContact C-N 3.34Å; K4-N6 PolarHBondContact O-N 2.95Å; N6-T8 PolarHBondContact O-N 2.84Å
7	T	30	Very low	37	Very low	93 Å²	93	110.5 Å²	110.5	57%	0.571	57%	0.567	S	S	*	*			trans	-98.2	39.3	172.9	43.7	0	0	0	0	109.6	L5 L9	L5-T7 HydrophobicContact CD2-CG2 4.14Å; L5-T7 PolarHBondContact O-N 3.15Å; L5-T7 PolarHBondContact O-OG1 3.3Å; T7-L9 PolarHBondContact O-N 2.82Å
8	T	30.4	Very low	37.5	Very low	93 Å²	93	107.1 Å²	107.1	57%	0.571	55%	0.552	S	S	*	*			trans	-62.6	107.6	-179.1	37.3	0	0	0	0	111	N6	N6-T8 PolarHBondContact O-N 2.84Å
9	L	34.5	Very low	38.2	Very low	114 Å²	114	103.5 Å²	103.5	60%	0.597	54%	0.535	S	S	*	.	S	Bend	trans	61.7	-178.5	160.6	-66.5	76.6	0	0	0	115.5	T7	T7-L9 PolarHBondContact O-N 2.82Å
10	F	39.9	Very low	38.9	Very low	89 Å²	89	103.3 Å²	103.3	39%	0.39	53%	0.532	S	S	.	.	S	Bend	trans	-73.8	138.1	151.5	-81.7	-107	0	0	0	107.2	I15 I52 L177	F10-I15 HydrophobicContact CB-CD1 4Å; F10-I15 HydrophobicContact CB-CG1 4.12Å; F10-I52 HydrophobicContact CD2-CD1 3.76Å; F10-I52 HydrophobicContact CE2-CD1 3.81Å; F10-L177 HydrophobicContact CE1-CD2 4.18Å; F10-L177 HydrophobicContact CZ-CD2 3.81Å
11	H	43	Very low	39.4	Very low	99 Å²	99	101.6 Å²	101.6	46%	0.458	52%	0.523	S	S	.	.			trans	-63.4	132.4	173	-165.1	-92.6	0	0	0	108.6	A13 L14	H11-A13 WeakPolarHBondContact ND1-CB 3.34Å; H11-A13 PolarHBondContact ND1-N 2.82Å; H11-A13 PolarHBondContact O-N 2.81Å; H11-A13 VanDerWaalsContact O-N 3.17Å; H11-L14 WeakPolarHBondContact O-CB 3.31Å; H11-L14 PolarHBondContact O-N 3.49Å
12	P	41.2	Very low	40.3	Very low	81 Å²	81	95.5 Å²	95.5	53%	0.526	49%	0.49	S	S	.	.	H	α-helix	trans	-52.7	-41	-176.9	-29.9	36	0	0	0	113.1	L14 I15 N16	P12-L14 PolarHBondContact O-N 3.16Å; P12-L14 VanDerWaalsContact O-N 3.09Å; P12-I15 CarbonylContact O-C 3.6Å; P12-I15 WeakPolarHBondContact O-CA 3.04Å; P12-I15 PolarHBondContact O-N 3.24Å; P12-N16 PolarHBondContact O-N 3.2Å
13	A	39.5	Very low	41.2	Very low	18 Å²	18	92 Å²	92	15%	0.149	47%	0.469	C	S	.	.	H	α-helix	trans	-54.9	-27.9	174.3	0	0	0	0	0	114.7	H11 L17 E112	H11-A13 WeakPolarHBondContact ND1-CB 3.34Å; H11-A13 PolarHBondContact ND1-N 2.82Å; H11-A13 PolarHBondContact O-N 2.81Å; H11-A13 VanDerWaalsContact O-N 3.17Å; A13-L17 WeakPolarHBondContact O-CB 3.24Å; A13-L17 PolarHBondContact O-N 3.47Å; A13-E112 HydrophobicContact CB-CG 3.86Å; A13-E112 WeakPolarHBondContact CB-OE1 3.19Å
14	L	44.1	Very low	42	Very low	63 Å²	63	85.2 Å²	85.2	33%	0.33	44%	0.443	S	S	.	.	H	α-helix	trans	-81	-24.7	178.6	-137.2	166.3	0	0	0	111.7	H11 P12 T18	H11-L14 WeakPolarHBondContact O-CB 3.31Å; H11-L14 PolarHBondContact O-N 3.49Å; P12-L14 PolarHBondContact O-N 3.16Å; P12-L14 VanDerWaalsContact O-N 3.09Å; L14-T18 PolarHBondContact O-N 3.36Å; L14-T18 PolarHBondContact O-OG1 2.78Å
15	I	49.5	Very low	42.8	Very low	27 Å²	27	79.6 Å²	79.6	14%	0.138	42%	0.421	C	S	.	.	H	α-helix	trans	-79.3	-44.2	168.7	-62	176.2	0	0	0	109.5	F10 P12 L17 T18 T19 Y45	F10-I15 HydrophobicContact CB-CD1 4Å; F10-I15 HydrophobicContact CB-CG1 4.12Å; P12-I15 CarbonylContact O-C 3.6Å; P12-I15 WeakPolarHBondContact O-CA 3.04Å; P12-I15 PolarHBondContact O-N 3.24Å; I15-L17 PolarHBondContact O-N 3.02Å; I15-T18 PolarHBondContact O-N 3.13Å; I15-T18 PolarHBondContact O-OG1 3.07Å; I15-T18 VanDerWaalsContact O-OG1 3.11Å; I15-T19 HydrophobicContact CG2-CG2 4.4Å; I15-T19 WeakPolarHBondContact O-CB 3.4Å; I15-T19 WeakPolarHBondContact O-CG2 3.45Å; I15-T19 PolarHBondContact O-N 2.88Å; I15-T19 PolarHBondContact O-OG1 3.21Å; I15-Y45 HydrophobicContact CG2-CD1 4.4Å; I15-Y45 HydrophobicContact CG2-CE1 4.24Å
16	N	46.2	Very low	43.3	Very low	73 Å²	73	74.1 Å²	74.1	39%	0.39	39%	0.392	S	S	.	.	H	α-helix	trans	-60.3	-45.1	174.8	-75.1	14.4	0	0	0	111.7	P12 T18 T19 H20	P12-N16 PolarHBondContact O-N 3.2Å; N16-T18 PolarHBondContact O-N 2.86Å; N16-T19 WeakPolarHBondContact CA-OG1 3.42Å; N16-T19 PolarHBondContact O-N 2.87Å; N16-T19 PolarHBondContact O-OG1 3.23Å; N16-T19 VanDerWaalsContact O-OG1 3.07Å; N16-H20 WeakPolarHBondContact O-CB 3.28Å; N16-H20 PolarHBondContact O-CD2 2.9Å; N16-H20 PolarHBondContact O-N 2.88Å
17	L	47.5	Very low	44.2	Very low	61 Å²	61	72.2 Å²	72.2	32%	0.319	38%	0.379	S	S	.	.	H	α-helix	trans	-63.9	-40.5	177.9	-179	62	0	0	0	111.9	A13 I15 L21 Y116	A13-L17 WeakPolarHBondContact O-CB 3.24Å; A13-L17 PolarHBondContact O-N 3.47Å; I15-L17 PolarHBondContact O-N 3.02Å; L17-L21 HydrophobicContact CD1-CD1 4.2Å; L17-L21 HydrophobicContact CD1-CG 4.37Å; L17-L21 HydrophobicContact CG-CD1 4.07Å; L17-L21 VanDerWaalsContact O-CB 3.31Å; L17-L21 WeakPolarHBondContact O-CB 3.47Å; L17-L21 WeakPolarHBondContact O-CD1 3.36Å; L17-L21 WeakPolarHBondContact O-CG 3.45Å; L17-L21 PolarHBondContact O-N 2.83Å; L17-Y116 HydrophobicContact CD1-CE2 4.09Å; L17-Y116 HydrophobicContact CD2-CE2 3.98Å
18	T	46.6	Very low	44.9	Very low	49 Å²	49	72.4 Å²	72.4	30%	0.301	37%	0.373	S	S	.	.	H	α-helix	trans	-71.5	-37.4	176.3	46.2	0	0	0	0	112.3	L14 I15 N16 L21 F22	L14-T18 PolarHBondContact O-N 3.36Å; L14-T18 PolarHBondContact O-OG1 2.78Å; I15-T18 PolarHBondContact O-N 3.13Å; I15-T18 PolarHBondContact O-OG1 3.07Å; I15-T18 VanDerWaalsContact O-OG1 3.11Å; N16-T18 PolarHBondContact O-N 2.86Å; T18-L21 PolarHBondContact O-N 3.26Å; T18-F22 WeakPolarHBondContact O-CB 3.45Å; T18-F22 VanDerWaalsContact O-CD2 3.22Å; T18-F22 WeakPolarHBondContact O-CD2 3.36Å; T18-F22 PolarHBondContact O-N 2.87Å
19	T	50.4	Low	45.6	Very low	38 Å²	38	72.9 Å²	72.9	23%	0.233	37%	0.367	C	S	.	.	H	α-helix	trans	-70.2	-37.7	175.5	48.9	0	0	0	0	112.9	I15 N16 F22 H23 I43	I15-T19 HydrophobicContact CG2-CG2 4.4Å; I15-T19 WeakPolarHBondContact O-CB 3.4Å; I15-T19 WeakPolarHBondContact O-CG2 3.45Å; I15-T19 PolarHBondContact O-N 2.88Å; I15-T19 PolarHBondContact O-OG1 3.21Å; N16-T19 WeakPolarHBondContact CA-OG1 3.42Å; N16-T19 PolarHBondContact O-N 2.87Å; N16-T19 PolarHBondContact O-OG1 3.23Å; N16-T19 VanDerWaalsContact O-OG1 3.07Å; T19-F22 PolarHBondContact O-N 2.9Å; T19-H23 WeakPolarHBondContact O-CB 3.27Å; T19-H23 PolarHBondContact O-N 3.23Å; T19-I43 HydrophobicContact CG2-CD1 4.2Å; T19-I43 HydrophobicContact CG2-CG2 4.12Å
20	H	51.7	Low	45.8	Very low	100 Å²	100	68.8 Å²	68.8	46%	0.463	35%	0.346	S	S	.	.	H	α-helix	trans	-65	-43.1	169.7	-93	-86.5	0	0	0	112.4	N16 F22 H23 N24	N16-H20 WeakPolarHBondContact O-CB 3.28Å; N16-H20 PolarHBondContact O-CD2 2.9Å; N16-H20 PolarHBondContact O-N 2.88Å; H20-F22 VanDerWaalsContact C-N 3.31Å; H20-F22 PolarHBondContact O-N 2.75Å; H20-H23 PolarHBondContact O-N 3.21Å; H20-N24 WeakPolarHBondContact O-CB 3.46Å; H20-N24 VanDerWaalsContact O-CG 3.25Å; H20-N24 PolarHBondContact O-N 3.03Å; H20-N24 PolarHBondContact O-OD1 2.84Å
21	L	49.9	Very low	45.6	Very low	67 Å²	67	70.6 Å²	70.6	35%	0.351	36%	0.359	S	S	.	.	H	α-helix	trans	-61.8	-40.8	174.1	-76.1	167.9	0	0	0	111.3	L17 T18 I25	L17-L21 HydrophobicContact CD1-CD1 4.2Å; L17-L21 HydrophobicContact CD1-CG 4.37Å; L17-L21 HydrophobicContact CG-CD1 4.07Å; L17-L21 VanDerWaalsContact O-CB 3.31Å; L17-L21 WeakPolarHBondContact O-CB 3.47Å; L17-L21 WeakPolarHBondContact O-CD1 3.36Å; L17-L21 WeakPolarHBondContact O-CG 3.45Å; L17-L21 PolarHBondContact O-N 2.83Å; T18-L21 PolarHBondContact O-N 3.26Å; L21-I25 VanDerWaalsContact O-CB 3.27Å; L21-I25 WeakPolarHBondContact O-CB 3.32Å; L21-I25 WeakPolarHBondContact O-CD1 3.4Å; L21-I25 WeakPolarHBondContact O-CG1 3.49Å; L21-I25 PolarHBondContact O-N 2.8Å
22	F	50.2	Low	45.3	Very low	111 Å²	111	69.1 Å²	69.1	49%	0.487	36%	0.357	S	S	.	.	H	α-helix	trans	-64.2	-45.9	172.6	-89.9	-67.6	0	0	0	112	T18 T19 H20 I25 I26	T18-F22 WeakPolarHBondContact O-CB 3.45Å; T18-F22 VanDerWaalsContact O-CD2 3.22Å; T18-F22 WeakPolarHBondContact O-CD2 3.36Å; T18-F22 PolarHBondContact O-N 2.87Å; T19-F22 PolarHBondContact O-N 2.9Å; H20-F22 VanDerWaalsContact C-N 3.31Å; H20-F22 PolarHBondContact O-N 2.75Å; F22-I25 PolarHBondContact O-N 2.94Å; F22-I26 HydrophobicContact CB-CD1 4.33Å; F22-I26 HydrophobicContact CD1-CD1 4.29Å; F22-I26 WeakPolarHBondContact O-CB 3.47Å; F22-I26 WeakPolarHBondContact O-CD1 3.35Å; F22-I26 WeakPolarHBondContact O-CG1 3.28Å; F22-I26 PolarHBondContact O-N 2.86Å
23	H	49.4	Very low	45	Very low	82 Å²	82	71.7 Å²	71.7	38%	0.38	36%	0.362	S	S	.	.	H	α-helix	trans	-56.1	-54.9	177	-163.2	-71.9	0	0	0	110.6	T19 H20 I25 I26 E27	T19-H23 WeakPolarHBondContact O-CB 3.27Å; T19-H23 PolarHBondContact O-N 3.23Å; H20-H23 PolarHBondContact O-N 3.21Å; H23-I25 PolarHBondContact O-N 2.89Å; H23-I26 PolarHBondContact O-N 2.89Å; H23-E27 IonicContact CE1-OE1 3.62Å; H23-E27 IonicContact CE1-OE2 3.16Å; H23-E27 PolarHBondContact CE1-OE2 3.21Å; H23-E27 IonicContact ND1-OE2 2.95Å; H23-E27 PolarHBondContact ND1-OE2 2.84Å; H23-E27 WeakPolarHBondContact O-CB 3.37Å; H23-E27 PolarHBondContact O-N 2.92Å
24	N	47.7	Very low	44.7	Very low	67 Å²	67	77.9 Å²	77.9	36%	0.358	39%	0.393	S	S	.	.	H	α-helix	trans	-59.2	-47.1	179.8	-67.1	0.5	0	0	0	111.5	H20 I26 H28	H20-N24 WeakPolarHBondContact O-CB 3.46Å; H20-N24 VanDerWaalsContact O-CG 3.25Å; H20-N24 PolarHBondContact O-N 3.03Å; H20-N24 PolarHBondContact O-OD1 2.84Å; N24-I26 PolarHBondContact O-N 3.21Å; N24-H28 WeakPolarHBondContact O-CB 3.38Å; N24-H28 PolarHBondContact O-N 3.36Å
25	I	47.6	Very low	44.1	Very low	68 Å²	68	80.7 Å²	80.7	35%	0.349	40%	0.403	S	S	.	.	H	α-helix	trans	-65.6	-38	-179.8	-69.9	167	0	0	0	111.9	L21 F22 H23 K29	L21-I25 VanDerWaalsContact O-CB 3.27Å; L21-I25 WeakPolarHBondContact O-CB 3.32Å; L21-I25 WeakPolarHBondContact O-CD1 3.4Å; L21-I25 WeakPolarHBondContact O-CG1 3.49Å; L21-I25 PolarHBondContact O-N 2.8Å; F22-I25 PolarHBondContact O-N 2.94Å; H23-I25 PolarHBondContact O-N 2.89Å; I25-K29 HydrophobicContact CG2-CD 4.36Å; I25-K29 WeakPolarHBondContact O-CB 3.39Å; I25-K29 WeakPolarHBondContact O-CG 3.45Å; I25-K29 PolarHBondContact O-N 2.84Å
26	I	43	Very low	43.3	Very low	33 Å²	33	86.7 Å²	86.7	17%	0.169	43%	0.428	C	S	.	.	H	α-helix	trans	-68.5	-53.4	178.5	-74	170.5	0	0	0	109.4	F22 H23 N24 K29 I30 L40	F22-I26 HydrophobicContact CB-CD1 4.33Å; F22-I26 HydrophobicContact CD1-CD1 4.29Å; F22-I26 WeakPolarHBondContact O-CB 3.47Å; F22-I26 WeakPolarHBondContact O-CD1 3.35Å; F22-I26 WeakPolarHBondContact O-CG1 3.28Å; F22-I26 PolarHBondContact O-N 2.86Å; H23-I26 PolarHBondContact O-N 2.89Å; N24-I26 PolarHBondContact O-N 3.21Å; I26-K29 PolarHBondContact O-N 3.25Å; I26-I30 HydrophobicContact CG2-CD1 3.49Å; I26-I30 VanDerWaalsContact CG2-CD1 3.49Å; I26-I30 VanDerWaalsContact O-CB 3.23Å; I26-I30 WeakPolarHBondContact O-CB 3.18Å; I26-I30 WeakPolarHBondContact O-CD1 3.41Å; I26-I30 WeakPolarHBondContact O-CG1 3.23Å; I26-I30 PolarHBondContact O-N 2.65Å; I26-L40 HydrophobicContact CG2-CB 4.35Å
27	E	45	Very low	42.5	Very low	91 Å²	91	85.3 Å²	85.3	43%	0.425	42%	0.424	S	S	.	.	H	α-helix	trans	-61.6	-45.7	-178	-169.9	166.8	-139.9	0	0	112.5	H23 N31	H23-E27 IonicContact CE1-OE1 3.62Å; H23-E27 IonicContact CE1-OE2 3.16Å; H23-E27 PolarHBondContact CE1-OE2 3.21Å; H23-E27 IonicContact ND1-OE2 2.95Å; H23-E27 PolarHBondContact ND1-OE2 2.84Å; H23-E27 WeakPolarHBondContact O-CB 3.37Å; H23-E27 PolarHBondContact O-N 2.92Å; E27-N31 WeakPolarHBondContact O-CB 3.21Å; E27-N31 PolarHBondContact O-N 2.84Å; E27-N31 VanDerWaalsContact O-N 3.15Å; E27-N31 PolarHBondContact O-ND2 2.81Å
28	H	46.2	Very low	42	Very low	96 Å²	96	85.4 Å²	85.4	44%	0.444	42%	0.424	S	S	.	.	H	α-helix	trans	-70.5	-32.7	178.6	-120.4	-79.9	0	0	0	113.7	N24	N24-H28 WeakPolarHBondContact O-CB 3.38Å; N24-H28 PolarHBondContact O-N 3.36Å
29	K	43.9	Very low	41.5	Very low	103 Å²	103	84.4 Å²	84.4	45%	0.448	42%	0.423	S	S	.	.	H	α-helix	trans	-77.5	-35.3	176.7	-77	-170.7	171.6	-173	0	112.5	I25 I26 T32	I25-K29 HydrophobicContact CG2-CD 4.36Å; I25-K29 WeakPolarHBondContact O-CB 3.39Å; I25-K29 WeakPolarHBondContact O-CG 3.45Å; I25-K29 PolarHBondContact O-N 2.84Å; I26-K29 PolarHBondContact O-N 3.25Å; K29-T32 WeakPolarHBondContact O-CB 3.36Å; K29-T32 WeakPolarHBondContact O-CG2 3.32Å; K29-T32 PolarHBondContact O-N 3.47Å; K29-T32 PolarHBondContact O-OG1 2.74Å
30	I	39	Very low	41.1	Very low	29 Å²	29	84.8 Å²	84.8	15%	0.149	42%	0.424	C	S	.	.	H	α-helix	trans	-75.2	-31.3	-177.2	-72.7	170.8	0	0	0	111.9	I26 T32 F35 L38	I26-I30 HydrophobicContact CG2-CD1 3.49Å; I26-I30 VanDerWaalsContact CG2-CD1 3.49Å; I26-I30 VanDerWaalsContact O-CB 3.23Å; I26-I30 WeakPolarHBondContact O-CB 3.18Å; I26-I30 WeakPolarHBondContact O-CD1 3.41Å; I26-I30 WeakPolarHBondContact O-CG1 3.23Å; I26-I30 PolarHBondContact O-N 2.65Å; I30-T32 PolarHBondContact O-N 2.83Å; I30-F35 WeakPolarHBondContact CG2-O 3.23Å; I30-F35 CarbonylContact O-C 3.58Å; I30-L38 HydrophobicContact CD1-CB 3.79Å; I30-L38 WeakPolarHBondContact CD1-O 3.42Å; I30-L38 HydrophobicContact CG1-CB 4.41Å; I30-L38 HydrophobicContact CG2-CB 4.44Å; I30-L38 WeakPolarHBondContact CG2-O 3.49Å
31	N	35.5	Very low	40.9	Very low	126 Å²	126	84 Å²	84	67%	0.674	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.6	1.1	172	-79.8	-32.8	0	0	0	114.6	E27	E27-N31 WeakPolarHBondContact O-CB 3.21Å; E27-N31 PolarHBondContact O-N 2.84Å; E27-N31 VanDerWaalsContact O-N 3.15Å; E27-N31 PolarHBondContact O-ND2 2.81Å
32	T	38.3	Very low	40.7	Very low	69 Å²	69	82.4 Å²	82.4	42%	0.423	42%	0.415	S	S	.	.	S	Bend	trans	-66.1	143.1	163.1	65.3	0	0	0	0	109.8	K29 I30 N34 F35	K29-T32 WeakPolarHBondContact O-CB 3.36Å; K29-T32 WeakPolarHBondContact O-CG2 3.32Å; K29-T32 PolarHBondContact O-N 3.47Å; K29-T32 PolarHBondContact O-OG1 2.74Å; I30-T32 PolarHBondContact O-N 2.83Å; T32-N34 PolarHBondContact O-N 3.28Å; T32-F35 PolarHBondContact O-N 3.18Å
33	Q	34.3	Very low	40.5	Very low	135 Å²	135	79.4 Å²	79.4	63%	0.631	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.1	-24.4	-170.5	-73.2	-176.6	-21.4	0	0	114.4
34	N	32.7	Very low	40.3	Very low	147 Å²	147	79.9 Å²	79.9	79%	0.786	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.6	-7.1	-179.4	-63.2	-20.4	0	0	0	114.7	T32	T32-N34 PolarHBondContact O-N 3.28Å
35	F	32	Very low	40.2	Very low	123 Å²	123	82.8 Å²	82.8	54%	0.539	42%	0.415	S	S	.	.			trans	-128	20.2	-170	-84.1	-76.1	0	0	0	116.2	I30 T32 C37	I30-F35 WeakPolarHBondContact CG2-O 3.23Å; I30-F35 CarbonylContact O-C 3.58Å; T32-F35 PolarHBondContact O-N 3.18Å; F35-C37 PolarHBondContact O-N 3Å
36	K	32.9	Very low	39.9	Very low	152 Å²	152	84.5 Å²	84.5	66%	0.661	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.6	6.7	177.9	-81.8	-172.9	171.3	-178.4	0	118.2
37	C	29.1	Very low	39.6	Very low	45 Å²	45	87.1 Å²	87.1	30%	0.304	43%	0.434	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.2	2.2	-163.5	-59.4	0	0	0	0	116	F35 I60 I61	F35-C37 PolarHBondContact O-N 3Å; C37-I60 CarbonylContact O-C 3.59Å; C37-I60 WeakPolarHBondContact O-CA 3.3Å; C37-I61 VanDerWaalsContact CA-O 3.28Å; C37-I61 WeakPolarHBondContact CA-O 3.38Å; C37-I61 WeakPolarHBondContact CB-O 3.43Å; C37-I61 PolarHBondContact O-N 3.04Å
38	L	37.7	Very low	39.8	Very low	63 Å²	63	86.4 Å²	86.4	33%	0.33	43%	0.429	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	95.2	-170	-76.6	169	0	0	0	112.7	I30 F58 I60	I30-L38 HydrophobicContact CD1-CB 3.79Å; I30-L38 WeakPolarHBondContact CD1-O 3.42Å; I30-L38 HydrophobicContact CG1-CB 4.41Å; I30-L38 HydrophobicContact CG2-CB 4.44Å; I30-L38 WeakPolarHBondContact CG2-O 3.49Å; L38-F58 HydrophobicContact CD2-CB 4.45Å; L38-I60 HydrophobicContact CD2-CG1 3.99Å
39	G	34.2	Very low	39.5	Very low	28 Å²	28	90.8 Å²	90.8	29%	0.289	45%	0.45	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	131.5	167	0	0	0	0	0	110.9	F58 D59	G39-F58 CarbonylContact O-C 3.14Å; G39-F58 VanDerWaalsContact O-CA 3.3Å; G39-F58 WeakPolarHBondContact O-CA 3.27Å; G39-D59 PolarHBondContact N-O 2.83Å; G39-D59 PolarHBondContact O-N 2.84Å
40	L	43.2	Very low	39.1	Very low	46 Å²	46	91.9 Å²	91.9	24%	0.241	46%	0.46	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78	128.5	164.2	-171.6	74.1	0	0	0	108.4	I26 I43 F58	I26-L40 HydrophobicContact CG2-CB 4.35Å; L40-I43 HydrophobicContact CD2-CD1 4.02Å; L40-I43 HydrophobicContact CD2-CG1 3.98Å; L40-F58 HydrophobicContact CD1-CD1 3.9Å; L40-F58 HydrophobicContact CD1-CE1 3.52Å; L40-F58 HydrophobicContact CD1-CZ 3.87Å
41	Q	47.7	Very low	38.9	Very low	83 Å²	83	93.8 Å²	93.8	39%	0.388	47%	0.469	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	-34.4	-171.6	178.3	156.2	81.9	0	0	113.6	Q57 D59	Q41-Q57 HydrophobicContact CB-CB 4.32Å; Q41-Q57 HydrophobicContact CB-CG 4.16Å; Q41-Q57 HydrophobicContact CG-CG 4.34Å; Q41-Q57 PolarHBondContact N-O 2.9Å; Q41-D59 PolarHBondContact NE2-OD2 2.79Å
42	S	45.7	Very low	39.1	Very low	33 Å²	33	91.1 Å²	91.1	23%	0.231	45%	0.454	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157	156.6	167.6	69.4	0	0	0	0	111.5	D44 Q57	S42-D44 PolarHBondContact OG-OD2 2.82Å; S42-Q57 PolarHBondContact N-O 3.07Å; S42-Q57 PolarHBondContact O-N 2.96Å; S42-Q57 WeakPolarHBondContact OG-CB 3.39Å
43	I	46.7	Very low	39.3	Very low	49 Å²	49	90.1 Å²	90.1	25%	0.251	44%	0.444	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	106.2	160.9	-53.7	-177.1	0	0	0	106.5	T19 L40 V54 V55 L56	T19-I43 HydrophobicContact CG2-CD1 4.2Å; T19-I43 HydrophobicContact CG2-CG2 4.12Å; L40-I43 HydrophobicContact CD2-CD1 4.02Å; L40-I43 HydrophobicContact CD2-CG1 3.98Å; I43-V54 HydrophobicContact CG2-CG1 4.16Å; I43-V55 WeakPolarHBondContact CA-O 3.33Å; I43-L56 HydrophobicContact CB-CD2 4.24Å; I43-L56 HydrophobicContact CD1-CD2 4.2Å; I43-L56 HydrophobicContact CG1-CD2 3.76Å; I43-L56 HydrophobicContact CG2-CD2 3.89Å
44	D	43.8	Very low	39.8	Very low	92 Å²	92	86 Å²	86	49%	0.492	43%	0.428	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	144.8	172.6	-61	-70.1	0	0	0	109.2	S42 V54 V55	S42-D44 PolarHBondContact OG-OD2 2.82Å; D44-V54 CarbonylContact O-C 3.58Å; D44-V54 WeakPolarHBondContact O-CA 3.46Å; D44-V55 HydrophobicContact CB-CB 4.32Å; D44-V55 PolarHBondContact N-O 2.74Å; D44-V55 PolarHBondContact O-N 2.94Å
45	Y	45.6	Very low	40.4	Very low	127 Å²	127	80.9 Å²	80.9	50%	0.498	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	139.5	173.1	67.9	-93.4	0	0	0	111.8	I15 E53	I15-Y45 HydrophobicContact CG2-CD1 4.4Å; I15-Y45 HydrophobicContact CG2-CE1 4.24Å; Y45-E53 CarbonylContact C-O 3.57Å; Y45-E53 VanDerWaalsContact CA-O 3.23Å; Y45-E53 WeakPolarHBondContact CA-O 3.37Å
46	E	40.9	Very low	41.1	Very low	105 Å²	105	77.5 Å²	77.5	49%	0.491	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	121.4	176.7	-155.8	-159.9	135.6	0	0	109.9	K48 E53	E46-K48 WeakPolarHBondContact OE1-CE 3.49Å; E46-K48 WeakPolarHBondContact OE1-CG 3.49Å; E46-K48 IonicContact OE1-NZ 2.72Å; E46-K48 PolarHBondContact OE1-NZ 2.93Å; E46-K48 IonicContact OE2-NZ 3.9Å; E46-K48 PolarHBondContact OE2-NZ 2.69Å; E46-E53 HydrophobicContact CB-CB 4.43Å; E46-E53 PolarHBondContact N-O 2.72Å; E46-E53 PolarHBondContact O-N 3.21Å
47	Q	37.8	Very low	41.7	Very low	88 Å²	88	73.4 Å²	73.4	41%	0.411	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	101.2	176.9	-173.5	-178.6	-36.9	0	0	110.7	I52	Q47-I52 HydrophobicContact CG-CG1 4.12Å
48	K	48	Very low	42.4	Very low	76 Å²	76	73.9 Å²	73.9	33%	0.33	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	158.5	167.2	-56.3	178.9	-179.7	73.9	0	108.6	E46 N50 Q51 E53	E46-K48 WeakPolarHBondContact OE1-CE 3.49Å; E46-K48 WeakPolarHBondContact OE1-CG 3.49Å; E46-K48 IonicContact OE1-NZ 2.72Å; E46-K48 PolarHBondContact OE1-NZ 2.93Å; E46-K48 IonicContact OE2-NZ 3.9Å; E46-K48 PolarHBondContact OE2-NZ 2.69Å; K48-N50 PolarHBondContact O-N 2.9Å; K48-Q51 PolarHBondContact N-O 2.94Å; K48-Q51 PolarHBondContact O-N 3.24Å; K48-E53 IonicContact NZ-OE2 2.64Å; K48-E53 PolarHBondContact NZ-OE2 3.02Å
49	E	40.2	Very low	42.4	Very low	188 Å²	188	72.6 Å²	72.6	88%	0.879	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	-45	-35.1	-164.2	-68.1	-167.6	122.2	0	0	117
50	N	36	Very low	42.5	Very low	125 Å²	125	74.6 Å²	74.6	67%	0.668	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-126.3	9.7	180	-70.6	-88.8	0	0	0	114.1	K48 I985	K48-N50 PolarHBondContact O-N 2.9Å; N50-I985 HydrophobicContact CB-CD1 3.84Å; N50-I985 WeakPolarHBondContact O-CD1 3.46Å
51	Q	35	Very low	42.2	Very low	69 Å²	69	77.2 Å²	77.2	32%	0.322	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	141.6	-174.7	-71.5	173.8	-21.1	0	0	110.7	K48 K983	K48-Q51 PolarHBondContact N-O 2.94Å; K48-Q51 PolarHBondContact O-N 3.24Å; Q51-K983 PolarHBondContact NE2-O 3.31Å
52	I	40.2	Very low	41.4	Very low	70 Å²	70	77.5 Å²	77.5	36%	0.359	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	115.9	165.3	-58.8	172.3	0	0	0	105.3	F10 Q47 V54	F10-I52 HydrophobicContact CD2-CD1 3.76Å; F10-I52 HydrophobicContact CE2-CD1 3.81Å; Q47-I52 HydrophobicContact CG-CG1 4.12Å; I52-V54 HydrophobicContact CG2-CG2 3.99Å
53	E	42.5	Very low	40.7	Very low	48 Å²	48	79.7 Å²	79.7	22%	0.224	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	135.2	171.8	-171.5	157.9	-159.1	0	0	107.5	Y45 E46 K48	Y45-E53 CarbonylContact C-O 3.57Å; Y45-E53 VanDerWaalsContact CA-O 3.23Å; Y45-E53 WeakPolarHBondContact CA-O 3.37Å; E46-E53 HydrophobicContact CB-CB 4.43Å; E46-E53 PolarHBondContact N-O 2.72Å; E46-E53 PolarHBondContact O-N 3.21Å; K48-E53 IonicContact NZ-OE2 2.64Å; K48-E53 PolarHBondContact NZ-OE2 3.02Å
54	V	44	Very low	39.9	Very low	49 Å²	49	81.7 Å²	81.7	30%	0.297	42%	0.424	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	122.6	177.7	-176.5	0	0	0	0	107.6	I43 D44 I52 L56 F981	I43-V54 HydrophobicContact CG2-CG1 4.16Å; D44-V54 CarbonylContact O-C 3.58Å; D44-V54 WeakPolarHBondContact O-CA 3.46Å; I52-V54 HydrophobicContact CG2-CG2 3.99Å; V54-L56 HydrophobicContact CG1-CD2 4.33Å; V54-F981 WeakPolarHBondContact O-CD2 3.45Å
55	V	45.6	Very low	39.3	Very low	40 Å²	40	82.5 Å²	82.5	24%	0.242	44%	0.438	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	121.2	179.2	-177.4	0	0	0	0	107.8	I43 D44	I43-V55 WeakPolarHBondContact CA-O 3.33Å; D44-V55 HydrophobicContact CB-CB 4.32Å; D44-V55 PolarHBondContact N-O 2.74Å; D44-V55 PolarHBondContact O-N 2.94Å
56	L	46.9	Very low	38.5	Very low	51 Å²	51	81.6 Å²	81.6	27%	0.267	45%	0.449	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	116.5	174.2	-61.3	175.8	0	0	0	108.5	I43 V54 F58	I43-L56 HydrophobicContact CB-CD2 4.24Å; I43-L56 HydrophobicContact CD1-CD2 4.2Å; I43-L56 HydrophobicContact CG1-CD2 3.76Å; I43-L56 HydrophobicContact CG2-CD2 3.89Å; V54-L56 HydrophobicContact CG1-CD2 4.33Å; L56-F58 HydrophobicContact CB-CD2 4.37Å; L56-F58 HydrophobicContact CB-CE2 3.62Å; L56-F58 HydrophobicContact CB-CZ 4.18Å; L56-F58 HydrophobicContact CD1-CE2 4.39Å; L56-F58 HydrophobicContact CD1-CZ 4.41Å
57	Q	45.2	Very low	38.1	Very low	66 Å²	66	81.6 Å²	81.6	31%	0.308	46%	0.461	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	125.8	177.2	-167.4	164.9	-57.7	0	0	110	Q41 S42	Q41-Q57 HydrophobicContact CB-CB 4.32Å; Q41-Q57 HydrophobicContact CB-CG 4.16Å; Q41-Q57 HydrophobicContact CG-CG 4.34Å; Q41-Q57 PolarHBondContact N-O 2.9Å; S42-Q57 PolarHBondContact N-O 3.07Å; S42-Q57 PolarHBondContact O-N 2.96Å; S42-Q57 WeakPolarHBondContact OG-CB 3.39Å
58	F	43.1	Very low	37.8	Very low	56 Å²	56	82.3 Å²	82.3	25%	0.246	48%	0.476	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	131.9	178	-62.4	-89.8	0	0	0	110.8	L38 G39 L40 L56	L38-F58 HydrophobicContact CD2-CB 4.45Å; G39-F58 CarbonylContact O-C 3.14Å; G39-F58 VanDerWaalsContact O-CA 3.3Å; G39-F58 WeakPolarHBondContact O-CA 3.27Å; L40-F58 HydrophobicContact CD1-CD1 3.9Å; L40-F58 HydrophobicContact CD1-CE1 3.52Å; L40-F58 HydrophobicContact CD1-CZ 3.87Å; L56-F58 HydrophobicContact CB-CD2 4.37Å; L56-F58 HydrophobicContact CB-CE2 3.62Å; L56-F58 HydrophobicContact CB-CZ 4.18Å; L56-F58 HydrophobicContact CD1-CE2 4.39Å; L56-F58 HydrophobicContact CD1-CZ 4.41Å
59	D	38.2	Very low	37	Very low	36 Å²	36	83.9 Å²	83.9	19%	0.193	50%	0.497	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	104.9	169.5	-132.8	-31.3	0	0	0	107.9	G39 Q41 I61 K974	G39-D59 PolarHBondContact N-O 2.83Å; G39-D59 PolarHBondContact O-N 2.84Å; Q41-D59 PolarHBondContact NE2-OD2 2.79Å; D59-I61 PolarHBondContact O-N 2.78Å; D59-K974 IonicContact OD1-NZ 2.75Å; D59-K974 PolarHBondContact OD1-NZ 2.79Å; D59-K974 IonicContact OD2-NZ 3.62Å
60	I	35.5	Very low	36.7	Very low	70 Å²	70	79.9 Å²	79.9	36%	0.359	49%	0.489	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	106.7	176.7	-57.9	174.2	0	0	0	108.3	C37 L38 S62	C37-I60 CarbonylContact O-C 3.59Å; C37-I60 WeakPolarHBondContact O-CA 3.3Å; L38-I60 HydrophobicContact CD2-CG1 3.99Å; I60-S62 PolarHBondContact O-N 3.03Å
61	I	36.5	Very low	36.4	Very low	100 Å²	100	79.6 Å²	79.6	51%	0.513	50%	0.497	S	S	.	.			trans	-85.9	86.1	169.5	-56.5	-179.6	0	0	0	107	C37 D59 S63	C37-I61 VanDerWaalsContact CA-O 3.28Å; C37-I61 WeakPolarHBondContact CA-O 3.38Å; C37-I61 WeakPolarHBondContact CB-O 3.43Å; C37-I61 PolarHBondContact O-N 3.04Å; D59-I61 PolarHBondContact O-N 2.78Å; I61-S63 VanDerWaalsContact C-N 3.31Å; I61-S63 PolarHBondContact O-N 2.78Å
62	S	31.8	Very low	36.5	Very low	89 Å²	89	81.6 Å²	81.6	62%	0.622	52%	0.519	S	S	*	.			trans	-67.4	92.4	168.9	-59.5	0	0	0	0	109.3	I60 S64	I60-S62 PolarHBondContact O-N 3.03Å; S62-S64 PolarHBondContact O-N 2.81Å
63	S	31.6	Very low	36.2	Very low	79 Å²	79	84 Å²	84	55%	0.552	54%	0.542	S	S	*	.			trans	-66.1	89	164.3	55.5	0	0	0	0	108.3	I61 S65	I61-S63 VanDerWaalsContact C-N 3.31Å; I61-S63 PolarHBondContact O-N 2.78Å; S63-S65 VanDerWaalsContact C-N 3.27Å; S63-S65 PolarHBondContact O-N 2.85Å
64	S	29.4	Very low	35.9	Very low	91 Å²	91	86.9 Å²	86.9	64%	0.636	57%	0.567	S	S	*	*			trans	-65.4	92.6	169.3	53.3	0	0	0	0	108	S62 S66	S62-S64 PolarHBondContact O-N 2.81Å; S64-S66 PolarHBondContact O-N 2.8Å
65	S	31.3	Very low	35.6	Very low	110 Å²	110	89.6 Å²	89.6	77%	0.769	59%	0.589	S	S	*	*			trans	-60.9	93.5	163.2	52.6	0	0	0	0	107.2	S63 S67	S63-S65 VanDerWaalsContact C-N 3.27Å; S63-S65 PolarHBondContact O-N 2.85Å; S65-S67 PolarHBondContact O-N 3.07Å
66	S	29.4	Very low	35	Very low	107 Å²	107	92.8 Å²	92.8	75%	0.748	61%	0.612	S	S	*	*			trans	-66.7	85	169.2	50.8	0	0	0	0	107.4	S64 S68	S64-S66 PolarHBondContact O-N 2.8Å; S66-S68 PolarHBondContact O-N 3.43Å
67	S	31.4	Very low	34.5	Very low	105 Å²	105	95.1 Å²	95.1	73%	0.734	63%	0.633	S	S	*	*			trans	-65.7	83.8	167.2	53.8	0	0	0	0	107.3	S65 S69	S65-S67 PolarHBondContact O-N 3.07Å; S67-S69 PolarHBondContact O-N 2.95Å
68	S	32.2	Very low	33.9	Very low	104 Å²	104	97 Å²	97	73%	0.727	65%	0.653	S	S	*	*			trans	-66.7	82.2	171.6	50.7	0	0	0	0	108	S66 S70	S66-S68 PolarHBondContact O-N 3.43Å; S68-S70 PolarHBondContact O-N 2.86Å
69	S	30.2	Very low	33.5	Very low	109 Å²	109	99 Å²	99	76%	0.762	68%	0.675	S	S	*	*			trans	-72	71.9	174	54.6	0	0	0	0	109.1	S67 S71	S67-S69 PolarHBondContact O-N 2.95Å; S69-S71 VanDerWaalsContact C-N 3.3Å; S69-S71 PolarHBondContact O-N 3.28Å
70	S	34.3	Very low	33.2	Very low	103 Å²	103	102.9 Å²	102.9	72%	0.72	70%	0.699	S	S	*	*			trans	-67.7	89.7	170.3	51.3	0	0	0	0	108.7	S68 S72	S68-S70 PolarHBondContact O-N 2.86Å; S70-S72 PolarHBondContact O-N 2.84Å; S70-S72 VanDerWaalsContact O-N 3.15Å
71	S	30.9	Very low	33	Very low	120 Å²	120	105.2 Å²	105.2	84%	0.839	71%	0.713	S	S	*	*			trans	-72.8	98.8	175.2	52.1	0	0	0	0	110.3	S69	S69-S71 VanDerWaalsContact C-N 3.3Å; S69-S71 PolarHBondContact O-N 3.28Å
72	S	35.5	Very low	32.8	Very low	111 Å²	111	107.6 Å²	107.6	78%	0.776	73%	0.726	S	S	*	*			trans	-120.2	112	169.2	54.8	0	0	0	0	109.4	S70	S70-S72 PolarHBondContact O-N 2.84Å; S70-S72 VanDerWaalsContact O-N 3.15Å
73	S	34.9	Very low	32.7	Very low	121 Å²	121	108.3 Å²	108.3	85%	0.846	73%	0.731	S	S	*	*			trans	-96.9	118.7	-171.9	52.3	0	0	0	0	113
74	S	36.9	Very low	32.6	Very low	108 Å²	108	111.5 Å²	111.5	76%	0.755	74%	0.742	S	S	*	*			trans	-162.4	105.3	159.2	55.1	0	0	0	0	112.9
75	S	36.1	Very low	32.9	Very low	106 Å²	106	113.2 Å²	113.2	74%	0.741	75%	0.748	S	S	*	*			trans	33.8	128.8	139.4	56.1	0	0	0	0	123.3
76	S	33.9	Very low	32.8	Very low	106 Å²	106	114.5 Å²	114.5	74%	0.741	75%	0.746	S	S	*	*			trans	83.1	145.9	131.6	55.2	0	0	0	0	123.8
77	S	35.4	Very low	32.9	Very low	101 Å²	101	116 Å²	116	71%	0.706	75%	0.746	S	S	*	*			trans	74	90.8	155.1	22.9	0	0	0	0	121.8
78	S	33.6	Very low	32.7	Very low	104 Å²	104	117.3 Å²	117.3	73%	0.727	75%	0.745	S	S	*	*				59.7	132.5	119.7	58.2	0	0	0	0	124.4
79	S	33.7	Very low	32.5	Very low	100 Å²	100	117.8 Å²	117.8	70%	0.699	74%	0.739	S	S	*	*			trans	68.2	96.8	142.1	53.7	0	0	0	0	122.2
80	T	32.8	Very low	32.3	Very low	116 Å²	116	118.7 Å²	118.7	71%	0.712	74%	0.74	S	S	*	*				39.8	107.6	125.8	54.3	0	0	0	0	120.3
81	N	31.6	Very low	31.9	Very low	119 Å²	119	122.3 Å²	122.3	64%	0.636	74%	0.739	S	S	*	*				175.8	153.8	91	-92.5	-33.4	0	0	0	115.5
82	N	31.9	Very low	31.8	Very low	150 Å²	150	122 Å²	122	80%	0.802	73%	0.732	S	S	*	*			trans	66.7	133.8	150.7	-70.1	-12.7	0	0	0	123.5
83	S	30.6	Very low	31.4	Very low	104 Å²	104	125.8 Å²	125.8	73%	0.727	74%	0.738	S	S	*	*			trans	98.5	143.6	136	-147.2	0	0	0	0	120.8
84	L	29.8	Very low	31	Very low	146 Å²	146	122.8 Å²	122.8	76%	0.764	72%	0.716	S	S	*	*			trans	43.8	111.8	163.4	-100.3	62.8	0	0	0	119.5
85	V	35	Very low	30.6	Very low	128 Å²	128	121.6 Å²	121.6	78%	0.776	70%	0.701	S	S	*	*				-148	126	89.8	170.8	0	0	0	0	108.9	N87	V85-N87 PolarHBondContact O-N 3.38Å
86	N	28	Very low	30.3	Very low	136 Å²	136	124.4 Å²	124.4	73%	0.727	70%	0.697	S	S	*	*			trans	-78	116.4	170.9	-83.9	-23.3	0	0	0	110.6
87	N	32.1	Very low	30.2	Very low	138 Å²	138	122 Å²	122	74%	0.738	68%	0.678	S	S	*	*			trans	-102.9	100	158.3	-91.8	-36.2	0	0	0	109	V85 N89	V85-N87 PolarHBondContact O-N 3.38Å; N87-N89 VanDerWaalsContact C-N 3.27Å; N87-N89 PolarHBondContact O-N 3.3Å
88	N	26.7	Very low	30	Very low	134 Å²	134	120.8 Å²	120.8	72%	0.717	66%	0.663	S	S	*	*			trans	-68.7	80.8	178.2	-74.4	-14.1	0	0	0	110.9	T90	N88-T90 VanDerWaalsContact C-N 3.29Å; N88-T90 PolarHBondContact O-N 3.43Å
89	N	28.9	Very low	29.9	Very low	113 Å²	113	119.2 Å²	119.2	60%	0.604	65%	0.646	S	S	*	*			trans	-69.5	89.9	165.4	-76.1	-44.5	0	0	0	108.8	N87 Y91	N87-N89 VanDerWaalsContact C-N 3.27Å; N87-N89 PolarHBondContact O-N 3.3Å; N89-Y91 HydrophobicContact CB-CD2 4.11Å; N89-Y91 HydrophobicContact CB-CE2 3.95Å; N89-Y91 WeakPolarHBondContact O-CD2 3.19Å; N89-Y91 PolarHBondContact O-N 2.86Å
90	T	25.8	Very low	29.8	Very low	128 Å²	128	120.3 Å²	120.3	79%	0.785	64%	0.639	S	S	*	*			trans	-64	83.7	167.3	30	0	0	0	0	109.9	N88 T92	N88-T90 VanDerWaalsContact C-N 3.29Å; N88-T90 PolarHBondContact O-N 3.43Å; T90-T92 VanDerWaalsContact C-N 3.34Å; T90-T92 PolarHBondContact O-N 2.94Å
91	Y	26.5	Very low	29.9	Very low	179 Å²	179	118.3 Å²	118.3	70%	0.702	63%	0.626	S	S	*	*			trans	-65.1	96.5	163.8	-82	-89.2	0	0	0	108.3	N89 E93	N89-Y91 HydrophobicContact CB-CD2 4.11Å; N89-Y91 HydrophobicContact CB-CE2 3.95Å; N89-Y91 WeakPolarHBondContact O-CD2 3.19Å; N89-Y91 PolarHBondContact O-N 2.86Å; Y91-E93 PolarHBondContact O-N 2.83Å
92	T	27.6	Very low	30.1	Very low	113 Å²	113	117 Å²	117	69%	0.693	62%	0.619	S	S	*	*			trans	-58.9	118.8	164.5	49.1	0	0	0	0	108.2	T90 C94	T90-T92 VanDerWaalsContact C-N 3.34Å; T90-T92 PolarHBondContact O-N 2.94Å; T92-C94 PolarHBondContact O-N 3.29Å
93	E	27.5	Very low	30.2	Very low	192 Å²	192	117.5 Å²	117.5	90%	0.897	61%	0.61	S	S	*	*			trans	-68.3	94.6	175.9	-173.7	158.9	-147.7	0	0	108.9	Y91 D95	Y91-E93 PolarHBondContact O-N 2.83Å; E93-D95 VanDerWaalsContact C-N 3.34Å; E93-D95 PolarHBondContact O-N 2.88Å
94	C	27.3	Very low	30.4	Very low	57 Å²	57	115.6 Å²	115.6	39%	0.385	59%	0.591	S	S	.	*			trans	-69.5	92.4	177.2	-68.6	0	0	0	0	109.3	T92 Y96	T92-C94 PolarHBondContact O-N 3.29Å; C94-Y96 WeakPolarHBondContact O-CD2 3.23Å; C94-Y96 WeakPolarHBondContact O-CE2 3.48Å; C94-Y96 PolarHBondContact O-N 2.87Å
95	D	28.6	Very low	30.9	Very low	84 Å²	84	112.1 Å²	112.1	45%	0.449	58%	0.576	S	S	.	*			trans	-62.2	100.5	172.4	-172.6	-8.4	0	0	0	109.7	E93 T97 N98	E93-D95 VanDerWaalsContact C-N 3.34Å; E93-D95 PolarHBondContact O-N 2.88Å; D95-T97 PolarHBondContact O-N 3.4Å; D95-T97 VanDerWaalsContact O-N 3.07Å; D95-T97 WeakPolarHBondContact OD1-CB 3.39Å; D95-T97 PolarHBondContact OD1-N 3.42Å; D95-T97 PolarHBondContact OD1-OG1 2.95Å; D95-T97 PolarHBondContact OD2-OG1 3.49Å; D95-N98 PolarHBondContact O-N 3.49Å; D95-N98 PolarHBondContact OD2-ND2 3.33Å
96	Y	29.4	Very low	31.2	Very low	164 Å²	164	113.9 Å²	113.9	64%	0.643	58%	0.576	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.6	-13	-174.9	-71.1	-85.7	0	0	0	113.1	C94 F100	C94-Y96 WeakPolarHBondContact O-CD2 3.23Å; C94-Y96 WeakPolarHBondContact O-CE2 3.48Å; C94-Y96 PolarHBondContact O-N 2.87Å; Y96-F100 WeakPolarHBondContact O-CD2 3.32Å
97	T	31.4	Very low	32	Very low	56 Å²	56	114.3 Å²	114.3	34%	0.344	57%	0.573	S	S	.	*	T	Hydrogen-bonded Turn	trans	-71.7	-54.2	176	62.6	0	0	0	0	111.1	D95 L99 F100 V101	D95-T97 PolarHBondContact O-N 3.4Å; D95-T97 VanDerWaalsContact O-N 3.07Å; D95-T97 WeakPolarHBondContact OD1-CB 3.39Å; D95-T97 PolarHBondContact OD1-N 3.42Å; D95-T97 PolarHBondContact OD1-OG1 2.95Å; D95-T97 PolarHBondContact OD2-OG1 3.49Å; T97-L99 PolarHBondContact O-N 3.02Å; T97-F100 PolarHBondContact O-N 3.14Å; T97-V101 PolarHBondContact O-N 3.41Å
98	N	30.8	Very low	32.5	Very low	75 Å²	75	109.6 Å²	109.6	40%	0.401	55%	0.548	S	S	.	.	H	α-helix	trans	-66.4	-38.7	-175.4	-55.1	-43.2	0	0	0	111.8	D95 F100 V101 D102	D95-N98 PolarHBondContact O-N 3.49Å; D95-N98 PolarHBondContact OD2-ND2 3.33Å; N98-F100 PolarHBondContact O-N 3.42Å; N98-F100 VanDerWaalsContact O-N 3.1Å; N98-V101 PolarHBondContact O-N 3.28Å; N98-D102 PolarHBondContact O-N 3.48Å
99	L	32.6	Very low	33.6	Very low	71 Å²	71	106.6 Å²	106.6	37%	0.372	53%	0.534	S	S	.	.	H	α-helix	trans	-59.3	-25.3	177.5	-118.1	168.1	0	0	0	114.1	T97	T97-L99 PolarHBondContact O-N 3.02Å
100	F	31.6	Very low	34.1	Very low	124 Å²	124	106 Å²	106	54%	0.544	54%	0.537	S	S	.	.	H	α-helix	trans	-87.3	-34.5	170.2	-90.1	-84.9	0	0	0	113.1	Y96 T97 N98 L104	Y96-F100 WeakPolarHBondContact O-CD2 3.32Å; T97-F100 PolarHBondContact O-N 3.14Å; N98-F100 PolarHBondContact O-N 3.42Å; N98-F100 VanDerWaalsContact O-N 3.1Å; F100-L104 HydrophobicContact CD1-CD1 4.37Å; F100-L104 VanDerWaalsContact O-CB 3.32Å; F100-L104 WeakPolarHBondContact O-CB 3.31Å; F100-L104 WeakPolarHBondContact O-CD1 3.41Å; F100-L104 WeakPolarHBondContact O-CG 3.23Å
101	V	33.8	Very low	34.9	Very low	73 Å²	73	105.5 Å²	105.5	44%	0.442	53%	0.529	S	S	.	.	H	α-helix	trans	-70.7	-54.3	-180	174.9	0	0	0	0	110.9	T97 N98 R103 L104 T105	T97-V101 PolarHBondContact O-N 3.41Å; N98-V101 PolarHBondContact O-N 3.28Å; V101-R103 PolarHBondContact O-N 2.75Å; V101-L104 PolarHBondContact O-N 3.49Å; V101-L104 VanDerWaalsContact O-N 3.12Å; V101-T105 HydrophobicContact CG1-CG2 4.38Å; V101-T105 PolarHBondContact O-N 2.8Å; V101-T105 PolarHBondContact O-OG1 3.42Å
102	D	35.3	Very low	35.6	Very low	92 Å²	92	99.5 Å²	99.5	49%	0.492	51%	0.508	S	S	.	.	H	α-helix	trans	-69.8	-30	-164.6	-59.3	-28.6	0	0	0	113.5	N98 T105	N98-D102 PolarHBondContact O-N 3.48Å; D102-T105 PolarHBondContact O-OG1 2.95Å
103	R	35.4	Very low	36.3	Very low	161 Å²	161	100.4 Å²	100.4	61%	0.608	50%	0.498	S	S	*	.	H	α-helix	trans	-87.4	-19.6	174.1	-72.9	-170.1	174.8	-168	0.6	114.1	V101	V101-R103 PolarHBondContact O-N 2.75Å
104	L	35.2	Very low	37.2	Very low	64 Å²	64	98.1 Å²	98.1	34%	0.335	49%	0.485	S	S	.	.	H	α-helix	trans	-86.2	-13.8	173.2	-63.5	178.1	0	0	0	112.3	F100 V101 I108	F100-L104 HydrophobicContact CD1-CD1 4.37Å; F100-L104 VanDerWaalsContact O-CB 3.32Å; F100-L104 WeakPolarHBondContact O-CB 3.31Å; F100-L104 WeakPolarHBondContact O-CD1 3.41Å; F100-L104 WeakPolarHBondContact O-CG 3.23Å; V101-L104 PolarHBondContact O-N 3.49Å; V101-L104 VanDerWaalsContact O-N 3.12Å; L104-I108 HydrophobicContact CB-CD1 3.84Å; L104-I108 HydrophobicContact CD2-CD1 3.83Å; L104-I108 HydrophobicContact CG-CD1 4.37Å; L104-I108 WeakPolarHBondContact O-CD1 3.26Å; L104-I108 VanDerWaalsContact O-CG1 3.26Å; L104-I108 WeakPolarHBondContact O-CG1 3.41Å
105	T	39.1	Very low	37.8	Very low	72 Å²	72	100 Å²	100	44%	0.442	49%	0.487	S	S	.	.	H	α-helix	trans	-81.9	-38.9	171.9	45	0	0	0	0	113.1	V101 D102	V101-T105 HydrophobicContact CG1-CG2 4.38Å; V101-T105 PolarHBondContact O-N 2.8Å; V101-T105 PolarHBondContact O-OG1 3.42Å; D102-T105 PolarHBondContact O-OG1 2.95Å
106	E	41.8	Very low	38.3	Very low	166 Å²	166	99.5 Å²	99.5	78%	0.776	48%	0.48	S	S	*	.	H	α-helix	trans	-83	-31.3	-172.2	-68.6	-167.9	140.3	0	0	115.9
107	Q	43.6	Very low	38.9	Very low	144 Å²	144	96.4 Å²	96.4	67%	0.673	47%	0.474	S	S	*	.	S	Bend	trans	-110.4	-5.7	-169.8	-65.3	-169.4	-6.5	0	0	115.8
108	I	42.4	Very low	39.5	Very low	40 Å²	40	97.8 Å²	97.8	21%	0.205	49%	0.486	C	S	.	.			trans	-85.1	119.7	-174.5	-65	-171.5	0	0	0	111.6	L104 E112 R113 Y116	L104-I108 HydrophobicContact CB-CD1 3.84Å; L104-I108 HydrophobicContact CD2-CD1 3.83Å; L104-I108 HydrophobicContact CG-CD1 4.37Å; L104-I108 WeakPolarHBondContact O-CD1 3.26Å; L104-I108 VanDerWaalsContact O-CG1 3.26Å; L104-I108 WeakPolarHBondContact O-CG1 3.41Å; I108-E112 HydrophobicContact CG2-CB 3.69Å; I108-R113 HydrophobicContact CG2-CB 4.13Å; I108-R113 HydrophobicContact CG2-CG 3.87Å; I108-Y116 HydrophobicContact CD1-CD2 4.46Å; I108-Y116 HydrophobicContact CD1-CE2 4.48Å
109	T	51	Low	39.8	Very low	70 Å²	70	99.7 Å²	99.7	43%	0.429	49%	0.491	S	S	.	.			trans	-67.1	154.4	174.7	68.1	0	0	0	0	111.8	N111 E112 R113	T109-N111 PolarHBondContact O-N 3.36Å; T109-E112 WeakPolarHBondContact CB-OE2 3.44Å; T109-E112 WeakPolarHBondContact CG2-OE2 3.25Å; T109-E112 PolarHBondContact N-OE2 3.23Å; T109-E112 PolarHBondContact O-N 3.15Å; T109-E112 VanDerWaalsContact OG1-CD 3.3Å; T109-E112 WeakPolarHBondContact OG1-CG 3.44Å; T109-E112 PolarHBondContact OG1-OE2 2.81Å; T109-R113 PolarHBondContact O-N 3.24Å
110	P	39.8	Very low	40.1	Very low	101 Å²	101	99.9 Å²	99.9	66%	0.656	49%	0.492	S	S	*	.	H	α-helix	trans	-56.1	-27.3	-179.7	-28.5	36.1	0	0	0	115	K114	P110-K114 PolarHBondContact O-N 2.93Å
111	N	41.8	Very low	40.5	Very low	118 Å²	118	102.1 Å²	102.1	63%	0.631	50%	0.504	S	S	*	.	H	α-helix	trans	-75.7	-35.7	176.3	-71.4	-29.6	0	0	0	112.4	T109 K114 F115	T109-N111 PolarHBondContact O-N 3.36Å; N111-K114 PolarHBondContact O-N 3.14Å; N111-F115 PolarHBondContact O-N 3.47Å; N111-F115 VanDerWaalsContact O-N 3.17Å
112	E	41.5	Very low	40.5	Very low	53 Å²	53	100.9 Å²	100.9	25%	0.248	50%	0.502	C	S	.	.	H	α-helix	trans	-71.9	-36.3	174.8	-70.2	164.2	136	0	0	111.1	A13 I108 T109 K114 F115 Y116	A13-E112 HydrophobicContact CB-CG 3.86Å; A13-E112 WeakPolarHBondContact CB-OE1 3.19Å; I108-E112 HydrophobicContact CG2-CB 3.69Å; T109-E112 WeakPolarHBondContact CB-OE2 3.44Å; T109-E112 WeakPolarHBondContact CG2-OE2 3.25Å; T109-E112 PolarHBondContact N-OE2 3.23Å; T109-E112 PolarHBondContact O-N 3.15Å; T109-E112 VanDerWaalsContact OG1-CD 3.3Å; T109-E112 WeakPolarHBondContact OG1-CG 3.44Å; T109-E112 PolarHBondContact OG1-OE2 2.81Å; E112-K114 VanDerWaalsContact C-N 3.33Å; E112-K114 PolarHBondContact O-N 2.99Å; E112-F115 CarbonylContact O-C 3.16Å; E112-F115 WeakPolarHBondContact O-CA 3.32Å; E112-F115 WeakPolarHBondContact O-CB 3.37Å; E112-F115 PolarHBondContact O-N 3.07Å; E112-Y116 PolarHBondContact O-N 3.46Å
113	R	42	Very low	40.6	Very low	131 Å²	131	100.7 Å²	100.7	49%	0.494	51%	0.508	S	S	.	.	H	α-helix	trans	-56.8	-43	169.5	-112.5	178.2	-169.8	179	6.9	112.3	I108 T109 F115 Y116 N117	I108-R113 HydrophobicContact CG2-CB 4.13Å; I108-R113 HydrophobicContact CG2-CG 3.87Å; T109-R113 PolarHBondContact O-N 3.24Å; R113-F115 VanDerWaalsContact C-N 3.32Å; R113-F115 PolarHBondContact O-N 3.38Å; R113-Y116 PolarHBondContact O-N 3.43Å; R113-N117 PolarHBondContact O-N 2.81Å
114	K	46.6	Very low	40.6	Very low	144 Å²	144	97.4 Å²	97.4	63%	0.626	51%	0.509	S	S	*	.	H	α-helix	trans	-62.3	-38	173.3	-73.9	175	179	175	0	112.4	P110 N111 E112 S118	P110-K114 PolarHBondContact O-N 2.93Å; N111-K114 PolarHBondContact O-N 3.14Å; E112-K114 VanDerWaalsContact C-N 3.33Å; E112-K114 PolarHBondContact O-N 2.99Å; K114-S118 WeakPolarHBondContact O-CB 3.15Å; K114-S118 PolarHBondContact O-N 3.46Å; K114-S118 VanDerWaalsContact O-N 3.08Å; K114-S118 PolarHBondContact O-OG 3.28Å
115	F	39.9	Very low	40.8	Very low	96 Å²	96	97 Å²	97	42%	0.421	51%	0.51	S	S	.	.	H	α-helix	trans	-69.4	-39.3	176.8	-134.5	-82.3	0	0	0	112.2	N111 E112 R113 S118 F119	N111-F115 PolarHBondContact O-N 3.47Å; N111-F115 VanDerWaalsContact O-N 3.17Å; E112-F115 CarbonylContact O-C 3.16Å; E112-F115 WeakPolarHBondContact O-CA 3.32Å; E112-F115 WeakPolarHBondContact O-CB 3.37Å; E112-F115 PolarHBondContact O-N 3.07Å; R113-F115 VanDerWaalsContact C-N 3.32Å; R113-F115 PolarHBondContact O-N 3.38Å; F115-S118 WeakPolarHBondContact O-CB 3.16Å; F115-S118 PolarHBondContact O-N 2.81Å; F115-F119 HydrophobicContact CD1-CD2 4.31Å; F115-F119 HydrophobicContact CE1-CD2 4.47Å; F115-F119 HydrophobicContact CE1-CE2 4.37Å; F115-F119 PolarHBondContact O-N 3.19Å
116	Y	38.3	Very low	40.8	Very low	74 Å²	74	99.5 Å²	99.5	29%	0.29	51%	0.514	S	S	.	.	H	α-helix	trans	-63.2	-47	174.1	-116.2	-86.3	0	0	0	112	L17 I108 E112 R113 S118 F119 N120	L17-Y116 HydrophobicContact CD1-CE2 4.09Å; L17-Y116 HydrophobicContact CD2-CE2 3.98Å; I108-Y116 HydrophobicContact CD1-CD2 4.46Å; I108-Y116 HydrophobicContact CD1-CE2 4.48Å; E112-Y116 PolarHBondContact O-N 3.46Å; R113-Y116 PolarHBondContact O-N 3.43Å; Y116-S118 PolarHBondContact O-N 3.44Å; Y116-F119 CarbonylContact O-C 3.5Å; Y116-F119 WeakPolarHBondContact O-CA 3.41Å; Y116-F119 WeakPolarHBondContact O-CB 3.11Å; Y116-F119 PolarHBondContact O-N 3.09Å; Y116-N120 PolarHBondContact O-N 2.75Å
117	N	42.2	Very low	40.8	Very low	100 Å²	100	97.8 Å²	97.8	54%	0.535	51%	0.506	S	S	.	.	H	α-helix	trans	-62.2	-34.1	176	-70.9	-1.5	0	0	0	112.1	R113 F119 N120 H121	R113-N117 PolarHBondContact O-N 2.81Å; N117-F119 VanDerWaalsContact C-N 3.3Å; N117-F119 PolarHBondContact O-N 3.29Å; N117-N120 PolarHBondContact O-N 3.29Å; N117-H121 PolarHBondContact O-N 2.91Å
118	S	44.5	Very low	40.8	Very low	85 Å²	85	95.3 Å²	95.3	59%	0.594	50%	0.497	S	S	*	.	H	α-helix	trans	-67.8	-28.7	172.4	-55.6	0	0	0	0	112.9	K114 F115 Y116	K114-S118 WeakPolarHBondContact O-CB 3.15Å; K114-S118 PolarHBondContact O-N 3.46Å; K114-S118 VanDerWaalsContact O-N 3.08Å; K114-S118 PolarHBondContact O-OG 3.28Å; F115-S118 WeakPolarHBondContact O-CB 3.16Å; F115-S118 PolarHBondContact O-N 2.81Å; Y116-S118 PolarHBondContact O-N 3.44Å
119	F	38	Very low	40.7	Very low	114 Å²	114	96.9 Å²	96.9	50%	0.5	51%	0.505	S	S	.	.	H	α-helix	trans	-80.8	-35.9	175.2	-114	-90.4	0	0	0	112.8	F115 Y116 N117 H121 A122	F115-F119 HydrophobicContact CD1-CD2 4.31Å; F115-F119 HydrophobicContact CE1-CD2 4.47Å; F115-F119 HydrophobicContact CE1-CE2 4.37Å; F115-F119 PolarHBondContact O-N 3.19Å; Y116-F119 CarbonylContact O-C 3.5Å; Y116-F119 WeakPolarHBondContact O-CA 3.41Å; Y116-F119 WeakPolarHBondContact O-CB 3.11Å; Y116-F119 PolarHBondContact O-N 3.09Å; N117-F119 VanDerWaalsContact C-N 3.3Å; N117-F119 PolarHBondContact O-N 3.29Å; F119-H121 PolarHBondContact O-N 3.2Å; F119-A122 WeakPolarHBondContact O-CB 3.33Å; F119-A122 PolarHBondContact O-N 2.82Å
120	N	38	Very low	40.3	Very low	75 Å²	75	97 Å²	97	40%	0.401	50%	0.503	S	S	.	.	H	α-helix	trans	-65.7	-20.2	176.6	-71.7	-12.6	0	0	0	112.9	Y116 N117 A122	Y116-N120 PolarHBondContact O-N 2.75Å; N117-N120 PolarHBondContact O-N 3.29Å; N120-A122 PolarHBondContact O-N 2.96Å
121	H	39.5	Very low	40.5	Very low	171 Å²	171	98 Å²	98	79%	0.792	50%	0.498	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.1	-13.2	168	-103.3	-78.7	0	0	0	114.2	N117 F119 S123	N117-H121 PolarHBondContact O-N 2.91Å; F119-H121 PolarHBondContact O-N 3.2Å; H121-S123 PolarHBondContact O-N 3.3Å
122	A	35.3	Very low	40.5	Very low	47 Å²	47	96.8 Å²	96.8	39%	0.388	49%	0.491	S	S	.	.	S	Bend	trans	-75.5	96.3	172.6	0	0	0	0	0	109.8	F119 N120 S124 V125	F119-A122 WeakPolarHBondContact O-CB 3.33Å; F119-A122 PolarHBondContact O-N 2.82Å; N120-A122 PolarHBondContact O-N 2.96Å; A122-S124 PolarHBondContact O-N 3.33Å; A122-V125 HydrophobicContact CB-CG2 4.31Å; A122-V125 PolarHBondContact O-N 3.49Å
123	S	36.2	Very low	40.3	Very low	89 Å²	89	99.8 Å²	99.8	62%	0.622	50%	0.501	S	S	*	.	H	α-helix	trans	-38.2	-42.7	-175	176.4	0	0	0	0	115.2	H121 V125 K126 H127	H121-S123 PolarHBondContact O-N 3.3Å; S123-V125 VanDerWaalsContact C-N 3.31Å; S123-V125 PolarHBondContact O-N 3.39Å; S123-K126 PolarHBondContact O-N 3.36Å; S123-H127 WeakPolarHBondContact O-CB 3.42Å; S123-H127 PolarHBondContact O-N 2.78Å
124	S	36.2	Very low	40.2	Very low	91 Å²	91	97.3 Å²	97.3	64%	0.636	50%	0.5	S	S	*	.	H	α-helix	trans	-61.8	-30.1	179.1	-51.7	0	0	0	0	114.9	A122 I128	A122-S124 PolarHBondContact O-N 3.33Å; S124-I128 WeakPolarHBondContact O-CD1 3.39Å; S124-I128 VanDerWaalsContact O-CG1 3.29Å; S124-I128 WeakPolarHBondContact O-CG1 3.12Å; S124-I128 PolarHBondContact O-N 3.37Å
125	V	38.4	Very low	39.9	Very low	57 Å²	57	94.3 Å²	94.3	35%	0.345	49%	0.494	S	S	.	.	H	α-helix	trans	-74.8	-47.7	178.4	-178.1	0	0	0	0	109.9	A122 S123 H127 I128 I129	A122-V125 HydrophobicContact CB-CG2 4.31Å; A122-V125 PolarHBondContact O-N 3.49Å; S123-V125 VanDerWaalsContact C-N 3.31Å; S123-V125 PolarHBondContact O-N 3.39Å; V125-H127 VanDerWaalsContact C-N 3.3Å; V125-H127 PolarHBondContact O-N 3.37Å; V125-I128 PolarHBondContact O-N 3.34Å; V125-I129 HydrophobicContact CG1-CD1 4.08Å; V125-I129 WeakPolarHBondContact O-CG1 3.25Å; V125-I129 PolarHBondContact O-N 3.3Å; V125-I129 VanDerWaalsContact O-N 3.11Å
126	K	40.1	Very low	39.6	Very low	123 Å²	123	94.9 Å²	94.9	54%	0.535	50%	0.502	S	S	.	.	H	α-helix	trans	-56	-46.2	173.4	176.7	170	177.2	176.7	0	111	S123 I128 I129 D130	S123-K126 PolarHBondContact O-N 3.36Å; K126-I128 PolarHBondContact O-N 2.99Å; K126-I129 PolarHBondContact O-N 3.23Å; K126-I129 VanDerWaalsContact O-N 3.08Å; K126-D130 WeakPolarHBondContact CE-OD2 3.3Å; K126-D130 VanDerWaalsContact CG-OD2 3.28Å; K126-D130 WeakPolarHBondContact CG-OD2 3.43Å; K126-D130 WeakPolarHBondContact O-CB 3.23Å; K126-D130 VanDerWaalsContact O-CG 3.27Å; K126-D130 PolarHBondContact O-N 3.29Å
127	H	42.1	Very low	39.5	Very low	130 Å²	130	97.4 Å²	97.4	60%	0.602	52%	0.516	S	S	*	.	H	α-helix	trans	-63.9	-25	-178.1	-143.2	-42.6	0	0	0	114.1	S123 V125 H131	S123-H127 WeakPolarHBondContact O-CB 3.42Å; S123-H127 PolarHBondContact O-N 2.78Å; V125-H127 VanDerWaalsContact C-N 3.3Å; V125-H127 PolarHBondContact O-N 3.37Å; H127-H131 WeakPolarHBondContact O-CB 3.42Å; H127-H131 PolarHBondContact O-N 3.32Å
128	I	42.6	Very low	39.2	Very low	93 Å²	93	98.5 Å²	98.5	48%	0.477	53%	0.526	S	S	.	.	H	α-helix	trans	-79	-41.4	173.3	-69.7	165.3	0	0	0	110.7	S124 V125 K126 H131 I132	S124-I128 WeakPolarHBondContact O-CD1 3.39Å; S124-I128 VanDerWaalsContact O-CG1 3.29Å; S124-I128 WeakPolarHBondContact O-CG1 3.12Å; S124-I128 PolarHBondContact O-N 3.37Å; V125-I128 PolarHBondContact O-N 3.34Å; K126-I128 PolarHBondContact O-N 2.99Å; I128-H131 PolarHBondContact O-N 3.47Å; I128-I132 HydrophobicContact CG2-CD1 4.02Å; I128-I132 WeakPolarHBondContact O-CG1 3.46Å; I128-I132 PolarHBondContact O-N 2.97Å
129	I	41.4	Very low	38.7	Very low	73 Å²	73	100.5 Å²	100.5	37%	0.374	54%	0.535	S	S	.	.	H	α-helix	trans	-63.7	-50.3	176.4	-65.6	168.4	0	0	0	110.1	V125 K126 H131 I132 Y133	V125-I129 HydrophobicContact CG1-CD1 4.08Å; V125-I129 WeakPolarHBondContact O-CG1 3.25Å; V125-I129 PolarHBondContact O-N 3.3Å; V125-I129 VanDerWaalsContact O-N 3.11Å; K126-I129 PolarHBondContact O-N 3.23Å; K126-I129 VanDerWaalsContact O-N 3.08Å; I129-H131 VanDerWaalsContact C-N 3.25Å; I129-H131 PolarHBondContact O-N 2.89Å; I129-I132 PolarHBondContact O-N 3.04Å; I129-Y133 HydrophobicContact CG2-CD2 3.79Å; I129-Y133 HydrophobicContact CG2-CE2 3.9Å; I129-Y133 WeakPolarHBondContact O-CD2 3.42Å; I129-Y133 PolarHBondContact O-N 3.49Å
130	D	42.9	Very low	38.3	Very low	72 Å²	72	99.1 Å²	99.1	39%	0.385	54%	0.539	S	S	.	.	H	α-helix	trans	-58.7	-36.4	178.2	-65	-10.8	0	0	0	111.6	K126 T134	K126-D130 WeakPolarHBondContact CE-OD2 3.3Å; K126-D130 VanDerWaalsContact CG-OD2 3.28Å; K126-D130 WeakPolarHBondContact CG-OD2 3.43Å; K126-D130 WeakPolarHBondContact O-CB 3.23Å; K126-D130 VanDerWaalsContact O-CG 3.27Å; K126-D130 PolarHBondContact O-N 3.29Å; D130-T134 WeakPolarHBondContact O-CB 3.46Å; D130-T134 WeakPolarHBondContact O-CG2 3.39Å; D130-T134 PolarHBondContact O-N 3.16Å; D130-T134 PolarHBondContact O-OG1 3.36Å
131	H	43.7	Very low	38	Very low	121 Å²	121	101.1 Å²	101.1	56%	0.56	56%	0.555	S	S	*	*	H	α-helix	trans	-70.5	-34.7	176	-160.8	-45.9	0	0	0	112.5	H127 I128 I129 T134 T135	H127-H131 WeakPolarHBondContact O-CB 3.42Å; H127-H131 PolarHBondContact O-N 3.32Å; I128-H131 PolarHBondContact O-N 3.47Å; I129-H131 VanDerWaalsContact C-N 3.25Å; I129-H131 PolarHBondContact O-N 2.89Å; H131-T134 WeakPolarHBondContact CA-OG1 3.47Å; H131-T134 PolarHBondContact O-OG1 2.95Å; H131-T135 PolarHBondContact ND1-OG1 3.42Å; H131-T135 WeakPolarHBondContact O-CB 3.43Å; H131-T135 PolarHBondContact O-N 2.83Å; H131-T135 PolarHBondContact O-OG1 3.46Å
132	I	40.3	Very low	37.6	Very low	94 Å²	94	100.3 Å²	100.3	48%	0.482	56%	0.556	S	S	.	*	H	α-helix	trans	-70.1	-44	175.1	-69	164.9	0	0	0	110.3	I128 I129 T135 N136	I128-I132 HydrophobicContact CG2-CD1 4.02Å; I128-I132 WeakPolarHBondContact O-CG1 3.46Å; I128-I132 PolarHBondContact O-N 2.97Å; I129-I132 PolarHBondContact O-N 3.04Å; I132-T135 PolarHBondContact O-N 3.26Å; I132-N136 PolarHBondContact O-N 3.38Å
133	Y	37.3	Very low	37.4	Very low	116 Å²	116	104.3 Å²	104.3	46%	0.455	58%	0.579	S	S	.	*	H	α-helix	trans	-59.7	-48.9	175	-92.6	-89.2	0	0	0	112.1	I129 T135 N136 Q137	I129-Y133 HydrophobicContact CG2-CD2 3.79Å; I129-Y133 HydrophobicContact CG2-CE2 3.9Å; I129-Y133 WeakPolarHBondContact O-CD2 3.42Å; I129-Y133 PolarHBondContact O-N 3.49Å; Y133-T135 PolarHBondContact O-N 2.87Å; Y133-N136 PolarHBondContact O-N 2.94Å; Y133-Q137 PolarHBondContact O-N 2.92Å; Y133-Q137 VanDerWaalsContact O-N 3.09Å
134	T	40.9	Very low	37.3	Very low	79 Å²	79	105.5 Å²	105.5	49%	0.485	59%	0.585	S	S	.	*	H	α-helix	trans	-67.9	-32.6	179.6	46.4	0	0	0	0	113.5	D130 H131 N136 V138	D130-T134 WeakPolarHBondContact O-CB 3.46Å; D130-T134 WeakPolarHBondContact O-CG2 3.39Å; D130-T134 PolarHBondContact O-N 3.16Å; D130-T134 PolarHBondContact O-OG1 3.36Å; H131-T134 WeakPolarHBondContact CA-OG1 3.47Å; H131-T134 PolarHBondContact O-OG1 2.95Å; T134-N136 VanDerWaalsContact C-N 3.28Å; T134-N136 PolarHBondContact O-N 2.95Å; T134-V138 VanDerWaalsContact O-CG2 3.27Å; T134-V138 WeakPolarHBondContact O-CG2 3.42Å
135	T	39.7	Very low	37.1	Very low	81 Å²	81	111.6 Å²	111.6	50%	0.497	60%	0.6	S	S	.	*	H	α-helix	trans	-67.2	-31.4	176.1	-52.2	0	0	0	0	111.9	H131 I132 Y133	H131-T135 PolarHBondContact ND1-OG1 3.42Å; H131-T135 WeakPolarHBondContact O-CB 3.43Å; H131-T135 PolarHBondContact O-N 2.83Å; H131-T135 PolarHBondContact O-OG1 3.46Å; I132-T135 PolarHBondContact O-N 3.26Å; Y133-T135 PolarHBondContact O-N 2.87Å
136	N	34.1	Very low	36.9	Very low	108 Å²	108	115.9 Å²	115.9	58%	0.578	62%	0.617	S	S	*	*	H	α-helix	trans	-88.8	-22.9	-178.5	-68	-0.7	0	0	0	113.8	I132 Y133 T134 T139	I132-N136 PolarHBondContact O-N 3.38Å; Y133-N136 PolarHBondContact O-N 2.94Å; T134-N136 VanDerWaalsContact C-N 3.28Å; T134-N136 PolarHBondContact O-N 2.95Å; N136-T139 PolarHBondContact O-OG1 3.38Å
137	Q	35.7	Very low	36.7	Very low	126 Å²	126	120.1 Å²	120.1	59%	0.589	64%	0.635	S	S	*	*	H	α-helix	trans	-83.7	-13.2	178.1	-74.9	-176.7	-16.6	0	0	114.1	Y133 T139 S140	Y133-Q137 PolarHBondContact O-N 2.92Å; Y133-Q137 VanDerWaalsContact O-N 3.09Å; Q137-T139 PolarHBondContact O-N 2.9Å; Q137-S140 PolarHBondContact O-OG 3.24Å
138	V	35.7	Very low	36.2	Very low	123 Å²	123	120.6 Å²	120.6	75%	0.745	64%	0.637	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.4	8.6	-179.8	172.5	0	0	0	0	112.8	T134	T134-V138 VanDerWaalsContact O-CG2 3.27Å; T134-V138 WeakPolarHBondContact O-CG2 3.42Å
139	T	35.4	Very low	35.7	Very low	128 Å²	128	123.6 Å²	123.6	79%	0.785	66%	0.655	S	S	*	*	T	Hydrogen-bonded Turn	trans	-114.3	14.2	174.3	51.2	0	0	0	0	114.2	N136 Q137	N136-T139 PolarHBondContact O-OG1 3.38Å; Q137-T139 PolarHBondContact O-N 2.9Å
140	S	29.3	Very low	35.4	Very low	85 Å²	85	126.4 Å²	126.4	59%	0.594	68%	0.675	S	S	*	*			trans	-137.7	63.8	-173.4	62.7	0	0	0	0	114.2	Q137	Q137-S140 PolarHBondContact O-OG 3.24Å
141	T	31.7	Very low	35	Very low	117 Å²	117	128.3 Å²	128.3	72%	0.718	69%	0.689	S	S	*	*			trans	-141.5	121.1	166.1	51.8	0	0	0	0	111.1
142	D	31.7	Very low	34.5	Very low	154 Å²	154	131 Å²	131	82%	0.824	70%	0.699	S	S	*	*			trans	53.4	95.4	151.6	-47.7	-34.5	0	0	0	120.4
143	C	29.5	Very low	34.3	Very low	130 Å²	130	133.5 Å²	133.5	88%	0.878	71%	0.712	S	S	*	*			trans	-167.5	158.3	132.7	-110.6	0	0	0	0	112.1
144	P	33.6	Very low	34.4	Very low	115 Å²	115	134.7 Å²	134.7	75%	0.747	73%	0.726	S	S	*	*			trans	-86.8	162.5	-167.9	34.4	-36.3	0	0	0	115.3	E146	P144-E146 PolarHBondContact O-N 2.84Å
145	K	32.7	Very low	34.2	Very low	218 Å²	218	132.9 Å²	132.9	95%	0.948	72%	0.717	S	S	*	*			trans	-28.4	95.7	173.7	-59.4	169.9	-178.9	173.2	0	116.1
146	E	34.4	Very low	34.6	Very low	148 Å²	148	133.5 Å²	133.5	69%	0.692	72%	0.722	S	S	*	*			trans	-133.9	145.5	160.4	-166.1	178.6	-132	0	0	111.1	P144 Q148	P144-E146 PolarHBondContact O-N 2.84Å; E146-Q148 HydrophobicContact CB-CG 4.46Å; E146-Q148 HydrophobicContact CG-CG 4.39Å; E146-Q148 PolarHBondContact O-N 3.37Å; E146-Q148 PolarHBondContact OE2-NE2 3.14Å
147	K	35.2	Very low	35.1	Very low	211 Å²	211	135.1 Å²	135.1	92%	0.917	73%	0.725	S	S	*	*			trans	-77.8	61	-176.9	-66.9	179.8	179.6	173.6	0	112.4
148	Q	33.2	Very low	36	Very low	140 Å²	140	133.6 Å²	133.6	65%	0.654	72%	0.724	S	S	*	*			trans	-81	132.8	176.9	-62.4	-165.4	6.4	0	0	111.5	E146 V150	E146-Q148 HydrophobicContact CB-CG 4.46Å; E146-Q148 HydrophobicContact CG-CG 4.39Å; E146-Q148 PolarHBondContact O-N 3.37Å; E146-Q148 PolarHBondContact OE2-NE2 3.14Å; Q148-V150 PolarHBondContact O-N 3.36Å
149	N	32	Very low	37.1	Very low	157 Å²	157	132.7 Å²	132.7	84%	0.84	72%	0.718	S	S	*	*			trans	-66.8	96	173.7	-79.1	-53.7	0	0	0	109.5	T151	N149-T151 VanDerWaalsContact C-N 3.26Å; N149-T151 PolarHBondContact O-N 3.22Å
150	V	34.7	Very low	38.7	Very low	132 Å²	132	131.1 Å²	131.1	80%	0.8	70%	0.704	S	S	*	*			trans	-66	90.8	170.4	-177.4	0	0	0	0	108.3	Q148 K152	Q148-V150 PolarHBondContact O-N 3.36Å; V150-K152 PolarHBondContact O-N 2.94Å
151	T	33.6	Very low	40.6	Very low	111 Å²	111	130.2 Å²	130.2	68%	0.681	70%	0.695	S	S	*	*			trans	-56.8	110.5	171.1	35.3	0	0	0	0	107.7	N149 I153	N149-T151 VanDerWaalsContact C-N 3.26Å; N149-T151 PolarHBondContact O-N 3.22Å; T151-I153 VanDerWaalsContact C-N 3.35Å; T151-I153 PolarHBondContact O-N 2.92Å
152	K	34.8	Very low	42.3	Very low	179 Å²	179	128.3 Å²	128.3	78%	0.778	68%	0.683	S	S	*	*			trans	-63.1	95.6	-178.4	-72.1	-174.2	176.8	-178.2	0	109.7	V150 N154	V150-K152 PolarHBondContact O-N 2.94Å; K152-N154 PolarHBondContact O-N 3.32Å
153	I	34.9	Very low	44.1	Very low	145 Å²	145	123.3 Å²	123.3	74%	0.744	66%	0.659	S	S	*	*			trans	-71.8	73.1	168.4	-55.5	-178.7	0	0	0	107.2	T151 S155	T151-I153 VanDerWaalsContact C-N 3.35Å; T151-I153 PolarHBondContact O-N 2.92Å; I153-S155 PolarHBondContact O-N 2.8Å
154	N	38.5	Very low	46	Very low	141 Å²	141	120.2 Å²	120.2	75%	0.754	64%	0.638	S	S	*	*			trans	-67.8	60.5	168.1	-74.8	-9.8	0	0	0	108.8	K152 P156	K152-N154 PolarHBondContact O-N 3.32Å; N154-P156 WeakPolarHBondContact O-CD 3.43Å
155	S	38	Very low	47.9	Very low	42 Å²	42	117.5 Å²	117.5	29%	0.294	62%	0.622	S	S	.	*			trans	-68	126	-175.6	71	0	0	0	0	109.1	I153 F157	I153-S155 PolarHBondContact O-N 2.8Å; S155-F157 PolarHBondContact O-N 3.25Å; S155-F157 VanDerWaalsContact O-N 3.09Å
156	P	47.1	Very low	50	Low	94 Å²	94	109.9 Å²	109.9	61%	0.61	59%	0.591	S	S	*	*	H	α-helix	trans	-62.1	-15.7	166.8	27.3	-33.9	0	0	0	110.7	N154 V158 T159 I160	N154-P156 WeakPolarHBondContact O-CD 3.43Å; P156-V158 PolarHBondContact O-N 2.79Å; P156-T159 PolarHBondContact O-N 3.35Å; P156-I160 HydrophobicContact CB-CD1 4.1Å; P156-I160 WeakPolarHBondContact O-CB 3.41Å; P156-I160 VanDerWaalsContact O-CG1 3.23Å; P156-I160 WeakPolarHBondContact O-CG1 3.14Å; P156-I160 PolarHBondContact O-N 3.46Å
157	F	44.3	Very low	52.2	Low	142 Å²	142	107.1 Å²	107.1	62%	0.623	58%	0.58	S	S	*	*	H	α-helix	trans	-53.6	-48.1	178.9	-155.9	-92	0	0	0	113.3	S155 T159 I160 V161	S155-F157 PolarHBondContact O-N 3.25Å; S155-F157 VanDerWaalsContact O-N 3.09Å; F157-T159 VanDerWaalsContact C-N 3.35Å; F157-T159 PolarHBondContact O-N 3.44Å; F157-I160 PolarHBondContact O-N 3.06Å; F157-V161 HydrophobicContact CD1-CG2 3.86Å; F157-V161 HydrophobicContact CE1-CG2 3.76Å; F157-V161 WeakPolarHBondContact O-CB 3.27Å; F157-V161 VanDerWaalsContact O-CG2 3.3Å; F157-V161 WeakPolarHBondContact O-CG2 3.39Å; F157-V161 PolarHBondContact O-N 3.21Å
158	V	54.7	Low	54.1	Low	94 Å²	94	100.1 Å²	100.1	57%	0.57	56%	0.555	S	S	*	*	H	α-helix	trans	-62.7	-43.3	178	179	0	0	0	0	111	P156 I160 V161 V162	P156-V158 PolarHBondContact O-N 2.79Å; V158-I160 VanDerWaalsContact C-N 3.34Å; V158-I160 PolarHBondContact O-N 3.46Å; V158-V161 PolarHBondContact O-N 3.38Å; V158-V162 WeakPolarHBondContact O-CG2 3.49Å; V158-V162 PolarHBondContact O-N 3.15Å
159	T	60	Low	56.1	Low	103 Å²	103	97.1 Å²	97.1	63%	0.632	55%	0.547	S	S	*	.	H	α-helix	trans	-65	-38.4	177.8	-55	0	0	0	0	111.7	P156 F157 C163	P156-T159 PolarHBondContact O-N 3.35Å; F157-T159 VanDerWaalsContact C-N 3.35Å; F157-T159 PolarHBondContact O-N 3.44Å; T159-C163 VanDerWaalsContact O-CB 3.25Å; T159-C163 WeakPolarHBondContact O-CB 3.47Å; T159-C163 PolarHBondContact O-N 3.4Å
160	I	69.6	Low	58.3	Low	95 Å²	95	95.1 Å²	95.1	49%	0.487	53%	0.531	S	S	.	.	H	α-helix	trans	-66.3	-45.9	174.8	-71.3	163.9	0	0	0	110.5	P156 F157 V158 C163 C164	P156-I160 HydrophobicContact CB-CD1 4.1Å; P156-I160 WeakPolarHBondContact O-CB 3.41Å; P156-I160 VanDerWaalsContact O-CG1 3.23Å; P156-I160 WeakPolarHBondContact O-CG1 3.14Å; P156-I160 PolarHBondContact O-N 3.46Å; F157-I160 PolarHBondContact O-N 3.06Å; V158-I160 VanDerWaalsContact C-N 3.34Å; V158-I160 PolarHBondContact O-N 3.46Å; I160-C163 CarbonylContact O-C 3.55Å; I160-C163 PolarHBondContact O-N 3.38Å; I160-C164 WeakPolarHBondContact O-CB 3.37Å; I160-C164 PolarHBondContact O-N 2.83Å; I160-C164 PolarHBondContact O-SG 2.9Å; I160-C164 VanDerWaalsContact O-SG 3.35Å
161	V	67.7	Low	60.3	Low	66 Å²	66	95.4 Å²	95.4	40%	0.4	52%	0.521	S	S	.	.	H	α-helix	trans	-60.1	-49.7	177.1	168	0	0	0	0	110.5	F157 V158 C163 C164 C165	F157-V161 HydrophobicContact CD1-CG2 3.86Å; F157-V161 HydrophobicContact CE1-CG2 3.76Å; F157-V161 WeakPolarHBondContact O-CB 3.27Å; F157-V161 VanDerWaalsContact O-CG2 3.3Å; F157-V161 WeakPolarHBondContact O-CG2 3.39Å; F157-V161 PolarHBondContact O-N 3.21Å; V158-V161 PolarHBondContact O-N 3.38Å; V161-C163 VanDerWaalsContact C-N 3.3Å; V161-C163 PolarHBondContact O-N 2.96Å; V161-C164 CarbonylContact O-C 3.59Å; V161-C164 WeakPolarHBondContact O-CB 3.32Å; V161-C164 PolarHBondContact O-N 3.12Å; V161-C164 VanDerWaalsContact O-N 3.14Å; V161-C165 PolarHBondContact O-N 3.08Å; V161-C165 PolarHBondContact O-SG 3.26Å
162	V	69.1	Low	62.7	Low	77 Å²	77	95.5 Å²	95.5	47%	0.467	52%	0.517	S	S	.	.	H	α-helix	trans	-60.3	-40.2	176	172.4	0	0	0	0	111.3	V158 C165 I166	V158-V162 WeakPolarHBondContact O-CG2 3.49Å; V158-V162 PolarHBondContact O-N 3.15Å; V162-C165 PolarHBondContact O-N 2.83Å; V162-I166 HydrophobicContact CG1-CD1 4.01Å; V162-I166 WeakPolarHBondContact O-CG1 3.29Å; V162-I166 PolarHBondContact O-N 3.12Å
163	C	67.6	Low	65	Low	49 Å²	49	91 Å²	91	33%	0.331	50%	0.501	S	S	.	.	H	α-helix	trans	-65.2	-40.6	175.5	-161.8	0	0	0	0	112.2	T159 I160 V161 I166 L167	T159-C163 VanDerWaalsContact O-CB 3.25Å; T159-C163 WeakPolarHBondContact O-CB 3.47Å; T159-C163 PolarHBondContact O-N 3.4Å; I160-C163 CarbonylContact O-C 3.55Å; I160-C163 PolarHBondContact O-N 3.38Å; V161-C163 VanDerWaalsContact C-N 3.3Å; V161-C163 PolarHBondContact O-N 2.96Å; C163-I166 PolarHBondContact O-N 3.45Å; C163-L167 WeakPolarHBondContact O-CB 3.36Å; C163-L167 VanDerWaalsContact O-CG 3.28Å; C163-L167 WeakPolarHBondContact O-CG 3.28Å; C163-L167 PolarHBondContact O-N 3.41Å
164	C	71	Confident	67.4	Low	65 Å²	65	86.3 Å²	86.3	44%	0.439	48%	0.479	S	S	.	.	H	α-helix	trans	-65.6	-37.2	174.1	-75	0	0	0	0	112.2	I160 V161 L167 T168	I160-C164 WeakPolarHBondContact O-CB 3.37Å; I160-C164 PolarHBondContact O-N 2.83Å; I160-C164 PolarHBondContact O-SG 2.9Å; I160-C164 VanDerWaalsContact O-SG 3.35Å; V161-C164 CarbonylContact O-C 3.59Å; V161-C164 WeakPolarHBondContact O-CB 3.32Å; V161-C164 PolarHBondContact O-N 3.12Å; V161-C164 VanDerWaalsContact O-N 3.14Å; C164-L167 PolarHBondContact O-N 3.44Å; C164-T168 WeakPolarHBondContact O-CB 3.33Å; C164-T168 VanDerWaalsContact O-CG2 3.3Å; C164-T168 WeakPolarHBondContact O-CG2 3.48Å; C164-T168 PolarHBondContact O-N 2.94Å; C164-T168 PolarHBondContact O-OG1 3.44Å
165	C	72.5	Confident	69.4	Low	58 Å²	58	83.9 Å²	83.9	39%	0.392	47%	0.466	S	S	.	.	H	α-helix	trans	-63.6	-42.9	172.2	-69.3	0	0	0	0	111.8	V161 V162 T168 T169	V161-C165 PolarHBondContact O-N 3.08Å; V161-C165 PolarHBondContact O-SG 3.26Å; V162-C165 PolarHBondContact O-N 2.83Å; C165-T168 WeakPolarHBondContact CA-OG1 3.47Å; C165-T168 PolarHBondContact O-OG1 3.1Å; C165-T169 WeakPolarHBondContact O-CB 3.44Å; C165-T169 WeakPolarHBondContact O-CG2 3.3Å; C165-T169 PolarHBondContact O-N 2.89Å; C165-T169 PolarHBondContact O-OG1 3.27Å
166	I	77.9	Confident	71.4	Confident	59 Å²	59	88.2 Å²	88.2	30%	0.303	48%	0.479	S	S	.	.	H	α-helix	trans	-65.5	-43.1	175.3	-66.9	165.2	0	0	0	111	V162 C163 T169 F170	V162-I166 HydrophobicContact CG1-CD1 4.01Å; V162-I166 WeakPolarHBondContact O-CG1 3.29Å; V162-I166 PolarHBondContact O-N 3.12Å; C163-I166 PolarHBondContact O-N 3.45Å; I166-T169 WeakPolarHBondContact CA-OG1 3.43Å; I166-T169 PolarHBondContact O-OG1 3.23Å; I166-T169 VanDerWaalsContact O-OG1 3.05Å; I166-F170 WeakPolarHBondContact O-CB 3.5Å; I166-F170 PolarHBondContact O-N 3Å
167	L	79.5	Confident	73.1	Confident	89 Å²	89	87 Å²	87	47%	0.466	47%	0.468	S	S	.	.	H	α-helix	trans	-67.5	-43.9	178.3	-72.1	169.3	0	0	0	112.1	C163 C164 F170 F171	C163-L167 WeakPolarHBondContact O-CB 3.36Å; C163-L167 VanDerWaalsContact O-CG 3.28Å; C163-L167 WeakPolarHBondContact O-CG 3.28Å; C163-L167 PolarHBondContact O-N 3.41Å; C164-L167 PolarHBondContact O-N 3.44Å; L167-F170 PolarHBondContact O-N 2.79Å; L167-F171 WeakPolarHBondContact O-CB 3.26Å; L167-F171 VanDerWaalsContact O-CD2 3.26Å; L167-F171 WeakPolarHBondContact O-CD2 3.44Å; L167-F171 PolarHBondContact O-N 2.85Å
168	T	75.4	Confident	74.8	Confident	65 Å²	65	86.4 Å²	86.4	40%	0.399	46%	0.461	S	S	.	.	H	α-helix	trans	-67.8	-40.9	178.6	49.8	0	0	0	0	112.1	C164 C165 F170 F171 L172	C164-T168 WeakPolarHBondContact O-CB 3.33Å; C164-T168 VanDerWaalsContact O-CG2 3.3Å; C164-T168 WeakPolarHBondContact O-CG2 3.48Å; C164-T168 PolarHBondContact O-N 2.94Å; C164-T168 PolarHBondContact O-OG1 3.44Å; C165-T168 WeakPolarHBondContact CA-OG1 3.47Å; C165-T168 PolarHBondContact O-OG1 3.1Å; T168-F170 PolarHBondContact O-N 3.46Å; T168-F171 PolarHBondContact O-N 2.95Å; T168-L172 WeakPolarHBondContact O-CB 3.5Å; T168-L172 VanDerWaalsContact O-CG 3.27Å; T168-L172 WeakPolarHBondContact O-CG 3.42Å; T168-L172 PolarHBondContact O-N 3.17Å
169	T	74.8	Confident	75.9	Confident	77 Å²	77	85.3 Å²	85.3	47%	0.472	46%	0.457	S	S	.	.	H	α-helix	trans	-63.4	-39.4	172.7	50.4	0	0	0	0	112	C165 I166 L172 L173	C165-T169 WeakPolarHBondContact O-CB 3.44Å; C165-T169 WeakPolarHBondContact O-CG2 3.3Å; C165-T169 PolarHBondContact O-N 2.89Å; C165-T169 PolarHBondContact O-OG1 3.27Å; I166-T169 WeakPolarHBondContact CA-OG1 3.43Å; I166-T169 PolarHBondContact O-OG1 3.23Å; I166-T169 VanDerWaalsContact O-OG1 3.05Å; T169-L172 PolarHBondContact O-N 2.82Å; T169-L173 VanDerWaalsContact O-CB 3.32Å; T169-L173 WeakPolarHBondContact O-CB 3.32Å; T169-L173 PolarHBondContact O-N 2.87Å
170	F	77.7	Confident	76.7	Confident	115 Å²	115	86.8 Å²	86.8	50%	0.504	45%	0.451	S	S	.	.	H	α-helix	trans	-62.8	-45.7	172.3	-172.8	-95.6	0	0	0	112.3	I166 L167 T168 L172 L173 V174	I166-F170 WeakPolarHBondContact O-CB 3.5Å; I166-F170 PolarHBondContact O-N 3Å; L167-F170 PolarHBondContact O-N 2.79Å; T168-F170 PolarHBondContact O-N 3.46Å; F170-L172 PolarHBondContact O-N 3.37Å; F170-L173 PolarHBondContact O-N 2.86Å; F170-V174 HydrophobicContact CD1-CG2 4.14Å; F170-V174 HydrophobicContact CE1-CG2 3.83Å; F170-V174 HydrophobicContact CZ-CG2 4.13Å; F170-V174 WeakPolarHBondContact O-CG2 3.23Å; F170-V174 PolarHBondContact O-N 3.46Å
171	F	78.7	Confident	76.9	Confident	137 Å²	137	84.5 Å²	84.5	60%	0.601	44%	0.443	S	S	*	.	H	α-helix	trans	-61.3	-42.5	174.8	-91	-69.8	0	0	0	112.3	L167 T168 V174 L175	L167-F171 WeakPolarHBondContact O-CB 3.26Å; L167-F171 VanDerWaalsContact O-CD2 3.26Å; L167-F171 WeakPolarHBondContact O-CD2 3.44Å; L167-F171 PolarHBondContact O-N 2.85Å; T168-F171 PolarHBondContact O-N 2.95Å; F171-V174 PolarHBondContact O-N 3.23Å; F171-L175 VanDerWaalsContact O-CB 3.31Å; F171-L175 WeakPolarHBondContact O-CB 3.36Å; F171-L175 VanDerWaalsContact O-CG 3.24Å; F171-L175 WeakPolarHBondContact O-CG 3.28Å; F171-L175 PolarHBondContact O-N 3.07Å
172	L	83.9	Confident	77.1	Confident	114 Å²	114	87.7 Å²	87.7	60%	0.597	45%	0.452	S	S	*	.	H	α-helix	trans	-64.6	-38.9	175.7	-73.8	170.6	0	0	0	111.9	T168 T169 F170 L175 F176	T168-L172 WeakPolarHBondContact O-CB 3.5Å; T168-L172 VanDerWaalsContact O-CG 3.27Å; T168-L172 WeakPolarHBondContact O-CG 3.42Å; T168-L172 PolarHBondContact O-N 3.17Å; T169-L172 PolarHBondContact O-N 2.82Å; F170-L172 PolarHBondContact O-N 3.37Å; L172-L175 PolarHBondContact O-N 2.65Å; L172-F176 VanDerWaalsContact O-CB 3.3Å; L172-F176 WeakPolarHBondContact O-CB 3.01Å; L172-F176 PolarHBondContact O-N 3Å
173	L	82.3	Confident	77.2	Confident	85 Å²	85	88.4 Å²	88.4	45%	0.445	45%	0.452	S	S	.	.	H	α-helix	trans	-66.5	-44.6	175.2	-172.4	151.7	0	0	0	111.2	T169 F170 L175 F176 L177	T169-L173 VanDerWaalsContact O-CB 3.32Å; T169-L173 WeakPolarHBondContact O-CB 3.32Å; T169-L173 PolarHBondContact O-N 2.87Å; F170-L173 PolarHBondContact O-N 2.86Å; L173-L175 VanDerWaalsContact C-N 3.35Å; L173-L175 PolarHBondContact O-N 3.35Å; L173-F176 PolarHBondContact O-N 3.3Å; L173-L177 HydrophobicContact CD2-CD1 3.67Å; L173-L177 HydrophobicContact CD2-CG 4.21Å; L173-L177 WeakPolarHBondContact O-CG 3.39Å; L173-L177 PolarHBondContact O-N 3.05Å
174	V	84.3	Confident	77.2	Confident	46 Å²	46	91.5 Å²	91.5	28%	0.279	46%	0.457	S	S	.	.	H	α-helix	trans	-62.8	-40.1	174.2	170.3	0	0	0	0	111.4	F170 F171 R178	F170-V174 HydrophobicContact CD1-CG2 4.14Å; F170-V174 HydrophobicContact CE1-CG2 3.83Å; F170-V174 HydrophobicContact CZ-CG2 4.13Å; F170-V174 WeakPolarHBondContact O-CG2 3.23Å; F170-V174 PolarHBondContact O-N 3.46Å; F171-V174 PolarHBondContact O-N 3.23Å; V174-R178 WeakPolarHBondContact O-CB 3.08Å; V174-R178 WeakPolarHBondContact O-CG 3.21Å; V174-R178 PolarHBondContact O-N 3.34Å
175	L	81.9	Confident	77.2	Confident	90 Å²	90	95 Å²	95	47%	0.471	46%	0.461	S	S	.	.	H	α-helix	trans	-64.4	-43.2	173	-77.2	167.5	0	0	0	111.7	F171 L172 L173 R178 C179	F171-L175 VanDerWaalsContact O-CB 3.31Å; F171-L175 WeakPolarHBondContact O-CB 3.36Å; F171-L175 VanDerWaalsContact O-CG 3.24Å; F171-L175 WeakPolarHBondContact O-CG 3.28Å; F171-L175 PolarHBondContact O-N 3.07Å; L172-L175 PolarHBondContact O-N 2.65Å; L173-L175 VanDerWaalsContact C-N 3.35Å; L173-L175 PolarHBondContact O-N 3.35Å; L175-R178 PolarHBondContact O-N 3.34Å; L175-C179 WeakPolarHBondContact O-CB 3.34Å; L175-C179 PolarHBondContact O-N 3.1Å; L175-C179 PolarHBondContact O-SG 3.29Å; L175-C179 VanDerWaalsContact O-SG 3.36Å
176	F	80.2	Confident	77	Confident	132 Å²	132	98.4 Å²	98.4	58%	0.579	47%	0.469	S	S	*	.	H	α-helix	trans	-63.7	-42.6	177.1	-173.8	-100.7	0	0	0	111.8	L172 L173 C179 R180	L172-F176 VanDerWaalsContact O-CB 3.3Å; L172-F176 WeakPolarHBondContact O-CB 3.01Å; L172-F176 PolarHBondContact O-N 3Å; L173-F176 PolarHBondContact O-N 3.3Å; F176-C179 PolarHBondContact O-N 3.29Å; F176-R180 VanDerWaalsContact O-CB 3.31Å; F176-R180 WeakPolarHBondContact O-CB 3.22Å; F176-R180 PolarHBondContact O-N 3.42Å
177	L	82.1	Confident	76.4	Confident	70 Å²	70	101.2 Å²	101.2	37%	0.366	48%	0.481	S	S	.	.	H	α-helix	trans	-64	-42	173.1	-69.9	179.9	0	0	0	112.1	F10 L173 S181	F10-L177 HydrophobicContact CE1-CD2 4.18Å; F10-L177 HydrophobicContact CZ-CD2 3.81Å; L173-L177 HydrophobicContact CD2-CD1 3.67Å; L173-L177 HydrophobicContact CD2-CG 4.21Å; L173-L177 WeakPolarHBondContact O-CG 3.39Å; L173-L177 PolarHBondContact O-N 3.05Å; L177-S181 WeakPolarHBondContact O-CB 3.47Å; L177-S181 PolarHBondContact O-N 2.98Å
178	R	80.7	Confident	75.8	Confident	129 Å²	129	101.9 Å²	101.9	49%	0.487	48%	0.484	S	S	.	.	H	α-helix	trans	-61.5	-44.3	172.9	-82	176.9	158	-177.5	-10.5	111.4	V174 L175 S181 F182 M933	V174-R178 WeakPolarHBondContact O-CB 3.08Å; V174-R178 WeakPolarHBondContact O-CG 3.21Å; V174-R178 PolarHBondContact O-N 3.34Å; L175-R178 PolarHBondContact O-N 3.34Å; R178-S181 PolarHBondContact O-N 3.23Å; R178-F182 WeakPolarHBondContact O-CB 3.32Å; R178-F182 PolarHBondContact O-N 3.24Å; R178-M933 PolarHBondContact NH2-O 2.95Å
179	C	76.7	Confident	75	Confident	71 Å²	71	103.3 Å²	103.3	48%	0.48	49%	0.489	S	S	.	.	H	α-helix	trans	-64.8	-46	176.3	-76.7	0	0	0	0	112.6	L175 F176 S181 F182 I183	L175-C179 WeakPolarHBondContact O-CB 3.34Å; L175-C179 PolarHBondContact O-N 3.1Å; L175-C179 PolarHBondContact O-SG 3.29Å; L175-C179 VanDerWaalsContact O-SG 3.36Å; F176-C179 PolarHBondContact O-N 3.29Å; C179-S181 VanDerWaalsContact C-N 3.32Å; C179-S181 PolarHBondContact O-N 3.43Å; C179-F182 PolarHBondContact O-N 2.97Å; C179-I183 WeakPolarHBondContact O-CB 3.45Å; C179-I183 VanDerWaalsContact O-CG1 3.27Å; C179-I183 WeakPolarHBondContact O-CG1 3.31Å; C179-I183 PolarHBondContact O-N 3.25Å
180	R	76.7	Confident	74.2	Confident	134 Å²	134	107.2 Å²	107.2	51%	0.506	50%	0.499	S	S	.	.	H	α-helix	trans	-62.2	-39.5	176.1	-171.2	173.1	175.1	120.2	-8.9	111.5	F176 R184	F176-R180 VanDerWaalsContact O-CB 3.31Å; F176-R180 WeakPolarHBondContact O-CB 3.22Å; F176-R180 PolarHBondContact O-N 3.42Å; R180-R184 WeakPolarHBondContact O-CB 3.43Å; R180-R184 WeakPolarHBondContact O-CG 3.32Å; R180-R184 PolarHBondContact O-N 3.09Å
181	S	74.2	Confident	73	Confident	47 Å²	47	111.3 Å²	111.3	33%	0.329	51%	0.512	S	S	.	.	H	α-helix	trans	-64.7	-43.5	171.7	-177.3	0	0	0	0	112.4	L177 R178 C179 R184 R185	L177-S181 WeakPolarHBondContact O-CB 3.47Å; L177-S181 PolarHBondContact O-N 2.98Å; R178-S181 PolarHBondContact O-N 3.23Å; C179-S181 VanDerWaalsContact C-N 3.32Å; C179-S181 PolarHBondContact O-N 3.43Å; S181-R184 PolarHBondContact O-N 3.17Å; S181-R185 WeakPolarHBondContact O-CB 3.46Å; S181-R185 WeakPolarHBondContact O-CG 3.38Å; S181-R185 PolarHBondContact O-N 3.3Å
182	F	72.2	Confident	71.7	Confident	132 Å²	132	115 Å²	115	58%	0.579	52%	0.522	S	S	*	.	H	α-helix	trans	-65.9	-40	177.1	-174.4	-100.7	0	0	0	112.4	R178 C179 R185 K186	R178-F182 WeakPolarHBondContact O-CB 3.32Å; R178-F182 PolarHBondContact O-N 3.24Å; C179-F182 PolarHBondContact O-N 2.97Å; F182-R185 PolarHBondContact O-N 3.43Å; F182-K186 HydrophobicContact CE1-CD 4.25Å; F182-K186 VanDerWaalsContact O-CB 3.26Å; F182-K186 WeakPolarHBondContact O-CB 3.21Å; F182-K186 PolarHBondContact O-N 3.14Å
183	I	71.7	Confident	69.9	Low	92 Å²	92	119.5 Å²	119.5	47%	0.472	53%	0.531	S	S	.	.	H	α-helix	trans	-63.9	-47.5	174.1	-69	163.7	0	0	0	110.3	C179 R185 K186 Q187	C179-I183 WeakPolarHBondContact O-CB 3.45Å; C179-I183 VanDerWaalsContact O-CG1 3.27Å; C179-I183 WeakPolarHBondContact O-CG1 3.31Å; C179-I183 PolarHBondContact O-N 3.25Å; I183-R185 PolarHBondContact O-N 2.88Å; I183-K186 PolarHBondContact O-N 3.3Å; I183-K186 VanDerWaalsContact O-N 3.17Å; I183-Q187 WeakPolarHBondContact O-CG 3.48Å; I183-Q187 PolarHBondContact O-N 2.63Å
184	R	67.5	Low	67.6	Low	115 Å²	115	121.6 Å²	121.6	43%	0.434	54%	0.542	S	S	.	.	H	α-helix	trans	-56.9	-47.3	173.1	-80.3	-178.8	166.5	-173.2	-6.6	111.6	R180 S181 K186 Q187 L188	R180-R184 WeakPolarHBondContact O-CB 3.43Å; R180-R184 WeakPolarHBondContact O-CG 3.32Å; R180-R184 PolarHBondContact O-N 3.09Å; S181-R184 PolarHBondContact O-N 3.17Å; R184-K186 PolarHBondContact O-N 3.43Å; R184-Q187 PolarHBondContact O-N 2.86Å; R184-L188 WeakPolarHBondContact O-CG 3.39Å; R184-L188 PolarHBondContact O-N 2.81Å
185	R	70	Confident	65.2	Low	139 Å²	139	122.9 Å²	122.9	53%	0.525	55%	0.551	S	S	.	*	H	α-helix	trans	-59.6	-42.1	174.6	-76	176.8	172.9	-172.5	-3.2	112.2	S181 F182 I183 L188 L189	S181-R185 WeakPolarHBondContact O-CB 3.46Å; S181-R185 WeakPolarHBondContact O-CG 3.38Å; S181-R185 PolarHBondContact O-N 3.3Å; F182-R185 PolarHBondContact O-N 3.43Å; I183-R185 PolarHBondContact O-N 2.88Å; R185-L188 PolarHBondContact O-N 2.82Å; R185-L189 WeakPolarHBondContact O-CB 3.32Å; R185-L189 PolarHBondContact O-N 2.71Å
186	K	69	Low	62.9	Low	129 Å²	129	128.1 Å²	128.1	56%	0.561	57%	0.57	S	S	*	*	H	α-helix	trans	-69.4	-33.1	178.7	-166.7	172.1	-176.8	177.7	0	112.6	F182 I183 R184 K190	F182-K186 HydrophobicContact CE1-CD 4.25Å; F182-K186 VanDerWaalsContact O-CB 3.26Å; F182-K186 WeakPolarHBondContact O-CB 3.21Å; F182-K186 PolarHBondContact O-N 3.14Å; I183-K186 PolarHBondContact O-N 3.3Å; I183-K186 VanDerWaalsContact O-N 3.17Å; R184-K186 PolarHBondContact O-N 3.43Å; K186-K190 PolarHBondContact O-N 3.46Å
187	Q	65.6	Low	60.4	Low	117 Å²	117	130.5 Å²	130.5	55%	0.547	58%	0.577	S	S	.	*	H	α-helix	trans	-68.6	-44.7	170.6	-73.3	172	-16.7	0	0	111.6	I183 R184 L189 K190 R191	I183-Q187 WeakPolarHBondContact O-CG 3.48Å; I183-Q187 PolarHBondContact O-N 2.63Å; R184-Q187 PolarHBondContact O-N 2.86Å; Q187-L189 PolarHBondContact O-N 3.28Å; Q187-K190 WeakPolarHBondContact O-CB 3.34Å; Q187-K190 PolarHBondContact O-N 3.5Å; Q187-R191 PolarHBondContact O-N 2.86Å
188	L	65.6	Low	58	Low	103 Å²	103	135.5 Å²	135.5	54%	0.539	60%	0.603	S	S	.	*	H	α-helix	trans	-63.3	-38.7	174.4	-70.9	168.2	0	0	0	112.2	R184 R185 R191 R192	R184-L188 WeakPolarHBondContact O-CG 3.39Å; R184-L188 PolarHBondContact O-N 2.81Å; R185-L188 PolarHBondContact O-N 2.82Å; L188-R191 PolarHBondContact O-N 3.5Å; L188-R192 PolarHBondContact O-N 2.65Å
189	L	60.2	Low	55.4	Low	95 Å²	95	136.9 Å²	136.9	50%	0.497	61%	0.609	S	S	.	*	H	α-helix	trans	-68.4	-33.7	172.9	-88.5	152.4	0	0	0	112.9	R185 Q187 R193	R185-L189 WeakPolarHBondContact O-CB 3.32Å; R185-L189 PolarHBondContact O-N 2.71Å; Q187-L189 PolarHBondContact O-N 3.28Å; L189-R193 WeakPolarHBondContact O-CB 3.36Å; L189-R193 WeakPolarHBondContact O-CG 3.31Å; L189-R193 PolarHBondContact O-N 3.03Å
190	K	56	Low	53.1	Low	159 Å²	159	139 Å²	139	69%	0.691	62%	0.623	S	S	*	*	H	α-helix	trans	-63.9	-43.8	168.1	-85.3	-169.5	170.2	-168.1	0	111.4	K186 Q187 R193 N194	K186-K190 PolarHBondContact O-N 3.46Å; Q187-K190 WeakPolarHBondContact O-CB 3.34Å; Q187-K190 PolarHBondContact O-N 3.5Å; K190-R193 PolarHBondContact O-N 3.03Å; K190-N194 PolarHBondContact O-N 3.05Å
191	R	52.9	Low	50.8	Low	201 Å²	201	138.3 Å²	138.3	76%	0.758	64%	0.64	S	S	*	*	H	α-helix	trans	-63.4	-40.4	174.7	-73.9	-175.7	174.8	-179.2	-2.4	112.4	Q187 L188 R193 N194	Q187-R191 PolarHBondContact O-N 2.86Å; L188-R191 PolarHBondContact O-N 3.5Å; R191-R193 PolarHBondContact O-N 3.35Å; R191-N194 CarbonylContact O-C 3.32Å; R191-N194 VanDerWaalsContact O-C 3.32Å; R191-N194 PolarHBondContact O-N 3.05Å
192	R	51.6	Low	48.8	Very low	216 Å²	216	145 Å²	145	82%	0.815	66%	0.662	S	S	*	*	H	α-helix	trans	-73.2	-20.8	176	-74.1	-173.3	176.5	-175.7	-1	114.4	L188	L188-R192 PolarHBondContact O-N 2.65Å
193	R	46.2	Very low	46.9	Very low	207 Å²	207	148.6 Å²	148.6	78%	0.781	67%	0.674	S	S	*	*	H	α-helix	trans	-83.2	-19.2	174.4	-81.4	-175.4	173.6	-177.9	-2.2	114.3	L189 K190 R191 P195	L189-R193 WeakPolarHBondContact O-CB 3.36Å; L189-R193 WeakPolarHBondContact O-CG 3.31Å; L189-R193 PolarHBondContact O-N 3.03Å; K190-R193 PolarHBondContact O-N 3.03Å; R191-R193 PolarHBondContact O-N 3.35Å; R193-P195 VanDerWaalsContact C-CD 3.41Å; R193-P195 WeakPolarHBondContact O-CD 3.24Å
194	N	33.8	Very low	44.9	Very low	129 Å²	129	149.7 Å²	149.7	69%	0.69	69%	0.689	S	S	*	*	S	Bend	trans	-111.7	80.3	162.9	-80.6	-8.2	0	0	0	108.6	K190 R191 K196	K190-N194 PolarHBondContact O-N 3.05Å; R191-N194 CarbonylContact O-C 3.32Å; R191-N194 VanDerWaalsContact O-C 3.32Å; R191-N194 PolarHBondContact O-N 3.05Å; N194-K196 PolarHBondContact O-N 2.72Å
195	P	33.4	Very low	43.1	Very low	73 Å²	73	153.6 Å²	153.6	47%	0.474	71%	0.71	S	S	.	*			trans	-63.4	91.5	164.9	29.6	-33.3	0	0	0	108.1	R193 Y197	R193-P195 VanDerWaalsContact C-CD 3.41Å; R193-P195 WeakPolarHBondContact O-CD 3.24Å; P195-Y197 HydrophobicContact CB-CD2 4.13Å; P195-Y197 HydrophobicContact CB-CE2 3.83Å; P195-Y197 HydrophobicContact CG-CD2 4.38Å; P195-Y197 HydrophobicContact CG-CE2 3.81Å; P195-Y197 WeakPolarHBondContact O-CD2 3.27Å; P195-Y197 PolarHBondContact O-N 3.35Å
196	K	33.7	Very low	41.5	Very low	200 Å²	200	151.4 Å²	151.4	87%	0.87	72%	0.715	S	S	*	*			trans	-64.9	87.3	156	-84.5	-161.3	170.3	-162.7	0	105.9	N194 L198	N194-K196 PolarHBondContact O-N 2.72Å; K196-L198 PolarHBondContact O-N 3.2Å
197	Y	29.7	Very low	39.9	Very low	183 Å²	183	154.5 Å²	154.5	72%	0.718	73%	0.729	S	S	*	*			trans	-57.7	109.4	165.9	-69.1	-83	0	0	0	106.8	P195 Y199	P195-Y197 HydrophobicContact CB-CD2 4.13Å; P195-Y197 HydrophobicContact CB-CE2 3.83Å; P195-Y197 HydrophobicContact CG-CD2 4.38Å; P195-Y197 HydrophobicContact CG-CE2 3.81Å; P195-Y197 WeakPolarHBondContact O-CD2 3.27Å; P195-Y197 PolarHBondContact O-N 3.35Å; Y197-Y199 PolarHBondContact O-N 2.94Å
198	L	30.5	Very low	38.6	Very low	174 Å²	174	154.8 Å²	154.8	91%	0.911	74%	0.741	S	S	*	*			trans	-71.6	77.6	164.5	-87.8	158.9	0	0	0	106.9	K196 C200	K196-L198 PolarHBondContact O-N 3.2Å; L198-C200 PolarHBondContact O-N 2.67Å
199	Y	26.4	Very low	37.1	Very low	159 Å²	159	156.7 Å²	156.7	62%	0.624	75%	0.75	S	S	*	*			trans	-66.7	112.3	174.4	-127.3	-90.5	0	0	0	107.5	Y197 S201	Y197-Y199 PolarHBondContact O-N 2.94Å; Y199-S201 PolarHBondContact O-N 2.81Å; Y199-S201 VanDerWaalsContact O-N 3.16Å
200	C	28.9	Very low	35.7	Very low	114 Å²	114	159 Å²	159	77%	0.77	76%	0.763	S	S	*	*			trans	-62.8	117.7	168	-72.6	0	0	0	0	108.1	L198 K202	L198-C200 PolarHBondContact O-N 2.67Å; C200-K202 PolarHBondContact O-N 2.99Å
201	S	28.1	Very low	34.6	Very low	121 Å²	121	159.3 Å²	159.3	85%	0.846	77%	0.767	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.1	63	-167.4	56.5	0	0	0	0	112.9	Y199	Y199-S201 PolarHBondContact O-N 2.81Å; Y199-S201 VanDerWaalsContact O-N 3.16Å
202	K	32.7	Very low	33.6	Very low	186 Å²	186	154.3 Å²	154.3	81%	0.809	76%	0.762	S	S	*	*	T	Hydrogen-bonded Turn	trans	-139.7	6.9	176.8	-76.4	-158.5	172.5	-172.3	0	116.3	C200	C200-K202 PolarHBondContact O-N 2.99Å
203	Y	31	Very low	32.6	Very low	209 Å²	209	155 Å²	155	82%	0.82	77%	0.766	S	S	*	*	S	Bend	trans	-135.3	141.9	173.9	-76.2	-77.7	0	0	0	113
204	S	29.9	Very low	32	Very low	114 Å²	114	152.5 Å²	152.5	80%	0.797	77%	0.766	S	S	*	*			trans	-95	122.5	-166.3	34	0	0	0	0	114.2	S206	S204-S206 PolarHBondContact O-N 3.07Å
205	K	29.2	Very low	31.7	Very low	198 Å²	198	155.3 Å²	155.3	86%	0.861	77%	0.772	S	S	*	*			trans	36.5	60.7	153.9	-62.8	-178.3	177.9	177.3	0	117.5
206	S	37.9	Very low	31.8	Very low	92 Å²	92	155.8 Å²	155.8	64%	0.643	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-72.5	125.9	166.4	63.7	0	0	0	0	111.9	S204	S204-S206 PolarHBondContact O-N 3.07Å
207	K	35.6	Very low	31.8	Very low	194 Å²	194	153 Å²	153	84%	0.843	78%	0.777	S	S	*	*	P	Polyproline II helix	trans	-62	149.6	-178.1	-67.4	175.1	-179.6	174.6	0	112.7	I209	K207-I209 PolarHBondContact O-N 3.47Å
208	P	36.7	Very low	31.9	Very low	124 Å²	124	151.5 Å²	151.5	81%	0.805	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-66.4	132.1	178.4	27.5	-34.6	0	0	0	112	N210	P208-N210 PolarHBondContact O-N 2.83Å
209	I	34.3	Very low	32.1	Very low	143 Å²	143	148 Å²	148	73%	0.733	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-70.6	118.4	178.4	-62.8	173.5	0	0	0	109.5	K207 H211	K207-I209 PolarHBondContact O-N 3.47Å; I209-H211 PolarHBondContact O-N 2.82Å
210	N	31.6	Very low	32.3	Very low	144 Å²	144	146.7 Å²	146.7	77%	0.77	78%	0.784	S	S	*	*			trans	-90	101.3	-175.2	-154.3	5.7	0	0	0	110.3	P208 C212	P208-N210 PolarHBondContact O-N 2.83Å; N210-C212 VanDerWaalsContact C-N 3.3Å; N210-C212 PolarHBondContact O-N 3.48Å
211	H	33	Very low	32.3	Very low	164 Å²	164	151.2 Å²	151.2	76%	0.759	79%	0.787	S	S	*	*			trans	-77.4	72.7	-177.4	-70.7	-68.6	0	0	0	112.5	I209 Y213	I209-H211 PolarHBondContact O-N 2.82Å; H211-Y213 PolarHBondContact O-N 3.34Å
212	C	32.5	Very low	32.5	Very low	97 Å²	97	157.7 Å²	157.7	66%	0.655	79%	0.793	S	S	*	*			trans	-67.9	114.9	173	-71.1	0	0	0	0	111.6	N210 I214	N210-C212 VanDerWaalsContact C-N 3.3Å; N210-C212 PolarHBondContact O-N 3.48Å; C212-I214 PolarHBondContact O-N 3.46Å
213	Y	28.9	Very low	32.4	Very low	230 Å²	230	153.8 Å²	153.8	90%	0.902	79%	0.788	S	S	*	*			trans	-68.6	105.1	168.3	-110.9	-98.6	0	0	0	109.9	H211	H211-Y213 PolarHBondContact O-N 3.34Å
214	I	33.9	Very low	32.7	Very low	154 Å²	154	149.6 Å²	149.6	79%	0.79	79%	0.787	S	S	*	*			trans	-87.2	108.6	166.6	-61.1	-179.3	0	0	0	108.1	C212 A216	C212-I214 PolarHBondContact O-N 3.46Å; I214-A216 PolarHBondContact O-N 3.12Å
215	K	28.1	Very low	33	Very low	189 Å²	189	148.7 Å²	148.7	82%	0.822	79%	0.786	S	S	*	*			trans	-90.4	72.8	-178.6	-169.9	-171.5	176.5	-170.7	0	110.5
216	A	35.6	Very low	33.4	Very low	83 Å²	83	148.4 Å²	148.4	69%	0.686	79%	0.785	S	S	*	*			trans	-83.5	146.1	168.6	0	0	0	0	0	110.5	I214	I214-A216 PolarHBondContact O-N 3.12Å
217	N	32.4	Very low	33.3	Very low	140 Å²	140	149.7 Å²	149.7	75%	0.749	79%	0.791	S	S	*	*	S	Bend	trans	-80.4	140.5	179.4	-69.5	-28.9	0	0	0	111.1
218	N	31.8	Very low	33.3	Very low	153 Å²	153	150.3 Å²	150.3	82%	0.818	79%	0.794	S	S	*	*	S	Bend	trans	70.1	130.2	172.1	-55.5	-17.8	0	0	0	116.9
219	S	34.4	Very low	33	Very low	101 Å²	101	153.4 Å²	153.4	71%	0.706	80%	0.797	S	S	*	*			trans	67.1	114.8	-177.9	77.8	0	0	0	0	116.8
220	C	31.7	Very low	33	Very low	130 Å²	130	152 Å²	152	88%	0.878	80%	0.8	S	S	*	*			trans	-105	75.8	174.1	-67.1	0	0	0	0	110.7
221	Y	28.9	Very low	32.9	Very low	210 Å²	210	152.5 Å²	152.5	82%	0.824	80%	0.803	S	S	*	*			trans	-77.2	122.6	169.8	-85.7	-80.9	0	0	0	111
222	W	32.6	Very low	32.7	Very low	257 Å²	257	149.9 Å²	149.9	97%	0.973	80%	0.803	S	S	*	*			trans	-79.3	117.6	165.3	-84.1	59.4	0	0	0	108.9
223	S	29.3	Very low	32.4	Very low	103 Å²	103	154.4 Å²	154.4	72%	0.72	81%	0.812	S	S	*	*			trans	-137.6	118.7	169.3	-166.6	0	0	0	0	109.3	A225	S223-A225 PolarHBondContact O-N 3.32Å
224	P	37.2	Very low	32.5	Very low	122 Å²	122	148 Å²	148	79%	0.792	80%	0.8	S	S	*	*			trans	-72.8	98.5	176.8	29.4	-32.2	0	0	0	108.9	K226	P224-K226 PolarHBondContact O-N 3.23Å
225	A	36.9	Very low	32.3	Very low	95 Å²	95	146.4 Å²	146.4	79%	0.785	80%	0.798	S	S	*	*			trans	-60.5	107.2	178.3	0	0	0	0	0	110.4	S223	S223-A225 PolarHBondContact O-N 3.32Å
226	K	37.1	Very low	32.3	Very low	191 Å²	191	149.2 Å²	149.2	83%	0.83	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-58.7	129.7	170.7	-65.1	-176.4	178.5	-176.3	0	108.5	P224 K228	P224-K226 PolarHBondContact O-N 3.23Å; K226-K228 PolarHBondContact O-N 2.78Å
227	P	36.1	Very low	32	Very low	119 Å²	119	150.5 Å²	150.5	77%	0.773	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-61.5	135.6	170.6	26.9	-33	0	0	0	109
228	K	36.3	Very low	31.9	Very low	207 Å²	207	151.9 Å²	151.9	90%	0.9	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-68	137.6	177.3	-69.1	-176.6	176.8	-177.9	0	109.5	K226	K226-K228 PolarHBondContact O-N 2.78Å
229	H	30.9	Very low	31.9	Very low	190 Å²	190	151.1 Å²	151.1	88%	0.88	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-66.3	147.8	178.3	-69.5	-99.8	0	0	0	112.2
230	S	34.4	Very low	31.8	Very low	112 Å²	112	155.9 Å²	155.9	78%	0.783	82%	0.816	S	S	*	*			trans	-141	90.5	154.1	60	0	0	0	0	109.5
231	N	27.8	Very low	31.9	Very low	155 Å²	155	155.6 Å²	155.6	83%	0.829	82%	0.816	S	S	*	*			trans	36.9	106.6	156.2	-55.5	-4.3	0	0	0	119.6
232	S	28.8	Very low	31.9	Very low	109 Å²	109	153.3 Å²	153.3	76%	0.762	82%	0.817	S	S	*	*				-174.8	155.3	113.2	39.4	0	0	0	0	111.6
233	F	27.7	Very low	31.9	Very low	193 Å²	193	149.6 Å²	149.6	85%	0.846	81%	0.808	S	S	*	*			trans	59.3	95	176.5	-68.3	-77.8	0	0	0	118.8
234	S	30.1	Very low	31.9	Very low	94 Å²	94	154.3 Å²	154.3	66%	0.657	81%	0.811	S	S	*	*			trans	10.7	115.9	133.3	51.2	0	0	0	0	117
235	V	29.2	Very low	31.8	Very low	121 Å²	121	156.7 Å²	156.7	73%	0.733	81%	0.811	S	S	*	*				59.4	106.2	70.9	-179.1	0	0	0	0	112.7
236	W	29.6	Very low	31.7	Very low	248 Å²	248	159.2 Å²	159.2	94%	0.939	81%	0.807	S	S	*	*				-140.2	138	129.4	-109	28.2	0	0	0	106.7
237	S	29.2	Very low	31.7	Very low	111 Å²	111	158.2 Å²	158.2	78%	0.776	81%	0.811	S	S	*	*			trans	-155.8	116.1	-175.2	58.1	0	0	0	0	109.5
238	E	29.3	Very low	31.7	Very low	169 Å²	169	160.2 Å²	160.2	79%	0.79	81%	0.807	S	S	*	*			trans	-143.4	158.9	-172	-144.3	176.7	-134.7	0	0	112
239	N	31.5	Very low	31.8	Very low	137 Å²	137	158.9 Å²	158.9	73%	0.733	80%	0.804	S	S	*	*			trans	68.3	64.3	167.5	-56.3	-48.5	0	0	0	117.7
240	Q	32.2	Very low	31.8	Very low	200 Å²	200	160.5 Å²	160.5	94%	0.935	80%	0.802	S	S	*	*				-113.2	138.5	127.8	-80.2	-163.5	-11.8	0	0	109.7
241	S	33.7	Very low	31.9	Very low	125 Å²	125	161.7 Å²	161.7	87%	0.874	80%	0.798	S	S	*	*			trans	-87.1	148.6	-169.6	47.3	0	0	0	0	113.8
242	L	29.8	Very low	32.1	Very low	162 Å²	162	159.3 Å²	159.3	85%	0.848	79%	0.794	S	S	*	*			trans	-56.1	143.3	176.8	-70.3	141.7	0	0	0	113.3
243	K	32.6	Very low	32.5	Very low	179 Å²	179	158.7 Å²	158.7	78%	0.778	79%	0.79	S	S	*	*				-178.4	154	108.8	-97.1	165	-176.4	177.1	0	113
244	Y	29.7	Very low	32.9	Very low	202 Å²	202	155.2 Å²	155.2	79%	0.792	78%	0.784	S	S	*	*			trans	66.9	144.3	176.2	-60.4	-76.8	0	0	0	116.5
245	H	35	Very low	33.2	Very low	172 Å²	172	155.9 Å²	155.9	80%	0.796	79%	0.789	S	S	*	*			cis	-120.2	152.2	1.6	-115.2	-82	0	0	0	112.3
246	Q	35.4	Very low	33.5	Very low	147 Å²	147	155.2 Å²	155.2	69%	0.687	79%	0.79	S	S	*	*			trans	-71.5	147.9	169.3	-63.9	178.3	2.8	0	0	111
247	N	36.4	Very low	33.7	Very low	170 Å²	170	150.6 Å²	150.6	91%	0.909	78%	0.782	S	S	*	*			trans	-142	121.1	146.1	-128.3	-14.6	0	0	0	109.2
248	K	36.2	Very low	33.9	Very low	162 Å²	162	151.2 Å²	151.2	70%	0.704	78%	0.777	S	S	*	*			trans	-104.5	119.6	-172.2	-71.1	178.9	179.1	176.6	0	111.2
249	H	38.2	Very low	34	Very low	179 Å²	179	151 Å²	151	83%	0.829	78%	0.776	S	S	*	*			trans	-127.3	122.4	144.3	-83.3	-108.9	0	0	0	106.9
250	R	31.3	Very low	34	Very low	223 Å²	223	149.2 Å²	149.2	84%	0.842	78%	0.775	S	S	*	*				59.4	118.9	70	-96.3	-169	165	178.8	-4.5	110.7
251	I	36.3	Very low	34	Very low	138 Å²	138	145 Å²	145	71%	0.708	77%	0.767	S	S	*	*			cis	-141	159.5	12.9	-77.1	174.4	0	0	0	111.6
252	S	32.7	Very low	33.9	Very low	105 Å²	105	143.8 Å²	143.8	73%	0.734	76%	0.759	S	S	*	*			trans	-16.9	164.5	158.2	-42.3	0	0	0	0	119.5
253	S	35.8	Very low	33.9	Very low	96 Å²	96	144.8 Å²	144.8	67%	0.671	76%	0.761	S	S	*	*			cis	-161.2	159	38.2	-55.5	0	0	0	0	116.2
254	T	35.9	Very low	33.9	Very low	119 Å²	119	142.2 Å²	142.2	73%	0.73	76%	0.76	S	S	*	*			trans	46.8	111.1	142.2	51.7	0	0	0	0	119.9
255	S	36.1	Very low	34	Very low	108 Å²	108	139.8 Å²	139.8	76%	0.755	76%	0.761	S	S	*	*				73.1	144	75.6	77.7	0	0	0	0	114.2
256	S	37.1	Very low	33.9	Very low	108 Å²	108	137.4 Å²	137.4	76%	0.755	76%	0.764	S	S	*	*			cis	-162.2	148.1	6.1	37.5	0	0	0	0	112.6
257	L	33.4	Very low	33.6	Very low	150 Å²	150	138 Å²	138	79%	0.785	77%	0.77	S	S	*	*			trans	29.4	151.7	138.1	-116.9	71.1	0	0	0	123.6
258	N	33.1	Very low	33.6	Very low	125 Å²	125	135 Å²	135	67%	0.668	76%	0.76	S	S	*	*			trans	72.2	151.5	158.4	-65.9	-6.9	0	0	0	117.7
259	Q	32.2	Very low	33.3	Very low	163 Å²	163	135.7 Å²	135.7	76%	0.762	77%	0.766	S	S	*	*			cis	-169.3	174.4	-34	-120.8	178.7	16.8	0	0	107.2
260	S	31.8	Very low	33.1	Very low	101 Å²	101	132.4 Å²	132.4	71%	0.706	76%	0.763	S	S	*	*			trans	55.1	112.3	156	56.6	0	0	0	0	121.3
261	S	31	Very low	33.2	Very low	110 Å²	110	132.1 Å²	132.1	77%	0.769	76%	0.762	S	S	*	*				88.2	123.7	122.9	-56.5	0	0	0	0	123.1
262	S	31.2	Very low	33	Very low	101 Å²	101	133.3 Å²	133.3	71%	0.706	76%	0.762	S	S	*	*			trans	66.7	112	134.5	63.6	0	0	0	0	122.8
263	M	30.5	Very low	33.1	Very low	182 Å²	182	137 Å²	137	90%	0.897	76%	0.761	S	S	*	*				77.7	161.1	127.3	-69.1	-177	137.6	0	0	121.4
264	V	33.1	Very low	33.1	Very low	126 Å²	126	138.5 Å²	138.5	76%	0.764	76%	0.758	S	S	*	*			trans	74.8	99.5	165.3	-160.3	0	0	0	0	118.2
265	N	30.6	Very low	33	Very low	150 Å²	150	138 Å²	138	80%	0.802	76%	0.759	S	S	*	*			trans	1.2	124.3	139.2	-51	-18	0	0	0	118.2
266	S	34	Very low	33.1	Very low	122 Å²	122	140 Å²	140	85%	0.853	75%	0.754	S	S	*	*				-172.2	149.2	120	46.3	0	0	0	0	113.4
267	I	28.8	Very low	33.1	Very low	160 Å²	160	141.2 Å²	141.2	82%	0.821	75%	0.752	S	S	*	*			trans	-110.7	131.2	169.7	-67	164.5	0	0	0	103.8
268	P	36.1	Very low	33.2	Very low	107 Å²	107	143.2 Å²	143.2	70%	0.695	75%	0.751	S	S	*	*				-160.5	162.6	84.5	42	-20.6	0	0	0	120.5
269	Q	31.3	Very low	33.3	Very low	177 Å²	177	141.8 Å²	141.8	83%	0.827	75%	0.751	S	S	*	*			trans	18.7	123.3	139.7	-53.2	179.2	2.6	0	0	122.2
270	S	32.9	Very low	33.5	Very low	110 Å²	110	141.7 Å²	141.7	77%	0.769	75%	0.748	S	S	*	*				-170.1	125.6	126	22.4	0	0	0	0	109
271	R	32.7	Very low	33.7	Very low	217 Å²	217	143 Å²	143	82%	0.819	75%	0.746	S	S	*	*				51.9	122.5	85.9	-64.5	-173.7	-177	-173.2	2.7	114.1
272	F	33.7	Very low	34	Very low	163 Å²	163	143.1 Å²	143.1	72%	0.715	75%	0.748	S	S	*	*				-178.6	116.4	103.1	-109.7	-93.3	0	0	0	113.9
273	Y	35	Very low	34	Very low	181 Å²	181	145.5 Å²	145.5	71%	0.71	75%	0.752	S	S	*	*			trans	59.4	156.2	138.9	-76.6	-125.5	0	0	0	121.6
274	Q	34	Very low	34.1	Very low	129 Å²	129	142.6 Å²	142.6	60%	0.603	75%	0.749	S	S	*	*			cis	-171.7	164.8	-23	176.4	172.3	91.9	0	0	110.1
275	S	33.8	Very low	34	Very low	109 Å²	109	143 Å²	143	76%	0.762	75%	0.745	S	S	*	*			trans	110.2	147.8	154.2	80.4	0	0	0	0	117.2
276	K	38.1	Very low	34.2	Very low	148 Å²	148	143.1 Å²	143.1	64%	0.643	74%	0.74	S	S	*	*			cis	-166.4	174.2	-40.2	-123.6	175.5	-178.6	178.3	0	110.3
277	N	37.4	Very low	34.2	Very low	135 Å²	135	145.1 Å²	145.1	72%	0.722	74%	0.736	S	S	*	*			trans	96	104.3	174.3	-51.3	-20.3	0	0	0	114.6
278	Y	35.9	Very low	34.6	Very low	192 Å²	192	142.3 Å²	142.3	75%	0.753	73%	0.728	S	S	*	*				73.4	129.7	73.6	-67.5	-58.2	0	0	0	112
279	S	35	Very low	34.6	Very low	95 Å²	95	147.3 Å²	147.3	66%	0.664	73%	0.734	S	S	*	*			cis	-142.1	148.7	23.6	-117.8	0	0	0	0	112
280	K	36.1	Very low	34.7	Very low	161 Å²	161	145.3 Å²	145.3	70%	0.7	73%	0.73	S	S	*	*				57.8	139.4	96.7	-67.9	179.1	137.4	-84.2	0	115.9
281	D	36.6	Very low	34.7	Very low	127 Å²	127	144.8 Å²	144.8	68%	0.679	73%	0.726	S	S	*	*			cis	-150.8	-172.7	-16.3	-76.7	-42.2	0	0	0	105.1
282	S	36.4	Very low	34.9	Very low	114 Å²	114	138.6 Å²	138.6	80%	0.797	72%	0.716	S	S	*	*			cis	-157.4	-178.3	8	54.3	0	0	0	0	110.3
283	N	31.4	Very low	34.9	Very low	151 Å²	151	137.4 Å²	137.4	81%	0.807	72%	0.717	S	S	*	*			trans	-110.9	156.5	174.9	-66.9	-50.8	0	0	0	113.6
284	C	33	Very low	34.8	Very low	121 Å²	121	135.1 Å²	135.1	82%	0.818	72%	0.717	S	S	*	*			trans	177	116.4	149.5	-98.6	0	0	0	0	108.3
285	I	30.6	Very low	34.8	Very low	133 Å²	133	134.8 Å²	134.8	68%	0.682	72%	0.723	S	S	*	*				84.7	139.3	52.6	-52.7	160.6	0	0	0	112.9
286	H	35.2	Very low	34.7	Very low	153 Å²	153	136.2 Å²	136.2	71%	0.708	72%	0.721	S	S	*	*			trans	76.5	141.1	-178	-64.5	-81.9	0	0	0	116.8
287	H	35.4	Very low	34.6	Very low	165 Å²	165	135.5 Å²	135.5	76%	0.764	72%	0.724	S	S	*	*			cis	-143.4	158.3	-3.1	-111.1	-68.2	0	0	0	110.4
288	P	36.2	Very low	34.3	Very low	100 Å²	100	135.6 Å²	135.6	65%	0.649	73%	0.725	S	S	*	*			trans	-100.7	165.9	179.4	39.2	-33.6	0	0	0	113.8
289	Y	35.4	Very low	34.1	Very low	212 Å²	212	131 Å²	131	83%	0.831	72%	0.721	S	S	*	*			trans	-171.8	158.1	134.8	-115.7	-81.9	0	0	0	112.9
290	N	34.2	Very low	33.9	Very low	136 Å²	136	133.9 Å²	133.9	73%	0.727	73%	0.729	S	S	*	*			trans	-29.5	162.1	179.2	-56.3	-8.8	0	0	0	119.3
291	S	33.4	Very low	33.9	Very low	98 Å²	98	131.8 Å²	131.8	69%	0.685	73%	0.725	S	S	*	*			cis	-160.4	150.6	26.7	-157.9	0	0	0	0	115.9
292	S	35.9	Very low	33.7	Very low	87 Å²	87	136 Å²	136	61%	0.608	73%	0.732	S	S	*	*			trans	34.3	138.7	142.4	60.1	0	0	0	0	122.4
293	N	34.9	Very low	33.5	Very low	138 Å²	138	138.2 Å²	138.2	74%	0.738	73%	0.734	S	S	*	*			cis	-163.3	149.9	-0.6	-100.3	-16.5	0	0	0	111
294	N	33.1	Very low	33.3	Very low	133 Å²	133	140.1 Å²	140.1	71%	0.711	74%	0.736	S	S	*	*			trans	9.8	151.7	145.2	-38.6	-30.7	0	0	0	119.7
295	V	33.7	Very low	33.2	Very low	122 Å²	122	141.4 Å²	141.4	74%	0.739	73%	0.733	S	S	*	*			cis	-154.9	121.4	38	-172.6	0	0	0	0	108
296	I	31.8	Very low	33.3	Very low	140 Å²	140	143.7 Å²	143.7	72%	0.718	74%	0.738	S	S	*	*				43.2	117.4	103	-54.7	168.3	0	0	0	112.7
297	N	34.8	Very low	33.1	Very low	133 Å²	133	144.7 Å²	144.7	71%	0.711	74%	0.737	S	S	*	*				-170.6	157.8	57.2	-141.6	-9.2	0	0	0	114.9
298	N	30.6	Very low	32.9	Very low	136 Å²	136	143.3 Å²	143.3	73%	0.727	74%	0.735	S	S	*	*			trans	55.6	126.1	151.5	-81.5	-12.9	0	0	0	126.5
299	S	33	Very low	32.7	Very low	96 Å²	96	149.4 Å²	149.4	67%	0.671	75%	0.747	S	S	*	*			trans	69.2	114.5	136.2	62.5	0	0	0	0	123.2
300	N	31.1	Very low	32.7	Very low	156 Å²	156	146.5 Å²	146.5	83%	0.834	74%	0.741	S	S	*	*			trans	45.8	132.3	135.9	-52.1	-12.5	0	0	0	119.4
301	D	36.4	Very low	32.8	Very low	117 Å²	117	148.4 Å²	148.4	63%	0.626	75%	0.745	S	S	*	*			cis	-151.1	167.4	46	-145.7	-22.7	0	0	0	114.8
302	R	30.9	Very low	32.9	Very low	216 Å²	216	151.6 Å²	151.6	82%	0.815	75%	0.749	S	S	*	*			trans	0.2	111	169.5	-77.2	158.4	-109.1	-148.1	-2.8	119.1
303	N	33.4	Very low	32.9	Very low	159 Å²	159	150.3 Å²	150.3	85%	0.85	75%	0.749	S	S	*	*			trans	-100.8	162.2	156.6	-126.9	-42.6	0	0	0	112
304	F	27.6	Very low	32.9	Very low	191 Å²	191	151.7 Å²	151.7	84%	0.838	75%	0.751	S	S	*	*			trans	-77.3	-174.3	-177.3	-94.2	-105.5	0	0	0	113.9
305	I	30.5	Very low	32.9	Very low	149 Å²	149	151.9 Å²	151.9	76%	0.764	75%	0.751	S	S	*	*			trans	96.9	117.6	161.2	-52.9	157.1	0	0	0	116.1
306	K	31.5	Very low	32.7	Very low	180 Å²	180	152.2 Å²	152.2	78%	0.783	76%	0.757	S	S	*	*			trans	-163.5	112.8	135.9	-92.7	-131.1	168.7	-170	0	114.2
307	Y	32.1	Very low	32.8	Very low	175 Å²	175	149.2 Å²	149.2	69%	0.686	76%	0.761	S	S	*	*			trans	56.8	123.5	147.9	-61.8	-99.9	0	0	0	119.3
308	N	30.1	Very low	32.7	Very low	136 Å²	136	150 Å²	150	73%	0.727	77%	0.77	S	S	*	*				83.5	122.8	54.4	-81.7	-15.8	0	0	0	114.7
309	Y	33.3	Very low	32.8	Very low	227 Å²	227	147 Å²	147	89%	0.89	77%	0.773	S	S	*	*			trans	163.3	141.1	145.9	-93.7	-77.3	0	0	0	107.2
310	H	34.7	Very low	32.8	Very low	152 Å²	152	149.8 Å²	149.8	70%	0.704	78%	0.78	S	S	*	*			cis	-170.8	177.5	-31.7	-141.2	33.3	0	0	0	109.3
311	Q	36	Very low	32.9	Very low	176 Å²	176	151.3 Å²	151.3	82%	0.822	78%	0.781	S	S	*	*			trans	67.7	150.4	171.4	-61.7	178	-13.1	0	0	118.4
312	H	35.9	Very low	32.6	Very low	164 Å²	164	153 Å²	153	76%	0.759	79%	0.787	S	S	*	*			cis	-165.8	157	-42.3	-125.2	-80.4	0	0	0	108.7
313	G	35.8	Very low	32.7	Very low	60 Å²	60	148.9 Å²	148.9	62%	0.619	78%	0.781	S	S	*	*			trans	96.9	102.6	179.7	0	0	0	0	0	112.3
314	E	35.3	Very low	32.5	Very low	167 Å²	167	147.9 Å²	147.9	78%	0.78	78%	0.781	S	S	*	*				74.2	133.5	62.5	-63.7	-176.7	-173	0	0	113.7
315	I	31.8	Very low	32.7	Very low	137 Å²	137	142.2 Å²	142.2	70%	0.703	78%	0.777	S	S	*	*			cis	-155.4	152.7	-7.3	-121.9	162.3	0	0	0	109.6
316	C	31	Very low	32.6	Very low	129 Å²	129	145.9 Å²	145.9	87%	0.872	78%	0.783	S	S	*	*			trans	39.6	131.8	164.1	-65.3	0	0	0	0	122
317	G	33.5	Very low	32.4	Very low	77 Å²	77	144.2 Å²	144.2	79%	0.794	78%	0.782	S	S	*	*			trans	177.2	44	172.2	0	0	0	0	0	117.7
318	T	32.7	Very low	32.3	Very low	149 Å²	149	144 Å²	144	91%	0.914	79%	0.787	S	S	*	*			trans	-26.7	129.1	174.2	49.4	0	0	0	0	117.2
319	G	32.6	Very low	32.2	Very low	75 Å²	75	144.3 Å²	144.3	77%	0.773	78%	0.784	S	S	*	*			trans	179.1	63.9	175.8	0	0	0	0	0	117	H321	G319-H321 PolarHBondContact O-N 2.9Å
320	N	31.9	Very low	31.9	Very low	154 Å²	154	137.6 Å²	137.6	82%	0.824	77%	0.769	S	S	*	*			trans	-48	128.9	179.5	-57.1	-22.2	0	0	0	114.4
321	H	33.8	Very low	31.5	Very low	187 Å²	187	136.7 Å²	136.7	87%	0.866	76%	0.763	S	S	*	*				-156.5	152.8	105.1	-122.7	-88.5	0	0	0	113.9	G319	G319-H321 PolarHBondContact O-N 2.9Å
322	M	31.3	Very low	31.1	Very low	152 Å²	152	139.3 Å²	139.3	75%	0.749	77%	0.766	S	S	*	*			trans	-94.3	166.3	-163.1	-71.5	-91.1	-88.7	0	0	114.7
323	N	32.5	Very low	30.9	Very low	130 Å²	130	135.4 Å²	135.4	70%	0.695	75%	0.75	S	S	*	*			trans	73.9	89.7	153.7	-65.5	-6.2	0	0	0	119.5
324	T	28.9	Very low	30.5	Very low	138 Å²	138	137.9 Å²	137.9	85%	0.847	75%	0.748	S	S	*	*				-2.6	128.1	116.7	52.2	0	0	0	0	117.1
325	G	32.1	Very low	30.1	Very low	73 Å²	73	136.4 Å²	136.4	75%	0.753	75%	0.746	S	S	*	*			trans	-163.2	113.8	165.1	0	0	0	0	0	111.4	L327	G325-L327 PolarHBondContact O-N 2.89Å
326	Y	27.4	Very low	30.2	Very low	225 Å²	225	137.1 Å²	137.1	88%	0.882	76%	0.757	S	S	*	*			trans	-62.3	128.9	176.4	-93.2	-125.5	0	0	0	110
327	L	28.5	Very low	30	Very low	146 Å²	146	140.6 Å²	140.6	76%	0.764	76%	0.757	S	S	*	*				73.1	68.4	71.5	-168.4	82.8	0	0	0	114	G325	G325-L327 PolarHBondContact O-N 2.89Å
328	E	29.1	Very low	29.9	Very low	171 Å²	171	142.1 Å²	142.1	80%	0.799	76%	0.756	S	S	*	*			trans	-159.9	154.7	161	-103.6	-153.5	-177.8	0	0	109.3
329	H	27.9	Very low	29.7	Very low	142 Å²	142	140.6 Å²	140.6	66%	0.657	75%	0.746	S	S	*	*			cis	-156	131.9	-12.6	-155.4	-16.4	0	0	0	111.1
330	C	26.8	Very low	29.5	Very low	86 Å²	86	144.5 Å²	144.5	58%	0.581	75%	0.746	S	S	*	*			trans	61.2	129.6	148.8	-96.8	0	0	0	0	125.4
331	K	27.6	Very low	29.3	Very low	132 Å²	132	144 Å²	144	57%	0.574	74%	0.741	S	S	*	*			trans	68.2	83.9	130	-65.5	166.9	175.1	173.8	0	122.4	K627 N629	K331-K627 PolarHBondContact O-NZ 2.84Å; K331-N629 PolarHBondContact NZ-OD1 3.11Å
332	R	27.3	Very low	29.1	Very low	232 Å²	232	144.6 Å²	144.6	88%	0.875	74%	0.737	S	S	*	*			trans	-136.9	117.8	148	-69.5	-167	-175.1	-171	3.7	111.4
333	I	31.6	Very low	29.3	Very low	82 Å²	82	142.3 Å²	142.3	42%	0.421	73%	0.733	S	S	.	*				74.8	102.7	102.4	-66.7	164.8	0	0	0	111.5	H625	I333-H625 HydrophobicContact CD1-CB 3.81Å; I333-H625 HydrophobicContact CG1-CB 4.24Å
334	N	27.7	Very low	29.3	Very low	111 Å²	111	144 Å²	144	59%	0.594	74%	0.741	S	S	*	*				62.1	122.1	78.5	-93	43.8	0	0	0	116.7	H625	N334-H625 WeakPolarHBondContact CB-NE2 3.37Å
335	N	27	Very low	29.3	Very low	137 Å²	137	141.7 Å²	141.7	73%	0.733	73%	0.73	S	S	*	*			trans	53.4	112.1	152.4	-64.8	-4.1	0	0	0	121
336	T	32.2	Very low	29.4	Very low	151 Å²	151	147 Å²	147	93%	0.926	74%	0.735	S	S	*	*			trans	-155.3	159.5	132.5	12	0	0	0	0	111.9
337	K	28.3	Very low	29.5	Very low	203 Å²	203	147.3 Å²	147.3	88%	0.883	74%	0.735	S	S	*	*			trans	-112.5	140.7	175.2	-58.2	174.4	178.6	179.9	0	110.7
338	S	29.9	Very low	29.8	Very low	109 Å²	109	145.7 Å²	145.7	76%	0.762	73%	0.733	S	S	*	*			trans	-174.1	131.9	139	-158.9	0	0	0	0	106.3
339	T	29.1	Very low	30	Very low	116 Å²	116	141.6 Å²	141.6	71%	0.712	72%	0.724	S	S	*	*			cis	81.1	132.1	34.3	-44	0	0	0	0	113.4
340	M	29.4	Very low	30.3	Very low	157 Å²	157	143.5 Å²	143.5	77%	0.773	73%	0.73	S	S	*	*			trans	86.3	112.6	-177.8	-59.4	-168.2	164.1	0	0	115.1
341	M	27.9	Very low	30.6	Very low	144 Å²	144	146.6 Å²	146.6	71%	0.709	74%	0.736	S	S	*	*				81.9	134.2	87.5	-68.2	164.4	72	0	0	112
342	Y	29.4	Very low	30.8	Very low	199 Å²	199	144.3 Å²	144.3	78%	0.78	74%	0.736	S	S	*	*			cis	-149.7	165	5.4	-126.1	-146.8	0	0	0	110
343	P	34.2	Very low	31.1	Very low	105 Å²	105	141.2 Å²	141.2	68%	0.682	74%	0.737	S	S	*	*			trans	-96.3	156.2	175.7	37.6	-33.4	0	0	0	113.5
344	I	32.4	Very low	31	Very low	165 Å²	165	142.7 Å²	142.7	85%	0.846	75%	0.752	S	S	*	*			trans	-169.9	152.5	160	-109.7	155	0	0	0	112
345	S	29.7	Very low	31.2	Very low	90 Å²	90	145.7 Å²	145.7	63%	0.629	77%	0.768	S	S	*	*			trans	4.7	158.2	162.3	-86.8	0	0	0	0	123
346	Q	33.6	Very low	31.4	Very low	183 Å²	183	142.9 Å²	142.9	86%	0.855	76%	0.763	S	S	*	*			cis	-154.1	177.3	12.6	-134.1	139.6	18.6	0	0	113.9
347	R	29.8	Very low	31.3	Very low	232 Å²	232	144.1 Å²	144.1	88%	0.875	76%	0.762	S	S	*	*			trans	-109.7	178.8	178.2	-112.6	-179.1	-179.8	175	-0.1	110
348	P	35.5	Very low	31.5	Very low	112 Å²	112	138.1 Å²	138.1	73%	0.727	76%	0.758	S	S	*	*			cis	-122.9	-126.1	-11.7	28.6	-2.8	0	0	0	109.3
349	S	32.7	Very low	31.6	Very low	86 Å²	86	140.4 Å²	140.4	60%	0.601	76%	0.762	S	S	*	*			cis	-169	135.3	-10.9	30.5	0	0	0	0	111.5
350	K	34.3	Very low	31.7	Very low	181 Å²	181	143.4 Å²	143.4	79%	0.787	77%	0.767	S	S	*	*			trans	62.2	152.9	147.7	-60.9	175.2	169.7	-172.8	0	118.3
351	Q	32.4	Very low	31.7	Very low	151 Å²	151	141.2 Å²	141.2	71%	0.706	77%	0.765	S	S	*	*			cis	-167	158.7	-14.3	-106.9	174.3	-112.4	0	0	106.5
352	S	33.3	Very low	31.8	Very low	84 Å²	84	140.7 Å²	140.7	59%	0.587	76%	0.764	S	S	*	*			cis	178.7	130.1	-28.8	48.5	0	0	0	0	109.6
353	N	32.8	Very low	31.8	Very low	167 Å²	167	141.4 Å²	141.4	89%	0.893	77%	0.771	S	S	*	*			trans	-164.1	148.2	149.9	-95.5	-19	0	0	0	110.4
354	P	28.7	Very low	31.6	Very low	113 Å²	113	144.2 Å²	144.2	73%	0.734	77%	0.773	S	S	*	*			trans	-131.2	119.2	-151.9	34.7	-14.8	0	0	0	115.9
355	L	32	Very low	31.4	Very low	175 Å²	175	143.6 Å²	143.6	92%	0.916	77%	0.771	S	S	*	*			trans	-156.7	127.6	162.4	-108.7	141.6	0	0	0	113.2
356	A	31	Very low	31.5	Very low	77 Å²	77	143.8 Å²	143.8	64%	0.636	77%	0.773	S	S	*	*	S	Bend	trans	62.6	128.5	152.7	0	0	0	0	0	122.1
357	I	31	Very low	31.5	Very low	178 Å²	178	143.3 Å²	143.3	91%	0.913	77%	0.771	S	S	*	*			trans	69.1	99	148.3	-54.9	155.5	0	0	0	117.1
358	G	32.3	Very low	31.6	Very low	76 Å²	76	141.5 Å²	141.5	78%	0.784	77%	0.769	S	S	*	*			trans	-178	87.5	173.6	0	0	0	0	0	115.8
359	N	32	Very low	31.5	Very low	158 Å²	158	142.6 Å²	142.6	85%	0.845	77%	0.768	S	S	*	*			trans	-22.2	153.5	176.5	-62.6	-42.5	0	0	0	122
360	Q	30.8	Very low	31.3	Very low	178 Å²	178	143.7 Å²	143.7	83%	0.832	77%	0.77	S	S	*	*			trans	87	161.4	163.7	-45	-157.1	22.5	0	0	117.2
361	P	29.7	Very low	31.3	Very low	112 Å²	112	142 Å²	142	73%	0.727	77%	0.77	S	S	*	*				-129.5	116.8	-76.6	34.5	-17.6	0	0	0	112.8
362	I	30.2	Very low	31.2	Very low	133 Å²	133	143.1 Å²	143.1	68%	0.682	78%	0.775	S	S	*	*			trans	-91.6	120.6	-173.3	-56.1	176	0	0	0	111.9	F364	I362-F364 HydrophobicContact CB-CD2 4.22Å; I362-F364 HydrophobicContact CB-CE2 4.12Å; I362-F364 HydrophobicContact CD1-CE2 4.45Å; I362-F364 HydrophobicContact CG2-CD2 3.62Å; I362-F364 HydrophobicContact CG2-CE2 3.52Å; I362-F364 HydrophobicContact CG2-CG 4.41Å; I362-F364 HydrophobicContact CG2-CZ 4.23Å; I362-F364 PolarHBondContact O-N 2.83Å
363	F	28.6	Very low	31.4	Very low	213 Å²	213	147 Å²	147	93%	0.934	79%	0.79	S	S	*	*			trans	-68.5	108.3	160.1	-95.2	-100.1	0	0	0	109.5
364	F	30.7	Very low	31.4	Very low	164 Å²	164	147.2 Å²	147.2	72%	0.719	79%	0.785	S	S	*	*			trans	-90.4	105.7	168.2	-94.2	-79.1	0	0	0	111.1	I362	I362-F364 HydrophobicContact CB-CD2 4.22Å; I362-F364 HydrophobicContact CB-CE2 4.12Å; I362-F364 HydrophobicContact CD1-CE2 4.45Å; I362-F364 HydrophobicContact CG2-CD2 3.62Å; I362-F364 HydrophobicContact CG2-CE2 3.52Å; I362-F364 HydrophobicContact CG2-CG 4.41Å; I362-F364 HydrophobicContact CG2-CZ 4.23Å; I362-F364 PolarHBondContact O-N 2.83Å
365	N	28.3	Very low	31.8	Very low	152 Å²	152	149.8 Å²	149.8	81%	0.813	79%	0.791	S	S	*	*			trans	-82.4	123.3	156.7	-156.1	10	0	0	0	106.9
366	S	32.8	Very low	31.7	Very low	95 Å²	95	146.8 Å²	146.8	66%	0.664	78%	0.78	S	S	*	*			trans	-124.5	95.3	-177.2	-63	0	0	0	0	110
367	Q	33.6	Very low	31.8	Very low	173 Å²	173	149.8 Å²	149.8	81%	0.808	79%	0.786	S	S	*	*			trans	-61.9	137	171.9	-73.5	170.8	-68.1	0	0	110	I369	Q367-I369 VanDerWaalsContact C-N 3.33Å; Q367-I369 PolarHBondContact O-N 3.31Å
368	K	30.7	Very low	31.9	Very low	193 Å²	193	145.4 Å²	145.4	84%	0.839	77%	0.771	S	S	*	*			trans	-74.5	85.2	175.6	-176.4	-170.9	176.3	-172.1	0	109.4	T370	K368-T370 PolarHBondContact O-N 3.35Å
369	I	32.7	Very low	32	Very low	136 Å²	136	150.6 Å²	150.6	70%	0.697	78%	0.775	S	S	*	*			trans	-73.1	117.6	171	-62.4	177.5	0	0	0	108.3	Q367 N371	Q367-I369 VanDerWaalsContact C-N 3.33Å; Q367-I369 PolarHBondContact O-N 3.31Å; I369-N371 WeakPolarHBondContact CG2-OD1 3.33Å
370	T	30.5	Very low	31.8	Very low	108 Å²	108	149.3 Å²	149.3	66%	0.663	77%	0.772	S	S	*	*			trans	-88.2	111.5	162.7	43.1	0	0	0	0	108.1	K368	K368-T370 PolarHBondContact O-N 3.35Å
371	N	33.1	Very low	32	Very low	145 Å²	145	146.6 Å²	146.6	78%	0.775	77%	0.771	S	S	*	*			trans	-95.3	116.8	159.8	-80.7	21.9	0	0	0	108	I369	I369-N371 WeakPolarHBondContact CG2-OD1 3.33Å
372	E	31.5	Very low	31.9	Very low	175 Å²	175	147.3 Å²	147.3	82%	0.818	77%	0.773	S	S	*	*			trans	-71.4	151.5	160.1	-66.3	161	166.8	0	0	108.1
373	N	35.5	Very low	32.1	Very low	167 Å²	167	147.3 Å²	147.3	89%	0.893	78%	0.779	S	S	*	*			trans	-150.1	119.6	162	-111.9	5.8	0	0	0	106.8
374	E	33.9	Very low	32.2	Very low	170 Å²	170	145.5 Å²	145.5	79%	0.794	77%	0.774	S	S	*	*			trans	-71.3	138.9	173.2	-63.4	164.5	103.3	0	0	109.7
375	I	36	Very low	32.2	Very low	167 Å²	167	147.2 Å²	147.2	86%	0.856	78%	0.781	S	S	*	*			trans	-131	110.6	142.9	-60	-177	0	0	0	105.3
376	T	30.4	Very low	32.4	Very low	112 Å²	112	146.7 Å²	146.7	69%	0.687	78%	0.783	S	S	*	*			trans	-106.2	117.5	178.8	-57.8	0	0	0	0	107.2
377	D	34.3	Very low	32.5	Very low	141 Å²	141	151 Å²	151	75%	0.754	79%	0.793	S	S	*	*			trans	-148	116.1	165.2	-112.9	-41.4	0	0	0	113.8
378	S	31.5	Very low	32.4	Very low	86 Å²	86	147.5 Å²	147.5	60%	0.601	79%	0.788	S	S	*	*			trans	42.2	133	132.7	52.5	0	0	0	0	123.8
379	E	34.2	Very low	32.4	Very low	185 Å²	185	143.5 Å²	143.5	86%	0.864	78%	0.784	S	S	*	*			trans	77.3	101.8	137.4	-68.3	175.8	-168.1	0	0	122.9
380	T	29.7	Very low	32.4	Very low	130 Å²	130	147 Å²	147	80%	0.798	79%	0.794	S	S	*	*			trans	-62.3	154.9	146.7	45.9	0	0	0	0	112.3
381	P	34.3	Very low	32.4	Very low	122 Å²	122	146.2 Å²	146.2	79%	0.792	79%	0.794	S	S	*	*				-151.2	179.9	72.1	41.4	-20.3	0	0	0	118.9
382	T	28.1	Very low	32.3	Very low	127 Å²	127	147.4 Å²	147.4	78%	0.779	79%	0.794	S	S	*	*			trans	-47.9	151.9	179.5	48	0	0	0	0	117.6
383	T	34.2	Very low	32.3	Very low	132 Å²	132	148 Å²	148	81%	0.81	79%	0.794	S	S	*	*			trans	-145.9	134.7	141.2	-29.7	0	0	0	0	109.7
384	E	31	Very low	31.9	Very low	176 Å²	176	145.4 Å²	145.4	82%	0.822	79%	0.789	S	S	*	*			trans	-88.7	141.9	174.8	-59.8	-177.5	135.5	0	0	110.5
385	F	30.5	Very low	31.6	Very low	200 Å²	200	144.7 Å²	144.7	88%	0.877	79%	0.789	S	S	*	*			trans	-142.8	113.3	154.4	-96.9	-77.9	0	0	0	110
386	T	31.9	Very low	31.3	Very low	140 Å²	140	142.1 Å²	142.1	86%	0.859	79%	0.785	S	S	*	*			trans	-97.5	117.8	166.9	-62.8	0	0	0	0	107.7
387	E	34.9	Very low	31.2	Very low	185 Å²	185	144.7 Å²	144.7	86%	0.864	79%	0.79	S	S	*	*			trans	-132.8	167.2	166.5	-138.2	-171.1	176.4	0	0	112
388	S	32.5	Very low	30.9	Very low	100 Å²	100	144.9 Å²	144.9	70%	0.699	79%	0.789	S	S	*	*			trans	-105.3	165.7	-139.6	65.8	0	0	0	0	115.7
389	S	29.6	Very low	30.7	Very low	109 Å²	109	146.6 Å²	146.6	76%	0.762	79%	0.792	S	S	*	*			trans	-55.1	130.6	177.8	39.8	0	0	0	0	114.5
390	K	33.4	Very low	30.5	Very low	210 Å²	210	143.2 Å²	143.2	91%	0.913	78%	0.784	S	S	*	*			trans	-152.4	162.2	148.2	-107.4	142	-169.8	169.6	0	111.6
391	S	30.3	Very low	30.3	Very low	92 Å²	92	147 Å²	147	64%	0.643	79%	0.785	S	S	*	*			trans	-109.4	167	-156.4	49.4	0	0	0	0	115.1
392	H	31.2	Very low	30.1	Very low	170 Å²	170	152.1 Å²	152.1	79%	0.787	79%	0.788	S	S	*	*			trans	92.8	148.9	160.5	-66.8	-70.8	0	0	0	120.8
393	K	31.5	Very low	30.3	Very low	187 Å²	187	156.6 Å²	156.6	81%	0.813	80%	0.797	S	S	*	*			trans	70.2	71.5	156.2	-72.3	167.6	-177.4	177.2	0	118.9
394	S	26.8	Very low	30.1	Very low	112 Å²	112	153.4 Å²	153.4	78%	0.783	79%	0.79	S	S	*	*				18.1	112.8	121.5	59.9	0	0	0	0	119.3
395	I	28.2	Very low	30.1	Very low	155 Å²	155	156.8 Å²	156.8	80%	0.795	80%	0.795	S	S	*	*			trans	-139.6	129.5	139.1	-89	142.8	0	0	0	106.7	Q397	I395-Q397 HydrophobicContact CG2-CG 4.06Å
396	S	28.4	Very low	30	Very low	113 Å²	113	152.9 Å²	152.9	79%	0.79	79%	0.793	S	S	*	*			trans	-113.3	91.5	179.4	58.4	0	0	0	0	110.8
397	Q	29.2	Very low	29.9	Very low	166 Å²	166	154.1 Å²	154.1	78%	0.776	79%	0.794	S	S	*	*			trans	-87.4	117.8	170.3	-73.3	-177	-13.4	0	0	110	I395	I395-Q397 HydrophobicContact CG2-CG 4.06Å
398	I	27.8	Very low	29.7	Very low	146 Å²	146	150.1 Å²	150.1	75%	0.749	79%	0.786	S	S	*	*			trans	-98.4	101.7	176.2	-60.6	177.1	0	0	0	108.5	V400	I398-V400 HydrophobicContact CG2-CG2 4.32Å; I398-V400 PolarHBondContact O-N 2.8Å
399	N	27.1	Very low	29.5	Very low	122 Å²	122	151.8 Å²	151.8	65%	0.652	79%	0.794	S	S	*	*			trans	-74.4	106.5	175.8	-79.1	-17.1	0	0	0	111.1	Y401	N399-Y401 HydrophobicContact CB-CD2 4.49Å; N399-Y401 HydrophobicContact CB-CE2 4.26Å; N399-Y401 PolarHBondContact O-N 2.84Å
400	V	29.3	Very low	29.6	Very low	114 Å²	114	149.8 Å²	149.8	69%	0.691	79%	0.785	S	S	*	*			trans	-87.2	91.8	177.6	-177.4	0	0	0	0	110.3	I398 R402	I398-V400 HydrophobicContact CG2-CG2 4.32Å; I398-V400 PolarHBondContact O-N 2.8Å; V400-R402 PolarHBondContact O-N 3.42Å
401	Y	27	Very low	29.6	Very low	209 Å²	209	147.1 Å²	147.1	82%	0.82	78%	0.78	S	S	*	*			trans	-67.6	102.1	174.1	-82.5	-88.8	0	0	0	112	N399	N399-Y401 HydrophobicContact CB-CD2 4.49Å; N399-Y401 HydrophobicContact CB-CE2 4.26Å; N399-Y401 PolarHBondContact O-N 2.84Å
402	R	30.4	Very low	29.5	Very low	229 Å²	229	150.7 Å²	150.7	86%	0.864	79%	0.791	S	S	*	*			trans	-76.5	125.1	162.3	-97.8	-175.6	167.1	171	-2.2	109.9	V400 G404	V400-R402 PolarHBondContact O-N 3.42Å; R402-G404 PolarHBondContact O-N 3.5Å
403	K	30.9	Very low	29.7	Very low	222 Å²	222	148.1 Å²	148.1	97%	0.965	79%	0.787	S	S	*	*			trans	-78.9	84.4	-173.2	-166.8	174.1	-173.3	173.6	0	111.7
404	G	31.3	Very low	29.5	Very low	65 Å²	65	147.1 Å²	147.1	67%	0.67	79%	0.79	S	S	*	*	S	Bend	trans	-163.7	106.7	177.9	0	0	0	0	0	114.5	R402	R402-G404 PolarHBondContact O-N 3.5Å
405	R	30.7	Very low	29.9	Very low	246 Å²	246	147.8 Å²	147.8	93%	0.928	80%	0.795	S	S	*	*			trans	59.7	116.1	178.6	-68.5	-177.8	172.8	168.3	-3.2	115.9
406	S	27.3	Very low	30.2	Very low	118 Å²	118	149.3 Å²	149.3	83%	0.825	80%	0.796	S	S	*	*			trans	-66.5	131.3	160.5	47.1	0	0	0	0	110.8
407	L	30.2	Very low	30.3	Very low	167 Å²	167	152 Å²	152	87%	0.874	80%	0.796	S	S	*	*			trans	-118.5	146.1	153.7	-76.3	171	0	0	0	107.4
408	S	30.7	Very low	30.4	Very low	100 Å²	100	149.7 Å²	149.7	70%	0.699	80%	0.798	S	S	*	*			trans	-74.2	137.7	-178	-167.9	0	0	0	0	110.7	A410	S408-A410 PolarHBondContact O-N 3.35Å
409	P	28.2	Very low	30.6	Very low	135 Å²	135	151.5 Å²	151.5	88%	0.877	80%	0.801	S	S	*	*	S	Bend	trans	-79	66.5	170.8	34.6	-34.7	0	0	0	110.2
410	A	32.1	Very low	30.8	Very low	68 Å²	68	155.5 Å²	155.5	56%	0.562	81%	0.813	S	S	*	*			trans	-146.2	50.7	-172.6	0	0	0	0	0	113.1	S408	S408-A410 PolarHBondContact O-N 3.35Å
411	D	32.4	Very low	30.9	Very low	154 Å²	154	157.1 Å²	157.1	82%	0.824	82%	0.816	S	S	*	*			trans	-149.7	66.2	167.4	-91.4	-44.6	0	0	0	109.5
412	I	29	Very low	31	Very low	167 Å²	167	157.4 Å²	157.4	86%	0.856	82%	0.823	S	S	*	*			trans	-117	82.7	167.6	-56.1	-180	0	0	0	107.9
413	T	34.3	Very low	31	Very low	116 Å²	116	151.5 Å²	151.5	71%	0.712	82%	0.816	S	S	*	*			trans	-137.5	105.7	174	41.6	0	0	0	0	111.4
414	N	28.7	Very low	31.2	Very low	165 Å²	165	146.5 Å²	146.5	88%	0.882	81%	0.806	S	S	*	*			trans	36.9	97	146.8	-59.1	-17.3	0	0	0	119
415	S	34	Very low	31	Very low	127 Å²	127	153.1 Å²	153.1	89%	0.888	82%	0.817	S	S	*	*			trans	-129.9	139.5	138.8	55.2	0	0	0	0	110.9
416	K	35	Very low	31	Very low	187 Å²	187	146.8 Å²	146.8	81%	0.813	81%	0.807	S	S	*	*			trans	-69.8	147.6	-156	-62.9	176.9	177.7	-177.9	0	115.2
417	E	30.9	Very low	30.9	Very low	169 Å²	169	152.3 Å²	152.3	79%	0.79	81%	0.81	S	S	*	*			trans	37.8	106.4	133.8	-56.7	174.7	101.3	0	0	119.2
418	S	32	Very low	31	Very low	117 Å²	117	153.2 Å²	153.2	82%	0.818	81%	0.807	S	S	*	*			trans	-145	134.4	131.1	51.8	0	0	0	0	110.3
419	K	31.6	Very low	30.8	Very low	185 Å²	185	152.9 Å²	152.9	80%	0.804	81%	0.805	S	S	*	*			trans	-93.1	127.3	178.8	-61.7	168.4	-177.6	169.3	0	108.7
420	F	30.6	Very low	30.8	Very low	206 Å²	206	153.6 Å²	153.6	90%	0.904	80%	0.801	S	S	*	*			trans	-140.6	140.5	155.1	-95.4	-73.5	0	0	0	111.2
421	L	32.5	Very low	30.9	Very low	147 Å²	147	154.7 Å²	154.7	77%	0.77	81%	0.81	S	S	*	*			trans	-90.8	151.9	-167.5	-74.1	71.6	0	0	0	112
422	F	27.2	Very low	30.8	Very low	216 Å²	216	155 Å²	155	95%	0.947	81%	0.806	S	S	*	*			trans	-81.1	123.9	154.8	-90.3	-94.5	0	0	0	109.8
423	S	31.3	Very low	31	Very low	104 Å²	104	151.4 Å²	151.4	73%	0.727	80%	0.796	S	S	*	*			trans	-154.3	142.4	165.6	-70.3	0	0	0	0	110
424	P	34.3	Very low	30.9	Very low	117 Å²	117	152.9 Å²	152.9	76%	0.76	80%	0.8	S	S	*	*			trans	-113.8	164.5	-167.8	40.7	-33.9	0	0	0	116
425	K	27.3	Very low	31.2	Very low	204 Å²	204	152.7 Å²	152.7	89%	0.887	79%	0.793	S	S	*	*			trans	71.2	153.6	166.5	-78.4	176.3	179.7	176.2	0	114.5
426	P	31.3	Very low	31.1	Very low	113 Å²	113	153.4 Å²	153.4	73%	0.734	78%	0.784	S	S	*	*				-135.2	-168.7	54.7	40.8	-22.2	0	0	0	116.9	F428	P426-F428 HydrophobicContact CG-CE2 4.4Å
427	R	26.2	Very low	31.1	Very low	235 Å²	235	150.3 Å²	150.3	89%	0.887	78%	0.777	S	S	*	*			trans	-104.7	143.2	171.8	-75.1	170.8	158	178	-9.2	110.2
428	F	31.4	Very low	31.4	Very low	186 Å²	186	147.8 Å²	147.8	82%	0.816	77%	0.769	S	S	*	*			trans	-151.3	147.4	147.3	-65.6	-78.2	0	0	0	107.7	P426	P426-F428 HydrophobicContact CG-CE2 4.4Å
429	S	27.6	Very low	31.5	Very low	93 Å²	93	150.1 Å²	150.1	65%	0.65	77%	0.767	S	S	*	*			cis	118.6	112	-10.6	78.4	0	0	0	0	116.6
430	L	28.1	Very low	31.5	Very low	149 Å²	149	146.1 Å²	146.1	78%	0.78	76%	0.76	S	S	*	*			trans	64	127.9	159.5	-98.1	71.5	0	0	0	122.1
431	A	32.7	Very low	31.6	Very low	92 Å²	92	142.3 Å²	142.3	76%	0.76	75%	0.748	S	S	*	*			trans	-175.3	114.2	150.8	0	0	0	0	0	102
432	E	30.3	Very low	31.7	Very low	160 Å²	160	143.1 Å²	143.1	75%	0.748	75%	0.747	S	S	*	*			cis	51.6	123	37.8	-75.4	173.5	165.4	0	0	110.9
433	S	33.1	Very low	31.7	Very low	92 Å²	92	140 Å²	140	64%	0.643	74%	0.74	S	S	*	*			cis	-147.9	162.6	31.3	-22.9	0	0	0	0	112.9
434	D	32.9	Very low	31.9	Very low	147 Å²	147	140 Å²	140	79%	0.786	74%	0.741	S	S	*	*			trans	63	155.6	144.9	-47.5	-30.2	0	0	0	119.2
435	E	34	Very low	31.7	Very low	160 Å²	160	139.6 Å²	139.6	75%	0.748	73%	0.729	S	S	*	*			cis	-147.6	169.4	11.6	-149.4	168.3	-174.1	0	0	112.7
436	M	33.8	Very low	31.9	Very low	142 Å²	142	134.3 Å²	134.3	70%	0.7	72%	0.717	S	S	*	*			trans	-21.5	154.8	160.7	-69.7	179.3	-81.3	0	0	117.2
437	N	35	Very low	31.9	Very low	122 Å²	122	134.5 Å²	134.5	65%	0.652	72%	0.721	S	S	*	*			cis	-168.3	-176.8	14	-110.9	12.7	0	0	0	107.6
438	D	36.6	Very low	32.2	Very low	117 Å²	117	127.1 Å²	127.1	63%	0.626	72%	0.718	S	S	*	*			cis	-157.4	148.3	1.8	-123	-36.6	0	0	0	110.6
439	Q	33.9	Very low	32	Very low	165 Å²	165	128 Å²	128	77%	0.771	72%	0.722	S	S	*	*			trans	53.1	161.3	152.5	-62.2	-70.4	-34.7	0	0	122.8
440	P	32	Very low	32.2	Very low	101 Å²	101	133.6 Å²	133.6	66%	0.656	73%	0.729	S	S	*	*			trans	-125.3	-148.5	-174.1	32.7	-8.9	0	0	0	113.2
441	I	32	Very low	32.3	Very low	127 Å²	127	132.3 Å²	132.3	65%	0.651	72%	0.723	S	S	*	*			trans	111.2	132.2	154.5	-60.3	159.8	0	0	0	117.9
442	E	34.4	Very low	32	Very low	163 Å²	163	133.9 Å²	133.9	76%	0.762	72%	0.723	S	S	*	*			trans	50.3	111.6	159	-73.7	155.3	-150.8	0	0	124.7
443	N	28	Very low	31.9	Very low	150 Å²	150	134.4 Å²	134.4	80%	0.802	73%	0.729	S	S	*	*				39	144.5	110.3	-68.7	-27.2	0	0	0	123.1
444	S	34.2	Very low	31.6	Very low	105 Å²	105	136.7 Å²	136.7	73%	0.734	73%	0.732	S	S	*	*			trans	106.9	100.7	145	76.2	0	0	0	0	120.9
445	Q	31.1	Very low	31.3	Very low	109 Å²	109	136.8 Å²	136.8	51%	0.509	73%	0.733	S	S	.	*				57.6	125.7	123.8	-67.1	173.2	-16.1	0	0	123.8	Q468	Q445-Q468 VanDerWaalsContact NE2-CD 3.29Å
446	S	30.4	Very low	30.9	Very low	93 Å²	93	133.9 Å²	133.9	65%	0.65	73%	0.729	S	S	*	*			trans	83.9	114.4	134.1	68.7	0	0	0	0	122.5
447	S	31.3	Very low	30.6	Very low	117 Å²	117	132.9 Å²	132.9	82%	0.818	74%	0.736	S	S	*	*			trans	51.8	120.8	136.4	60.3	0	0	0	0	122.5
448	G	32.8	Very low	30.3	Very low	80 Å²	80	131.8 Å²	131.8	83%	0.825	74%	0.738	S	S	*	*			trans	-159.6	135.3	158.5	0	0	0	0	0	111.7
449	F	27.6	Very low	29.9	Very low	203 Å²	203	133.4 Å²	133.4	89%	0.89	75%	0.746	S	S	*	*			trans	-96.2	152.9	-175.9	-79.2	-107.4	0	0	0	112.6
450	R	31	Very low	29.6	Very low	212 Å²	212	134.4 Å²	134.4	80%	0.8	75%	0.751	S	S	*	*				-177.2	159.8	111	-101.7	177.2	-174.9	-76.6	-2.6	115.9
451	D	31.5	Very low	29.3	Very low	122 Å²	122	134.4 Å²	134.4	65%	0.652	75%	0.753	S	S	*	*			trans	50.3	98.1	158.1	-47.7	-14.9	0	0	0	117.3
452	V	27.1	Very low	29	Very low	124 Å²	124	132.9 Å²	132.9	75%	0.752	76%	0.76	S	S	*	*				76.9	97.3	54.6	-175	0	0	0	0	114.6
453	I	27.6	Very low	28.7	Very low	172 Å²	172	133 Å²	133	88%	0.882	76%	0.764	S	S	*	*			trans	-151.2	142.7	132.5	-95.4	155.9	0	0	0	105.8
454	I	25.6	Very low	28.6	Very low	139 Å²	139	131.2 Å²	131.2	71%	0.713	76%	0.763	S	S	*	*			trans	-128.7	127.1	-173	-66.3	167.1	0	0	0	108.7
455	D	27.5	Very low	28.1	Very low	150 Å²	150	136.8 Å²	136.8	80%	0.802	77%	0.77	S	S	*	*				-154.8	144.7	121.9	-135.4	-20	0	0	0	115.2
456	C	26.3	Very low	28	Very low	98 Å²	98	137.1 Å²	137.1	66%	0.662	78%	0.781	S	S	*	*			trans	-62	140.7	-167.5	-48.7	0	0	0	0	112.9
457	S	26.1	Very low	27.9	Very low	121 Å²	121	137.9 Å²	137.9	85%	0.846	78%	0.782	S	S	*	*				-158	117.6	55.7	29.9	0	0	0	0	109.8
458	S	29.1	Very low	27.7	Very low	100 Å²	100	138.2 Å²	138.2	70%	0.699	77%	0.77	S	S	*	*			trans	-156.7	162.9	-162.6	63	0	0	0	0	112.9
459	L	28.6	Very low	27.5	Very low	151 Å²	151	140.4 Å²	140.4	79%	0.791	76%	0.763	S	S	*	*			trans	64.9	163.8	169.8	-88.5	66.8	0	0	0	115
460	E	26.4	Very low	27.6	Very low	186 Å²	186	135.3 Å²	135.3	87%	0.869	75%	0.753	S	S	*	*			cis	-110.6	137.5	6.7	-70.7	177.6	137	0	0	114.2
461	S	27.6	Very low	27.3	Very low	101 Å²	101	131.2 Å²	131.2	71%	0.706	76%	0.755	S	S	*	*			trans	-119.2	112.4	161.2	57.6	0	0	0	0	109.2
462	A	25.4	Very low	27.1	Very low	95 Å²	95	129.3 Å²	129.3	79%	0.785	75%	0.751	S	S	*	*			trans	65.8	178.8	170.6	0	0	0	0	0	117.4
463	I	27.5	Very low	27.3	Very low	165 Å²	165	131.4 Å²	131.4	85%	0.846	75%	0.752	S	S	*	*			trans	97.7	124	171.8	-52.7	170.6	0	0	0	116.8
464	S	26.2	Very low	27.4	Very low	113 Å²	113	129.5 Å²	129.5	79%	0.79	74%	0.744	S	S	*	*	P	Polyproline II helix	trans	-51.8	158.6	-177.3	-48.7	0	0	0	0	119.6
465	Y	22.6	Very low	27.6	Very low	222 Å²	222	130.2 Å²	130.2	87%	0.871	75%	0.749	S	S	*	*	P	Polyproline II helix	trans	-60.5	153.9	172	-63.4	-91.2	0	0	0	116.3
466	P	30.6	Very low	27.8	Very low	116 Å²	116	127 Å²	127	75%	0.753	75%	0.752	S	S	*	*	P	Polyproline II helix	trans	-97.2	164.6	140.3	36.5	-29.7	0	0	0	112.3
467	V	27.4	Very low	28	Very low	109 Å²	109	129.4 Å²	129.4	66%	0.661	76%	0.758	S	S	*	*			trans	-121.2	164.7	-178.2	-177.2	0	0	0	0	109.7
468	Q	28.2	Very low	28.4	Very low	124 Å²	124	131.9 Å²	131.9	58%	0.579	75%	0.753	S	S	*	*			trans	84.9	147.1	178.2	-69.5	-172.4	1	0	0	115.6	Q445	Q445-Q468 VanDerWaalsContact NE2-CD 3.29Å
469	N	28.4	Very low	28.5	Very low	126 Å²	126	134 Å²	134	67%	0.674	76%	0.757	S	S	*	*			cis	-145.7	166.2	10.2	-125.2	-20.9	0	0	0	114.5
470	S	29.5	Very low	28.7	Very low	96 Å²	96	134 Å²	134	67%	0.671	76%	0.756	S	S	*	*			trans	67.8	112.4	157.3	-56.7	0	0	0	0	121.2
471	C	24.8	Very low	28.8	Very low	125 Å²	125	131.7 Å²	131.7	85%	0.845	75%	0.75	S	S	*	*				49.4	148.9	124.9	-64.2	0	0	0	0	122.8
472	S	27.5	Very low	28.8	Very low	83 Å²	83	132 Å²	132	58%	0.58	75%	0.752	S	S	*	*			cis	177.7	150.7	-15.9	52	0	0	0	0	109.1
473	H	30.1	Very low	29.1	Very low	167 Å²	167	132.4 Å²	132.4	77%	0.773	75%	0.749	S	S	*	*			trans	65.2	157.2	168.7	-56.7	-65.4	0	0	0	115.6
474	L	30.1	Very low	29.1	Very low	133 Å²	133	134 Å²	134	70%	0.696	75%	0.75	S	S	*	*			cis	-156.2	158.6	-17.5	-112.8	166.2	0	0	0	108.9
475	N	29.7	Very low	29.2	Very low	153 Å²	153	135.6 Å²	135.6	82%	0.818	75%	0.75	S	S	*	*			trans	20.1	113.8	159	-63.4	-13.7	0	0	0	120.2
476	G	32.7	Very low	29.5	Very low	84 Å²	84	129.6 Å²	129.6	87%	0.866	74%	0.741	S	S	*	*			trans	-156.7	74.5	173.1	0	0	0	0	0	114.5
477	N	30.4	Very low	29.3	Very low	148 Å²	148	135.4 Å²	135.4	79%	0.791	75%	0.748	S	S	*	*			trans	-75.5	147.7	-171.4	-165.3	-0.5	0	0	0	114.2
478	K	34.8	Very low	29.4	Very low	172 Å²	172	135.6 Å²	135.6	75%	0.748	75%	0.749	S	S	*	*			trans	98.4	113.6	163.2	-56.1	170.4	-177.6	175.5	0	120.2
479	N	31	Very low	29.3	Very low	145 Å²	145	140.8 Å²	140.8	78%	0.775	77%	0.765	S	S	*	*				34.9	120.6	126.8	-43.9	-4	0	0	0	118.3
480	L	32.2	Very low	29.3	Very low	150 Å²	150	143.6 Å²	143.6	79%	0.785	77%	0.774	S	S	*	*				-166.7	164	72.9	-92.3	163.3	0	0	0	112.2
481	D	28.5	Very low	29.6	Very low	139 Å²	139	143.6 Å²	143.6	74%	0.743	77%	0.774	S	S	*	*			trans	25	125.4	156.9	-50.9	-24.7	0	0	0	119.4
482	S	28	Very low	29.9	Very low	106 Å²	106	143 Å²	143	74%	0.741	76%	0.762	S	S	*	*				177.2	175.2	63.5	45.9	0	0	0	0	112.7
483	S	31	Very low	30.1	Very low	104 Å²	104	145.5 Å²	145.5	73%	0.727	77%	0.766	S	S	*	*			trans	61.7	110	174.9	49	0	0	0	0	117.1
484	F	27.2	Very low	30.2	Very low	198 Å²	198	141.3 Å²	141.3	87%	0.868	76%	0.756	S	S	*	*				57.3	97.7	79.3	-80.3	-93.2	0	0	0	113.4
485	D	28.8	Very low	30.5	Very low	148 Å²	148	138.8 Å²	138.8	79%	0.791	75%	0.746	S	S	*	*				-168.1	160.3	83	-125.9	-31.8	0	0	0	115.3
486	S	29	Very low	30.5	Very low	96 Å²	96	139.4 Å²	139.4	67%	0.671	74%	0.738	S	S	*	*	S	Bend	trans	69.8	155.4	176.2	84.5	0	0	0	0	119.3
487	R	27.1	Very low	30.6	Very low	237 Å²	237	140.7 Å²	140.7	89%	0.894	72%	0.724	S	S	*	*			trans	76.7	38.4	168.9	-53.5	-172.5	-179	-160.2	2.9	121.9
488	T	27.8	Very low	30.7	Very low	113 Å²	113	138.4 Å²	138.4	69%	0.693	71%	0.712	S	S	*	*			trans	-146.9	105.5	160	36.9	0	0	0	0	115.2
489	Y	26.4	Very low	30.6	Very low	233 Å²	233	134.6 Å²	134.6	91%	0.914	70%	0.7	S	S	*	*	S	Bend	trans	-157.5	153.3	145.6	-99.9	-72	0	0	0	110.1	S491	Y489-S491 PolarHBondContact O-N 2.88Å
490	Q	29.9	Very low	30.8	Very low	186 Å²	186	131.3 Å²	131.3	87%	0.869	69%	0.685	S	S	*	*	S	Bend	trans	66.1	5.6	176.8	-62.7	-167.7	-10.4	0	0	119.8
491	S	35.3	Very low	30.8	Very low	95 Å²	95	127.2 Å²	127.2	66%	0.664	67%	0.672	S	S	*	*	S	Bend	trans	-97.9	8.2	166	-162.7	0	0	0	0	114.8	Y489	Y489-S491 PolarHBondContact O-N 2.88Å
492	L	30.7	Very low	31.1	Very low	112 Å²	112	126.8 Å²	126.8	59%	0.586	67%	0.666	S	S	*	*	S	Bend	trans	-108.9	-24.2	-176	-80.6	161.7	0	0	0	114.5	S494 V495 Y496	L492-S494 VanDerWaalsContact C-N 3.3Å; L492-S494 PolarHBondContact O-N 3.4Å; L492-V495 PolarHBondContact O-N 2.72Å; L492-V495 VanDerWaalsContact O-N 3.12Å; L492-Y496 PolarHBondContact O-N 3.28Å; L492-Y496 VanDerWaalsContact O-N 3.08Å
493	M	31.3	Very low	31.4	Very low	136 Å²	136	129.7 Å²	129.7	67%	0.67	67%	0.665	S	S	*	*	H	α-helix	trans	-65.7	-33.4	-176.8	-162.2	69.8	84.5	0	0	112.4	V495 L497	M493-V495 VanDerWaalsContact C-N 3.29Å; M493-V495 PolarHBondContact O-N 3.05Å; M493-L497 HydrophobicContact CG-CD1 4.04Å; M493-L497 WeakPolarHBondContact O-CB 3.27Å; M493-L497 WeakPolarHBondContact O-CG 3.42Å; M493-L497 PolarHBondContact O-N 2.94Å
494	S	33.3	Very low	31.5	Very low	80 Å²	80	131.5 Å²	131.5	56%	0.559	67%	0.667	S	S	*	*	H	α-helix	trans	-73.9	-14	176	44.7	0	0	0	0	114.5	L492 N498	L492-S494 VanDerWaalsContact C-N 3.3Å; L492-S494 PolarHBondContact O-N 3.4Å; S494-N498 PolarHBondContact O-ND2 3.02Å
495	V	35.7	Very low	31.8	Very low	79 Å²	79	132.6 Å²	132.6	48%	0.479	67%	0.665	S	S	.	*	H	α-helix	trans	-92.3	-51.2	173.7	-176.1	0	0	0	0	109.4	L492 M493 L497 N498	L492-V495 PolarHBondContact O-N 2.72Å; L492-V495 VanDerWaalsContact O-N 3.12Å; M493-V495 VanDerWaalsContact C-N 3.29Å; M493-V495 PolarHBondContact O-N 3.05Å; V495-L497 VanDerWaalsContact C-N 3.31Å; V495-L497 PolarHBondContact O-N 3.06Å; V495-N498 PolarHBondContact O-N 3.41Å; V495-N498 VanDerWaalsContact O-N 3.12Å
496	Y	29.9	Very low	31.8	Very low	166 Å²	166	132.1 Å²	132.1	65%	0.651	66%	0.661	S	S	*	*	H	α-helix	trans	-62	-32.4	-177.9	-114.9	-99.3	0	0	0	114.2	L492 N498 D499 V500	L492-Y496 PolarHBondContact O-N 3.28Å; L492-Y496 VanDerWaalsContact O-N 3.08Å; Y496-N498 VanDerWaalsContact C-N 3.31Å; Y496-N498 PolarHBondContact O-N 3.47Å; Y496-D499 PolarHBondContact O-N 2.96Å; Y496-V500 WeakPolarHBondContact O-CG2 3.39Å; Y496-V500 PolarHBondContact O-N 2.83Å
497	L	34.4	Very low	31.7	Very low	111 Å²	111	135 Å²	135	58%	0.581	67%	0.667	S	S	*	*	H	α-helix	trans	-71.7	-20.8	177.9	-77.1	170	0	0	0	114	M493 V495 A501	M493-L497 HydrophobicContact CG-CD1 4.04Å; M493-L497 WeakPolarHBondContact O-CB 3.27Å; M493-L497 WeakPolarHBondContact O-CG 3.42Å; M493-L497 PolarHBondContact O-N 2.94Å; V495-L497 VanDerWaalsContact C-N 3.31Å; V495-L497 PolarHBondContact O-N 3.06Å; L497-A501 VanDerWaalsContact O-CB 3.25Å; L497-A501 WeakPolarHBondContact O-CB 3.38Å; L497-A501 PolarHBondContact O-N 3.41Å
498	N	33.2	Very low	31.7	Very low	100 Å²	100	129.4 Å²	129.4	54%	0.535	66%	0.66	S	S	.	*	H	α-helix	trans	-77	-42	173.2	-86.3	-57.3	0	0	0	111.7	S494 V495 Y496 A501 Q502	S494-N498 PolarHBondContact O-ND2 3.02Å; V495-N498 PolarHBondContact O-N 3.41Å; V495-N498 VanDerWaalsContact O-N 3.12Å; Y496-N498 VanDerWaalsContact C-N 3.31Å; Y496-N498 PolarHBondContact O-N 3.47Å; N498-A501 PolarHBondContact O-N 3.42Å; N498-Q502 WeakPolarHBondContact O-CG 3.33Å; N498-Q502 PolarHBondContact O-N 2.89Å
499	D	32	Very low	31.6	Very low	92 Å²	92	129 Å²	129	49%	0.492	66%	0.659	S	S	.	*	H	α-helix	trans	-68.8	-36.7	-179.9	-75.6	-18.1	0	0	0	112.7	Y496 Q502 K503	Y496-D499 PolarHBondContact O-N 2.96Å; D499-Q502 PolarHBondContact O-N 3.28Å; D499-K503 WeakPolarHBondContact O-CB 3.25Å; D499-K503 PolarHBondContact O-N 2.82Å
500	V	34.2	Very low	31.5	Very low	77 Å²	77	123.2 Å²	123.2	47%	0.467	65%	0.648	S	S	.	*	H	α-helix	trans	-68.6	-36.3	174.1	177.1	0	0	0	0	111.2	Y496 Q502 N504	Y496-V500 WeakPolarHBondContact O-CG2 3.39Å; Y496-V500 PolarHBondContact O-N 2.83Å; V500-Q502 VanDerWaalsContact C-N 3.32Å; V500-Q502 PolarHBondContact O-N 3.48Å; V500-N504 PolarHBondContact O-N 3.31Å
501	A	33.7	Very low	31.2	Very low	63 Å²	63	119.8 Å²	119.8	52%	0.521	64%	0.64	S	S	.	*	H	α-helix	trans	-72.3	-20.6	175.3	0	0	0	0	0	114	L497 N498	L497-A501 VanDerWaalsContact O-CB 3.25Å; L497-A501 WeakPolarHBondContact O-CB 3.38Å; L497-A501 PolarHBondContact O-N 3.41Å; N498-A501 PolarHBondContact O-N 3.42Å
502	Q	34.4	Very low	30.6	Very low	131 Å²	131	120 Å²	120	61%	0.612	64%	0.637	S	S	*	*	H	α-helix	trans	-92.7	-36.6	174	-68.9	-168.5	23.6	0	0	113.1	N498 D499 V500 N504 R505	N498-Q502 WeakPolarHBondContact O-CG 3.33Å; N498-Q502 PolarHBondContact O-N 2.89Å; D499-Q502 PolarHBondContact O-N 3.28Å; V500-Q502 VanDerWaalsContact C-N 3.32Å; V500-Q502 PolarHBondContact O-N 3.48Å; Q502-N504 VanDerWaalsContact C-N 3.33Å; Q502-N504 PolarHBondContact O-N 2.82Å; Q502-R505 PolarHBondContact O-N 2.96Å; Q502-R505 VanDerWaalsContact O-N 3.14Å
503	K	33.4	Very low	30.3	Very low	166 Å²	166	121 Å²	121	72%	0.722	64%	0.642	S	S	*	*	H	α-helix	trans	-63.2	-36.1	175.8	-80.4	-176.4	174.1	178	0	113	D499 R505 I506	D499-K503 WeakPolarHBondContact O-CB 3.25Å; D499-K503 PolarHBondContact O-N 2.82Å; K503-R505 PolarHBondContact O-N 3.18Å; K503-I506 PolarHBondContact O-N 3.19Å
504	N	34.1	Very low	30	Very low	142 Å²	142	119.9 Å²	119.9	76%	0.759	64%	0.643	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.8	15.5	175.6	-70.3	-4.7	0	0	0	114.3	V500 Q502	V500-N504 PolarHBondContact O-N 3.31Å; Q502-N504 VanDerWaalsContact C-N 3.33Å; Q502-N504 PolarHBondContact O-N 2.82Å
505	R	33.2	Very low	29.6	Very low	221 Å²	221	121.6 Å²	121.6	83%	0.834	65%	0.65	S	S	*	*	T	Hydrogen-bonded Turn	trans	-113.1	-2.8	172.1	-103.9	179.8	176.8	163.1	3	114.7	Q502 K503	Q502-R505 PolarHBondContact O-N 2.96Å; Q502-R505 VanDerWaalsContact O-N 3.14Å; K503-R505 PolarHBondContact O-N 3.18Å
506	I	28.4	Very low	29.2	Very low	138 Å²	138	123.9 Å²	123.9	71%	0.708	66%	0.664	S	S	*	*	S	Bend	trans	-133.9	82.4	-179.9	-51.1	178.6	0	0	0	109.2	K503	K503-I506 PolarHBondContact O-N 3.19Å
507	I	27.8	Very low	29.1	Very low	157 Å²	157	123.2 Å²	123.2	81%	0.805	67%	0.672	S	S	*	*			trans	-169	94.4	143.7	-88.7	141.9	0	0	0	104.7
508	T	26.2	Very low	28.9	Very low	119 Å²	119	125.4 Å²	125.4	73%	0.73	68%	0.683	S	S	*	*			trans	-75.7	121.4	150.3	41.7	0	0	0	0	106.2	T510	T508-T510 PolarHBondContact O-N 3.29Å
509	P	25.2	Very low	28.6	Very low	105 Å²	105	127.6 Å²	127.6	68%	0.682	69%	0.694	S	S	*	*			trans	-69.2	91.1	166.9	29.5	-32.3	0	0	0	107.4	V511	P509-V511 HydrophobicContact CB-CG2 4.27Å; P509-V511 PolarHBondContact O-N 2.62Å
510	T	24.2	Very low	28.5	Very low	111 Å²	111	130.1 Å²	130.1	68%	0.681	71%	0.708	S	S	*	*			trans	-68.3	80	166.6	-51.4	0	0	0	0	107	T508 T512	T508-T510 PolarHBondContact O-N 3.29Å; T510-T512 PolarHBondContact O-N 2.95Å
511	V	24.7	Very low	28.3	Very low	115 Å²	115	132.1 Å²	132.1	70%	0.697	72%	0.72	S	S	*	*			trans	-72.2	81.1	171.1	-175.9	0	0	0	0	106.7	P509 I513	P509-V511 HydrophobicContact CB-CG2 4.27Å; P509-V511 PolarHBondContact O-N 2.62Å; V511-I513 VanDerWaalsContact C-N 3.28Å; V511-I513 HydrophobicContact CG1-CG1 4.13Å; V511-I513 PolarHBondContact O-N 3.04Å
512	T	23.1	Very low	28.2	Very low	99 Å²	99	137.1 Å²	137.1	61%	0.607	74%	0.737	S	S	*	*			trans	-62.8	95.7	166.2	-52.8	0	0	0	0	106.8	T510 T514	T510-T512 PolarHBondContact O-N 2.95Å; T512-T514 HydrophobicContact CG2-CG2 3.91Å; T512-T514 PolarHBondContact O-N 3.12Å
513	I	24.6	Very low	27.8	Very low	134 Å²	134	135.2 Å²	135.2	69%	0.687	74%	0.738	S	S	*	*			trans	-69.3	90.1	166.8	-57.9	179.3	0	0	0	105.9	V511 T515	V511-I513 VanDerWaalsContact C-N 3.28Å; V511-I513 HydrophobicContact CG1-CG1 4.13Å; V511-I513 PolarHBondContact O-N 3.04Å; I513-T515 HydrophobicContact CG2-CG2 4.31Å; I513-T515 PolarHBondContact O-N 3.27Å
514	T	23.5	Very low	27.8	Very low	112 Å²	112	134.9 Å²	134.9	69%	0.687	74%	0.739	S	S	*	*			trans	-69.6	80.8	166.3	46.5	0	0	0	0	108.4	T512 T516	T512-T514 HydrophobicContact CG2-CG2 3.91Å; T512-T514 PolarHBondContact O-N 3.12Å; T514-T516 PolarHBondContact O-N 3.29Å
515	T	26.5	Very low	27.7	Very low	115 Å²	115	133.2 Å²	133.2	71%	0.706	73%	0.731	S	S	*	*			trans	-59.6	107.5	153.7	33.2	0	0	0	0	107	I513 N517	I513-T515 HydrophobicContact CG2-CG2 4.31Å; I513-T515 PolarHBondContact O-N 3.27Å; T515-N517 PolarHBondContact O-N 3.43Å
516	T	26.8	Very low	27.5	Very low	127 Å²	127	129.1 Å²	129.1	78%	0.779	73%	0.725	S	S	*	*			trans	-69.3	75.2	169.6	48.6	0	0	0	0	108.6	T514 I518	T514-T516 PolarHBondContact O-N 3.29Å; T516-I518 PolarHBondContact O-N 3.09Å; T516-I518 VanDerWaalsContact O-N 3.13Å
517	N	27.9	Very low	27.7	Very low	153 Å²	153	128.1 Å²	128.1	82%	0.818	73%	0.726	S	S	*	*			trans	-69.7	109.2	174.2	-146.8	21.5	0	0	0	106.6	T515 N519	T515-N517 PolarHBondContact O-N 3.43Å; N517-N519 PolarHBondContact O-N 3.26Å
518	I	30.1	Very low	27.6	Very low	157 Å²	157	125.9 Å²	125.9	81%	0.805	72%	0.724	S	S	*	*			trans	-62.2	138	-176.3	-66.4	173.8	0	0	0	108.4	T516 N520	T516-I518 PolarHBondContact O-N 3.09Å; T516-I518 VanDerWaalsContact O-N 3.13Å; I518-N520 PolarHBondContact O-N 3.46Å
519	N	26.8	Very low	27.8	Very low	145 Å²	145	126.9 Å²	126.9	78%	0.775	73%	0.73	S	S	*	*			trans	-49.2	126.3	178.9	-66.7	-35.1	0	0	0	111.3	N517	N517-N519 PolarHBondContact O-N 3.26Å
520	N	29.3	Very low	27.8	Very low	146 Å²	146	128.7 Å²	128.7	78%	0.781	73%	0.734	S	S	*	*			trans	-152.4	139.9	132.6	-108.6	-27.7	0	0	0	113.1	I518	I518-N520 PolarHBondContact O-N 3.46Å
521	T	31	Very low	28.1	Very low	119 Å²	119	132.1 Å²	132.1	73%	0.73	74%	0.742	S	S	*	*			trans	52.2	96.4	154.8	56.8	0	0	0	0	119.4
522	L	30.4	Very low	28.2	Very low	167 Å²	167	134.1 Å²	134.1	87%	0.874	75%	0.749	S	S	*	*				85.2	138.9	123.7	-130.7	70.5	0	0	0	120.1
523	S	27.6	Very low	28.6	Very low	91 Å²	91	136.9 Å²	136.9	64%	0.636	76%	0.758	S	S	*	*			trans	-61.1	158.4	161.4	46.5	0	0	0	0	110.8
524	E	32	Very low	28.6	Very low	159 Å²	159	135.7 Å²	135.7	74%	0.743	76%	0.761	S	S	*	*				-166.1	158.1	64.6	-88.9	-169.8	-170.5	0	0	115.9
525	N	32	Very low	29	Very low	108 Å²	108	138 Å²	138	58%	0.578	77%	0.768	S	S	*	*			trans	50.6	103.2	138.4	-62.6	-37.5	0	0	0	121.8
526	N	29.8	Very low	29.1	Very low	134 Å²	134	138.8 Å²	138.8	72%	0.717	77%	0.768	S	S	*	*				75.3	142.2	118.2	-60	-28.8	0	0	0	122.9
527	T	31.8	Very low	29.3	Very low	117 Å²	117	139.9 Å²	139.9	72%	0.718	77%	0.769	S	S	*	*			trans	55.2	92.8	146.7	50.5	0	0	0	0	119.8
528	S	26.7	Very low	29.3	Very low	111 Å²	111	136.9 Å²	136.9	78%	0.776	76%	0.756	S	S	*	*				23.2	114.6	123	60.2	0	0	0	0	119.3
529	T	30.3	Very low	29.4	Very low	140 Å²	140	136 Å²	136	86%	0.859	75%	0.753	S	S	*	*			trans	-149.4	154.7	140.3	-2.8	0	0	0	0	110.1
530	N	25	Very low	29.6	Very low	143 Å²	143	138 Å²	138	77%	0.765	75%	0.751	S	S	*	*			trans	-70.3	160.5	173	-55	-60	0	0	0	110.3
531	H	31.3	Very low	29.6	Very low	182 Å²	182	138 Å²	138	84%	0.843	75%	0.751	S	S	*	*				-168	139.7	118.1	-98.9	-67.8	0	0	0	111
532	N	26.5	Very low	29.7	Very low	158 Å²	158	139.5 Å²	139.5	85%	0.845	76%	0.755	S	S	*	*			trans	-84.6	135.4	171.9	-62.4	-28	0	0	0	110
533	I	31.2	Very low	29.5	Very low	157 Å²	157	137.8 Å²	137.8	81%	0.805	75%	0.751	S	S	*	*			trans	-138.6	138.2	141.3	-79.6	104.3	0	0	0	107.2
534	C	23.9	Very low	29.6	Very low	109 Å²	109	140.5 Å²	140.5	74%	0.736	76%	0.757	S	S	*	*			trans	-124.6	139.6	170.2	-174.7	0	0	0	0	107.8
535	L	31.4	Very low	29.3	Very low	160 Å²	160	138.7 Å²	138.7	84%	0.838	76%	0.757	S	S	*	*			trans	-147.4	143.4	172.1	-93.9	172.3	0	0	0	109.6
536	D	28.4	Very low	29	Very low	131 Å²	131	140.8 Å²	140.8	70%	0.701	77%	0.767	S	S	*	*			trans	-99.2	-176	-161.7	-63	-74.9	0	0	0	115.4
537	N	31.5	Very low	28.9	Very low	150 Å²	150	138.7 Å²	138.7	80%	0.802	76%	0.761	S	S	*	*			trans	99.2	95.5	153.4	-59.2	-51.2	0	0	0	119
538	T	29.3	Very low	28.6	Very low	91 Å²	91	139.3 Å²	139.3	56%	0.558	77%	0.767	S	S	*	*			trans	-16.2	135	142.1	53.8	0	0	0	0	117.5
539	N	31.4	Very low	28.7	Very low	139 Å²	139	140.3 Å²	140.3	74%	0.743	76%	0.763	S	S	*	*				-165.1	155.7	118.5	-108.1	-26.1	0	0	0	116.1
540	Y	30.8	Very low	28.7	Very low	187 Å²	187	140.3 Å²	140.3	73%	0.733	76%	0.758	S	S	*	*			trans	12.6	127.6	167.3	-67.4	-78.6	0	0	0	123.5
541	N	28.8	Very low	29.1	Very low	144 Å²	144	140.3 Å²	140.3	77%	0.77	76%	0.756	S	S	*	*			trans	25.1	105.4	131.1	-60.3	-1.8	0	0	0	118.6
542	N	33	Very low	29.2	Very low	151 Å²	151	137.8 Å²	137.8	81%	0.807	76%	0.756	S	S	*	*			trans	-133.5	125.9	144	-98.5	-43.9	0	0	0	109.3
543	V	25.9	Very low	29.2	Very low	131 Å²	131	137.6 Å²	137.6	79%	0.794	76%	0.755	S	S	*	*			trans	-86.8	109	174.2	175.5	0	0	0	0	107.8
544	I	30.9	Very low	29.3	Very low	149 Å²	149	135.9 Å²	135.9	76%	0.764	75%	0.752	S	S	*	*			trans	-112.5	105.5	173.3	-59.5	179.6	0	0	0	107.9
545	T	24.8	Very low	29.6	Very low	121 Å²	121	137.1 Å²	137.1	74%	0.742	75%	0.751	S	S	*	*			trans	-105.6	113.1	-179.7	-46.9	0	0	0	0	109.2
546	L	26.7	Very low	29.7	Very low	151 Å²	151	136.2 Å²	136.2	79%	0.791	75%	0.753	S	S	*	*			trans	-171.1	152.2	178.7	-104.7	152.9	0	0	0	109.1
547	P	26.6	Very low	29.8	Very low	90 Å²	90	133.2 Å²	133.2	58%	0.584	75%	0.753	S	S	*	*				-120.5	167.8	-70.9	38	-28.3	0	0	0	113.5	L549	P547-L549 HydrophobicContact CB-CD1 4.26Å; P547-L549 HydrophobicContact CG-CD1 4.03Å
548	P	27.2	Very low	29.8	Very low	130 Å²	130	133.7 Å²	133.7	84%	0.844	75%	0.753	S	S	*	*			trans	-91.1	110.4	179.6	34	-31.9	0	0	0	113.8
549	L	27	Very low	29.9	Very low	132 Å²	132	136 Å²	136	69%	0.691	76%	0.761	S	S	*	*			trans	-144.1	147.6	169.2	-74	94.4	0	0	0	108.1	P547	P547-L549 HydrophobicContact CB-CD1 4.26Å; P547-L549 HydrophobicContact CG-CD1 4.03Å
550	N	31.6	Very low	30.1	Very low	141 Å²	141	136.8 Å²	136.8	75%	0.754	77%	0.765	S	S	*	*			cis	-142.7	148.1	-0.3	-100.4	-26.5	0	0	0	110
551	I	32.2	Very low	30.2	Very low	143 Å²	143	135.4 Å²	135.4	73%	0.733	77%	0.77	S	S	*	*			trans	-118.9	135.7	159.2	-62.9	177.3	0	0	0	106.1	N553	I551-N553 PolarHBondContact O-N 3.2Å
552	P	33.4	Very low	30.4	Very low	128 Å²	128	131.2 Å²	131.2	83%	0.831	76%	0.761	S	S	*	*			trans	-68.8	130.5	-178.8	27.1	-34.2	0	0	0	111.9
553	N	28.4	Very low	30.4	Very low	154 Å²	154	131.7 Å²	131.7	82%	0.824	76%	0.763	S	S	*	*			trans	-96.1	133.1	177.9	-77.4	-22.5	0	0	0	112.1	I551	I551-N553 PolarHBondContact O-N 3.2Å
554	T	31.3	Very low	30.6	Very low	122 Å²	122	134.4 Å²	134.4	75%	0.748	76%	0.76	S	S	*	*			trans	-158.8	124.9	151.3	46.2	0	0	0	0	106.3
555	D	31.3	Very low	30.6	Very low	135 Å²	135	133.8 Å²	133.8	72%	0.722	76%	0.758	S	S	*	*	S	Bend	cis	-152	155.9	-0.9	-93.9	-48.1	0	0	0	111.3
556	T	33.2	Very low	31	Very low	141 Å²	141	133.7 Å²	133.7	87%	0.865	76%	0.758	S	S	*	*			trans	41.1	126.1	156	59.8	0	0	0	0	120.6
557	G	30.3	Very low	31.1	Very low	68 Å²	68	134.8 Å²	134.8	70%	0.701	76%	0.759	S	S	*	*			cis	161.2	-179	-1.6	0	0	0	0	0	112.6
558	I	32.9	Very low	31.4	Very low	159 Å²	159	139.7 Å²	139.7	82%	0.815	77%	0.771	S	S	*	*			trans	71.3	100.5	174.3	-50.5	175.5	0	0	0	113.1
559	I	30.7	Very low	31.6	Very low	141 Å²	141	141 Å²	141	72%	0.723	77%	0.768	S	S	*	*				72.8	130.3	55.6	-54.7	167.3	0	0	0	110.1
560	D	35	Very low	31.6	Very low	154 Å²	154	141.7 Å²	141.7	82%	0.824	77%	0.772	S	S	*	*			cis	-137.2	167.8	24.9	-131.9	-31.8	0	0	0	113.3
561	D	33.1	Very low	31.4	Very low	159 Å²	159	139.9 Å²	139.9	85%	0.85	77%	0.77	S	S	*	*			trans	-136.8	138.4	178.5	-160.8	1.5	0	0	0	110.5
562	G	33.5	Very low	31.2	Very low	56 Å²	56	141.6 Å²	141.6	58%	0.577	77%	0.773	S	S	*	*			trans	-162.3	97.6	-161.4	0	0	0	0	0	118.5
563	L	33.4	Very low	31	Very low	161 Å²	161	142.8 Å²	142.8	84%	0.843	77%	0.767	S	S	*	*			trans	49.2	146.2	138.2	-67.9	126.5	0	0	0	120.8
564	Y	28.8	Very low	31	Very low	188 Å²	188	140.2 Å²	140.2	74%	0.737	76%	0.761	S	S	*	*			cis	177.7	130.3	-20.9	-141	-102.3	0	0	0	105.3
565	N	30.9	Very low	31	Very low	135 Å²	135	142.6 Å²	142.6	72%	0.722	77%	0.77	S	S	*	*			trans	59.3	173.1	172.5	-55.8	-12.7	0	0	0	115.4
566	T	32.7	Very low	30.9	Very low	119 Å²	119	144.9 Å²	144.9	73%	0.73	78%	0.776	S	S	*	*			cis	-144.3	164.7	3.2	-28	0	0	0	0	111
567	E	29.6	Very low	30.8	Very low	174 Å²	174	143.5 Å²	143.5	81%	0.813	77%	0.772	S	S	*	*			trans	-33.2	134.1	170.8	-52.6	165.4	134.5	0	0	117.1
568	K	32	Very low	30.9	Very low	193 Å²	193	145.5 Å²	145.5	84%	0.839	77%	0.771	S	S	*	*				-168.8	132	124.7	-107.6	157.5	-172.2	171	0	115.8
569	M	31.6	Very low	30.6	Very low	159 Å²	159	146.9 Å²	146.9	78%	0.783	77%	0.771	S	S	*	*			trans	28.6	118.5	134.2	-64.5	177.4	168.8	0	0	120.7
570	N	27.9	Very low	30.5	Very low	146 Å²	146	145 Å²	145	78%	0.781	77%	0.77	S	S	*	*				59	144.2	128.3	-62.8	-6.8	0	0	0	122.7
571	S	27.8	Very low	30.2	Very low	102 Å²	102	145.4 Å²	145.4	71%	0.713	77%	0.771	S	S	*	*			trans	70.7	122.6	146.8	52.7	0	0	0	0	120.9
572	F	27.9	Very low	29.9	Very low	179 Å²	179	144.6 Å²	144.6	79%	0.785	77%	0.767	S	S	*	*			trans	71.5	125.3	135.9	-86.6	-103.2	0	0	0	121.9
573	E	28.9	Very low	29.9	Very low	154 Å²	154	150 Å²	150	72%	0.72	78%	0.78	S	S	*	*			trans	44.9	116.5	136.7	-67.4	-175.6	150.9	0	0	121.4
574	S	28.4	Very low	29.9	Very low	99 Å²	99	149.1 Å²	149.1	69%	0.692	77%	0.772	S	S	*	*			trans	24.5	124.7	136.9	59.9	0	0	0	0	119.8
575	N	30.5	Very low	30.2	Very low	173 Å²	173	147.6 Å²	147.6	93%	0.925	77%	0.771	S	S	*	*			trans	-121.4	148.7	149.2	-96.3	-69.1	0	0	0	111.3
576	Q	30.7	Very low	30.2	Very low	182 Å²	182	146.4 Å²	146.4	85%	0.85	77%	0.765	S	S	*	*			trans	-108.1	159	-168.5	-59.1	175.3	1.7	0	0	112.5
577	S	30.9	Very low	30.2	Very low	112 Å²	112	148.2 Å²	148.2	78%	0.783	76%	0.764	S	S	*	*			trans	-160.3	127.4	157.6	58	0	0	0	0	108
578	T	30.8	Very low	30.1	Very low	110 Å²	110	147.5 Å²	147.5	68%	0.675	77%	0.765	S	S	*	*	S	Bend	cis	-153.9	131.8	-4	-42.1	0	0	0	0	105.2
579	F	28.2	Very low	29.9	Very low	189 Å²	189	141 Å²	141	83%	0.829	75%	0.753	S	S	*	*				-171.6	158.2	85.7	-110.8	-87.7	0	0	0	112.5
580	S	27.1	Very low	29.7	Very low	101 Å²	101	141.8 Å²	141.8	71%	0.706	75%	0.754	S	S	*	*			trans	-38	157.8	174.9	-40.9	0	0	0	0	116.4
581	I	30.5	Very low	29.8	Very low	163 Å²	163	141.7 Å²	141.7	84%	0.836	75%	0.749	S	S	*	*			cis	-144.3	144.9	40.7	-66	171.4	0	0	0	112.8
582	N	26.2	Very low	29.7	Very low	142 Å²	142	143 Å²	143	76%	0.759	75%	0.748	S	S	*	*			trans	-74.4	144.5	174.5	-72.9	-17.7	0	0	0	114.4
583	I	34.1	Very low	29.7	Very low	169 Å²	169	140.9 Å²	140.9	87%	0.867	75%	0.745	S	S	*	*			trans	-141.9	140.4	133.6	-60.6	-171.2	0	0	0	108.8
584	H	31.5	Very low	29.5	Very low	143 Å²	143	141.5 Å²	141.5	66%	0.662	75%	0.745	S	S	*	*			trans	-80.1	145.8	175.8	-89.9	-112.3	0	0	0	113.3
585	H	35.9	Very low	29.5	Very low	156 Å²	156	141.4 Å²	141.4	72%	0.722	74%	0.741	S	S	*	*				167.6	123.4	102.8	-94.2	-64.6	0	0	0	113.5
586	D	31.6	Very low	29.5	Very low	110 Å²	110	140.1 Å²	140.1	59%	0.588	73%	0.729	S	S	*	*				45.7	124.7	122.4	-54.6	-13.7	0	0	0	123.4
587	H	31.3	Very low	29.4	Very low	156 Å²	156	136 Å²	136	72%	0.722	71%	0.713	S	S	*	*				74.2	123	127.6	-73.7	-39.8	0	0	0	123.4
588	I	29.1	Very low	29.6	Very low	160 Å²	160	139.1 Å²	139.1	82%	0.821	72%	0.719	S	S	*	*			trans	75.5	142.2	132.1	-61.9	167.5	0	0	0	117.9
589	G	27.2	Very low	29.6	Very low	57 Å²	57	140.1 Å²	140.1	59%	0.588	72%	0.716	S	S	*	*			trans	101.4	111.4	174.6	0	0	0	0	0	111.3
590	Q	27.7	Very low	29.6	Very low	175 Å²	175	136.1 Å²	136.1	82%	0.818	71%	0.712	S	S	*	*				69.5	140.8	65.5	-68.4	-169.4	-13	0	0	114.7
591	H	28.7	Very low	29.8	Very low	143 Å²	143	136.8 Å²	136.8	66%	0.662	71%	0.714	S	S	*	*			trans	66	105	166.8	-66.6	-63.4	0	0	0	119.4
592	N	26.5	Very low	29.6	Very low	131 Å²	131	136 Å²	136	70%	0.701	71%	0.709	S	S	*	*				60.9	141.4	118.4	-57.9	-10.9	0	0	0	121.3
593	N	27.6	Very low	29.8	Very low	133 Å²	133	136.7 Å²	136.7	71%	0.711	71%	0.71	S	S	*	*			trans	88.7	122.3	146.8	-68.5	-11.6	0	0	0	120.9
594	F	25.5	Very low	29.5	Very low	168 Å²	168	137 Å²	137	74%	0.737	71%	0.706	S	S	*	*			trans	65.2	107.8	137.9	-77.6	-103.4	0	0	0	118
595	T	27.9	Very low	29.4	Very low	96 Å²	96	138.5 Å²	138.5	59%	0.589	71%	0.713	S	S	*	*				71.2	148.6	99.5	60.7	0	0	0	0	113.6
596	H	30.1	Very low	28.9	Very low	147 Å²	147	139.6 Å²	139.6	68%	0.681	72%	0.716	S	S	*	*			cis	-141.5	133.5	38.2	-90.5	-79.4	0	0	0	111.9
597	D	29.2	Very low	28.9	Very low	95 Å²	95	140.6 Å²	140.6	51%	0.508	73%	0.728	S	S	.	*				70.6	132.6	99.1	-78.8	-29.3	0	0	0	116.7	Q599	D597-Q599 PolarHBondContact OD1-NE2 3.11Å; D597-Q599 VanDerWaalsContact OD1-NE2 3.16Å; D597-Q599 PolarHBondContact OD2-NE2 3.06Å
598	L	35.9	Very low	28.8	Very low	177 Å²	177	142.5 Å²	142.5	93%	0.927	73%	0.734	S	S	*	*			trans	-150.3	105.5	131.1	-109.4	157.7	0	0	0	109.1
599	Q	29.3	Very low	28.5	Very low	131 Å²	131	145.3 Å²	145.3	61%	0.612	74%	0.735	S	S	*	*			trans	-65	174.8	175.8	-74.3	97.3	-0.5	0	0	112.4	D597	D597-Q599 PolarHBondContact OD1-NE2 3.11Å; D597-Q599 VanDerWaalsContact OD1-NE2 3.16Å; D597-Q599 PolarHBondContact OD2-NE2 3.06Å
600	S	27.9	Very low	28.5	Very low	106 Å²	106	148.9 Å²	148.9	74%	0.741	75%	0.747	S	S	*	*			cis	-168.8	-173.3	9.5	-129.3	0	0	0	0	108.4
601	P	31.8	Very low	28.3	Very low	114 Å²	114	145.6 Å²	145.6	74%	0.74	74%	0.739	S	S	*	*			cis	-127.1	170.9	-5.5	39.6	-23.9	0	0	0	115.3
602	M	27	Very low	28.1	Very low	147 Å²	147	146.1 Å²	146.1	72%	0.724	75%	0.746	S	S	*	*			trans	-81.8	138.6	173.9	-61.1	163.7	56.5	0	0	113	K604	M602-K604 HydrophobicContact CE-CD 4.34Å; M602-K604 HydrophobicContact CE-CG 4.1Å
603	I	30.1	Very low	27.9	Very low	156 Å²	156	143.8 Å²	143.8	80%	0.8	74%	0.739	S	S	*	*			trans	-123.3	126.6	149.1	-63.7	-177.2	0	0	0	108.8	E605	I603-E605 HydrophobicContact CG2-CG 4.49Å; I603-E605 PolarHBondContact O-N 3.27Å
604	K	27.6	Very low	27.7	Very low	176 Å²	176	144.9 Å²	144.9	77%	0.765	74%	0.744	S	S	*	*			trans	-87.5	72.3	-174.8	-73	175.6	175.1	165.3	0	112.3	M602 K606	M602-K604 HydrophobicContact CE-CD 4.34Å; M602-K604 HydrophobicContact CE-CG 4.1Å; K604-K606 PolarHBondContact O-N 3.06Å
605	E	29	Very low	27.6	Very low	174 Å²	174	145.6 Å²	145.6	81%	0.813	75%	0.747	S	S	*	*			trans	-74.3	121.6	167.8	-79.9	-99.3	97	0	0	110.6	I603 P607	I603-E605 HydrophobicContact CG2-CG 4.49Å; I603-E605 PolarHBondContact O-N 3.27Å; E605-P607 WeakPolarHBondContact O-CD 3.46Å
606	K	26.4	Very low	27.3	Very low	180 Å²	180	146.3 Å²	146.3	78%	0.783	76%	0.756	S	S	*	*			trans	-95.4	110.2	175.6	-67.5	171.9	-177.3	167.8	0	109.2	K604 K608	K604-K606 PolarHBondContact O-N 3.06Å; K606-K608 PolarHBondContact O-N 2.62Å
607	P	30.4	Very low	27.1	Very low	130 Å²	130	143.8 Å²	143.8	84%	0.844	76%	0.76	S	S	*	*			trans	-60.5	113.3	161.4	25.8	-31.8	0	0	0	107.7	E605 R609	E605-P607 WeakPolarHBondContact O-CD 3.46Å; P607-R609 PolarHBondContact O-N 3.04Å
608	K	29.5	Very low	27	Very low	196 Å²	196	146.3 Å²	146.3	85%	0.852	77%	0.774	S	S	*	*			trans	-66.2	124	-166.1	-67.5	162.3	-174.7	163.3	0	109.5	K606	K606-K608 PolarHBondContact O-N 2.62Å
609	R	23.7	Very low	26.6	Very low	220 Å²	220	146.4 Å²	146.4	83%	0.83	77%	0.767	S	S	*	*			trans	-48.4	140.7	159.5	-75.3	-179.5	174.2	168.2	-2.4	108	P607 V611	P607-R609 PolarHBondContact O-N 3.04Å; R609-V611 HydrophobicContact CB-CG2 4.33Å; R609-V611 PolarHBondContact O-N 2.83Å
610	P	26.2	Very low	26.5	Very low	131 Å²	131	150.7 Å²	150.7	85%	0.851	78%	0.779	S	S	*	*			trans	-66.3	85.1	160	29.2	-32.4	0	0	0	107.6	L612	P610-L612 PolarHBondContact O-N 3.17Å
611	V	24.3	Very low	26.4	Very low	106 Å²	106	152.4 Å²	152.4	64%	0.642	78%	0.78	S	S	*	*			trans	-63.4	111.5	172.5	179.1	0	0	0	0	105.9	R609 C613	R609-V611 HydrophobicContact CB-CG2 4.33Å; R609-V611 PolarHBondContact O-N 2.83Å; V611-C613 PolarHBondContact O-N 3.48Å
612	L	23.7	Very low	26.1	Very low	154 Å²	154	154.9 Å²	154.9	81%	0.806	78%	0.781	S	S	*	*			trans	-71.5	78.3	176.2	-161.3	86	0	0	0	108.3	P610 L614	P610-L612 PolarHBondContact O-N 3.17Å; L612-L614 PolarHBondContact O-N 2.94Å
613	C	22.2	Very low	26.3	Very low	82 Å²	82	158.2 Å²	158.2	55%	0.554	79%	0.792	S	S	*	*			trans	-63.7	95.8	-178.8	-75.9	0	0	0	0	110	V611 F615	V611-C613 PolarHBondContact O-N 3.48Å; C613-F615 HydrophobicContact CB-CD2 3.69Å; C613-F615 HydrophobicContact CB-CE2 3.7Å; C613-F615 PolarHBondContact O-N 2.82Å
614	L	23.5	Very low	26.2	Very low	156 Å²	156	161.5 Å²	161.5	82%	0.817	79%	0.794	S	S	*	*			trans	-64.9	70.2	167.3	-81.8	155.8	0	0	0	110.1	L612 S616	L612-L614 PolarHBondContact O-N 2.94Å; L614-S616 PolarHBondContact O-N 3.09Å
615	F	23.7	Very low	26.2	Very low	183 Å²	183	157.4 Å²	157.4	80%	0.803	78%	0.778	S	S	*	*			trans	-73.6	81.7	167.4	-81.7	-66.8	0	0	0	109.5	C613 A617	C613-F615 HydrophobicContact CB-CD2 3.69Å; C613-F615 HydrophobicContact CB-CE2 3.7Å; C613-F615 PolarHBondContact O-N 2.82Å; F615-A617 PolarHBondContact O-N 2.97Å
616	S	22.6	Very low	26.4	Very low	112 Å²	112	156.4 Å²	156.4	78%	0.783	78%	0.777	S	S	*	*			trans	-67.9	69.8	166.5	55.6	0	0	0	0	110.4	L614 N618	L614-S616 PolarHBondContact O-N 3.09Å; S616-N618 PolarHBondContact O-N 2.98Å
617	A	25.8	Very low	26.5	Very low	93 Å²	93	152.4 Å²	152.4	77%	0.769	76%	0.76	S	S	*	*			trans	-72.9	74	176.6	0	0	0	0	0	110.8	F615	F615-A617 PolarHBondContact O-N 2.97Å
618	N	25.6	Very low	26.6	Very low	149 Å²	149	157.3 Å²	157.3	80%	0.797	76%	0.761	S	S	*	*			trans	-84.3	145.7	170	-153.1	-5.7	0	0	0	109.1	S616	S616-N618 PolarHBondContact O-N 2.98Å
619	K	27.4	Very low	26.7	Very low	179 Å²	179	153.1 Å²	153.1	78%	0.778	75%	0.748	S	S	*	*			trans	69.3	131.5	-159.8	-44.4	167.9	-175	177.5	0	110.8
620	Y	27.3	Very low	27.1	Very low	220 Å²	220	150.1 Å²	150.1	86%	0.863	75%	0.749	S	S	*	*			cis	-134.2	159.3	41.5	-114.5	-95.7	0	0	0	115.3
621	N	25.8	Very low	27.1	Very low	142 Å²	142	148.9 Å²	148.9	76%	0.759	74%	0.743	S	S	*	*			trans	-77.4	176.9	171.2	-80.6	-44.7	0	0	0	112.3
622	Q	27.3	Very low	27.4	Very low	166 Å²	166	151.2 Å²	151.2	78%	0.776	75%	0.75	S	S	*	*			trans	75.2	99	170.7	-46.5	-174.7	22.9	0	0	117
623	K	29.4	Very low	27.7	Very low	218 Å²	218	148.5 Å²	148.5	95%	0.948	74%	0.74	S	S	*	*				-138.9	129.5	124.7	-117.1	162.8	-172	171.8	0	110.1
624	R	29.4	Very low	28.1	Very low	225 Å²	225	151.7 Å²	151.7	85%	0.849	75%	0.751	S	S	*	*			trans	-71.9	151.2	-161.6	-67.9	173.9	175.6	162.1	-3.2	112.1	L626	R624-L626 PolarHBondContact O-N 2.84Å
625	H	27.8	Very low	28.6	Very low	90 Å²	90	150.8 Å²	150.8	42%	0.417	75%	0.747	S	S	.	*			trans	-59.3	120.9	159	-90.1	-85.7	0	0	0	110.3	I333 N334	I333-H625 HydrophobicContact CD1-CB 3.81Å; I333-H625 HydrophobicContact CG1-CB 4.24Å; N334-H625 WeakPolarHBondContact CB-NE2 3.37Å
626	L	31.6	Very low	29	Very low	152 Å²	152	148.3 Å²	148.3	80%	0.796	74%	0.741	S	S	*	*			trans	-118.4	101.5	157.3	-137	80.7	0	0	0	108.8	R624	R624-L626 PolarHBondContact O-N 2.84Å
627	K	30.1	Very low	29.6	Very low	96 Å²	96	149.7 Å²	149.7	42%	0.417	74%	0.74	S	S	.	*	P	Polyproline II helix	trans	-75.6	120.6	164.5	-71.5	177.1	-179.8	176.8	0	107.5	K331	K331-K627 PolarHBondContact O-NZ 2.84Å
628	R	31.1	Very low	29.9	Very low	233 Å²	233	152.5 Å²	152.5	88%	0.879	74%	0.737	S	S	*	*	P	Polyproline II helix	trans	-89.7	120.3	146.2	-80.6	-177.5	165.8	141	-2.7	106.6
629	N	32.3	Very low	30.3	Very low	109 Å²	109	151.8 Å²	151.8	58%	0.583	73%	0.733	S	S	*	*	P	Polyproline II helix	trans	-73.1	160.6	167.7	-79.7	-54.8	0	0	0	108.8	K331	K331-N629 PolarHBondContact NZ-OD1 3.11Å
630	N	31.6	Very low	30.6	Very low	156 Å²	156	149.3 Å²	149.3	83%	0.834	73%	0.728	S	S	*	*	P	Polyproline II helix	trans	-70.1	160.3	170.6	-64.7	-1	0	0	0	111.3
631	S	27.6	Very low	31	Very low	106 Å²	106	146 Å²	146	74%	0.741	73%	0.726	S	S	*	*	P	Polyproline II helix	trans	-65.8	152.8	165.3	44.3	0	0	0	0	113.5
632	I	30	Very low	31.3	Very low	154 Å²	154	146 Å²	146	79%	0.79	73%	0.726	S	S	*	*			trans	-157.9	97.8	146.3	-95.6	151.7	0	0	0	101.7
633	T	29.8	Very low	31.8	Very low	97 Å²	97	145.9 Å²	145.9	60%	0.595	73%	0.729	S	S	*	*				53.6	89	92.8	61.5	0	0	0	0	112.3
634	I	31.4	Very low	32	Very low	150 Å²	150	141.8 Å²	141.8	77%	0.769	72%	0.717	S	S	*	*			trans	-84	110.6	144.3	-61.5	169.9	0	0	0	103.9
635	D	33.6	Very low	32.4	Very low	137 Å²	137	138.7 Å²	138.7	73%	0.733	72%	0.717	S	S	*	*			trans	-99.4	105	162.3	-71.9	-28.6	0	0	0	105.3
636	D	32.1	Very low	32.8	Very low	130 Å²	130	140.6 Å²	140.6	70%	0.695	73%	0.731	S	S	*	*			trans	-65.6	143	163.8	-59.7	-61.7	0	0	0	109.1
637	N	34.5	Very low	32.9	Very low	142 Å²	142	138.8 Å²	138.8	76%	0.759	72%	0.722	S	S	*	*			trans	168.6	123.8	148.2	-90.6	-37.2	0	0	0	110.6
638	H	32.8	Very low	33	Very low	152 Å²	152	140.3 Å²	140.3	70%	0.704	74%	0.735	S	S	*	*			trans	64.8	146.3	142.8	-74.6	-80.9	0	0	0	118.8
639	D	33.8	Very low	33.1	Very low	134 Å²	134	135 Å²	135	72%	0.717	72%	0.724	S	S	*	*			cis	-133.6	165.9	8.2	-87.9	-53.8	0	0	0	112.9
640	D	33.3	Very low	33.3	Very low	126 Å²	126	135.2 Å²	135.2	67%	0.674	73%	0.725	S	S	*	*			trans	-44	153.2	169.9	-46.6	-50.9	0	0	0	115.1
641	N	35.4	Very low	33.3	Very low	152 Å²	152	135.2 Å²	135.2	81%	0.813	73%	0.725	S	S	*	*				-175.2	118	118	-100.1	-80.7	0	0	0	111.2
642	D	33.6	Very low	33.7	Very low	140 Å²	140	133.6 Å²	133.6	75%	0.749	73%	0.725	S	S	*	*			trans	-0.7	135.5	149.8	-56.3	-24.2	0	0	0	119.8
643	I	37.5	Very low	33.7	Very low	165 Å²	165	132.8 Å²	132.8	85%	0.846	72%	0.722	S	S	*	*				-167.6	148.3	96.2	-94.3	160.8	0	0	0	109.6
644	N	33.4	Very low	34.1	Very low	132 Å²	132	135.3 Å²	135.3	71%	0.706	73%	0.731	S	S	*	*			trans	-75.5	161	178.9	-53.2	-54.9	0	0	0	112.2
645	D	36.6	Very low	34.4	Very low	159 Å²	159	135.1 Å²	135.1	85%	0.85	73%	0.726	S	S	*	*				-168.4	91.8	109	-94.4	-10.6	0	0	0	111.7
646	D	36.1	Very low	34.5	Very low	130 Å²	130	134.2 Å²	134.2	70%	0.695	72%	0.721	S	S	*	*				31.1	134.7	125.4	-102.9	18.8	0	0	0	122.4
647	N	34	Very low	34.8	Very low	114 Å²	114	134 Å²	134	61%	0.61	73%	0.725	S	S	*	*			trans	83.2	131.9	135.5	-78.9	-43.9	0	0	0	122.5
648	N	33	Very low	34.7	Very low	128 Å²	128	134.8 Å²	134.8	68%	0.684	72%	0.721	S	S	*	*			trans	68.9	134.6	142.4	-63.8	-26.7	0	0	0	118
649	N	33.5	Very low	34.6	Very low	122 Å²	122	135.2 Å²	135.2	65%	0.652	72%	0.724	S	S	*	*			cis	-164.1	163	24.9	-131.1	-22.4	0	0	0	114.5
650	N	36.1	Very low	34.5	Very low	114 Å²	114	135.4 Å²	135.4	61%	0.61	73%	0.725	S	S	*	*			trans	60.5	105.1	146.8	-68.6	-37.1	0	0	0	123.1
651	N	30.3	Very low	34.3	Very low	155 Å²	155	137 Å²	137	83%	0.829	73%	0.73	S	S	*	*				56.4	124.7	105.9	-64.6	-34	0	0	0	122.1
652	G	36.5	Very low	34	Very low	73 Å²	73	136 Å²	136	75%	0.753	73%	0.725	S	S	*	*			trans	154.5	72.6	169.6	0	0	0	0	0	110.2
653	N	31.3	Very low	33.7	Very low	136 Å²	136	134.2 Å²	134.2	73%	0.727	72%	0.718	S	S	*	*			cis	71.4	157.8	48.6	-157.9	17.2	0	0	0	113.5
654	I	38	Very low	33.3	Very low	151 Å²	151	136 Å²	136	77%	0.774	72%	0.715	S	S	*	*			trans	88.1	97	-163.3	-55.2	167.9	0	0	0	110.1
655	H	36.5	Very low	33	Very low	146 Å²	146	140.2 Å²	140.2	68%	0.676	72%	0.721	S	S	*	*				68.1	138.9	77.7	-78.5	-97.4	0	0	0	113.4
656	D	36	Very low	32.5	Very low	117 Å²	117	138.7 Å²	138.7	63%	0.626	71%	0.712	S	S	*	*			cis	-137.3	-154.8	-5.3	-134.7	-59.5	0	0	0	106.9
657	V	37.7	Very low	32.1	Very low	127 Å²	127	141.7 Å²	141.7	77%	0.77	71%	0.714	S	S	*	*			cis	-138.6	157.2	15.6	-166.9	0	0	0	0	110.2
658	K	32.6	Very low	32	Very low	157 Å²	157	144.3 Å²	144.3	68%	0.683	72%	0.722	S	S	*	*			trans	-43.4	163	156.9	-55.2	149.2	-175.7	169.2	0	112.9
659	Q	32.3	Very low	31.9	Very low	161 Å²	161	141.6 Å²	141.6	75%	0.752	72%	0.724	S	S	*	*			cis	-155.3	178	20.6	-123	134.9	-32.7	0	0	106.8
660	D	31.7	Very low	31.9	Very low	139 Å²	139	141.6 Å²	141.6	74%	0.743	73%	0.729	S	S	*	*			cis	-155.7	177.3	18.5	-143.1	-23.5	0	0	0	111.1
661	M	29	Very low	31.7	Very low	158 Å²	158	142.1 Å²	142.1	78%	0.778	73%	0.732	S	S	*	*			trans	-108.5	175.9	173.7	-66.8	-151	-53.6	0	0	113.9
662	D	27.9	Very low	31.7	Very low	133 Å²	133	141.5 Å²	141.5	71%	0.711	73%	0.727	S	S	*	*			trans	74.4	114.8	154.8	-84.5	-15.6	0	0	0	122.4
663	V	28	Very low	31.2	Very low	101 Å²	101	142.2 Å²	142.2	61%	0.612	72%	0.72	S	S	*	*				56.5	109.8	118.9	179.6	0	0	0	0	119.3
664	R	28.3	Very low	31	Very low	204 Å²	204	141.5 Å²	141.5	77%	0.77	72%	0.721	S	S	*	*			trans	114.1	123.4	155.4	-76.3	161.1	-71.2	-151.8	-7.2	116.3
665	R	26.8	Very low	30.5	Very low	219 Å²	219	139.8 Å²	139.8	83%	0.826	72%	0.718	S	S	*	*			trans	84.4	136.8	130.7	-81.2	176.3	170.2	171.8	-3.5	120.7
666	L	27.1	Very low	30.1	Very low	128 Å²	128	142 Å²	142	67%	0.67	73%	0.725	S	S	*	*			trans	78.8	109.6	145.7	-93.2	68.3	0	0	0	120
667	R	28.5	Very low	29.5	Very low	193 Å²	193	144.8 Å²	144.8	73%	0.728	74%	0.74	S	S	*	*				88	125.1	126.9	-77.3	173.8	-177.7	-144.3	2	120.9
668	Q	31.8	Very low	28.9	Very low	168 Å²	168	143.2 Å²	143.2	79%	0.785	73%	0.734	S	S	*	*			trans	64.9	119.3	134.1	-63.5	164.6	-45.8	0	0	116.6
669	G	30.8	Very low	28.6	Very low	71 Å²	71	142 Å²	142	73%	0.732	74%	0.739	S	S	*	*			cis	170.9	-179.8	2.5	0	0	0	0	0	108.7
670	T	33.1	Very low	28.2	Very low	122 Å²	122	141.2 Å²	141.2	75%	0.748	74%	0.741	S	S	*	*			cis	-163.3	145	-8.4	31.5	0	0	0	0	104.8
671	N	31.9	Very low	28	Very low	125 Å²	125	141.6 Å²	141.6	67%	0.668	74%	0.743	S	S	*	*			cis	-148.3	138	5.9	-104.8	-11.8	0	0	0	110.9
672	I	29.5	Very low	27.8	Very low	143 Å²	143	140.8 Å²	140.8	73%	0.733	74%	0.737	S	S	*	*				49.6	127.4	119.6	-57.9	174.5	0	0	0	117.5
673	S	26.9	Very low	27.6	Very low	87 Å²	87	141 Å²	141	61%	0.608	74%	0.737	S	S	*	*			cis	-161.7	134.8	-7.9	43.3	0	0	0	0	108.7
674	T	26.9	Very low	27.6	Very low	122 Å²	122	143.4 Å²	143.4	75%	0.748	75%	0.746	S	S	*	*				53.2	140.4	83.9	90.5	0	0	0	0	114.3
675	T	26.6	Very low	27.4	Very low	115 Å²	115	142.4 Å²	142.4	71%	0.706	74%	0.742	S	S	*	*			cis	-163.6	166.4	-2.2	3.5	0	0	0	0	112.3
676	K	28.8	Very low	27.3	Very low	192 Å²	192	140.5 Å²	140.5	84%	0.835	75%	0.746	S	S	*	*			trans	-20.3	143.5	142.8	-46.8	166.1	-177	178.3	0	114.6
677	L	24	Very low	27.2	Very low	176 Å²	176	139.3 Å²	139.3	92%	0.921	75%	0.745	S	S	*	*				-165.8	-179.3	124.7	-108.3	164.4	0	0	0	112.2
678	S	24.2	Very low	27	Very low	93 Å²	93	133.5 Å²	133.5	65%	0.65	74%	0.744	S	S	*	*			trans	-96.5	158.2	-155	51	0	0	0	0	116.3
679	V	27.7	Very low	26.8	Very low	132 Å²	132	130.8 Å²	130.8	80%	0.8	74%	0.744	S	S	*	*			trans	16.7	113.9	147.6	-174	0	0	0	0	116.7
680	N	23.9	Very low	26.7	Very low	145 Å²	145	132.1 Å²	132.1	78%	0.775	74%	0.742	S	S	*	*			trans	-148.6	131.3	151.4	-121.5	-18.4	0	0	0	111	Q682	N680-Q682 PolarHBondContact O-N 3.5Å
681	N	26.1	Very low	26.5	Very low	147 Å²	147	132.9 Å²	132.9	79%	0.786	74%	0.742	S	S	*	*			trans	-84.6	99.7	176.1	-88.9	-24.6	0	0	0	110.6
682	Q	24.6	Very low	26.3	Very low	141 Å²	141	133.8 Å²	133.8	66%	0.659	75%	0.746	S	S	*	*			trans	-151.8	121.4	157.3	-93.9	119.6	65.9	0	0	107.1	N680	N680-Q682 PolarHBondContact O-N 3.5Å
683	I	24.2	Very low	26.2	Very low	138 Å²	138	134 Å²	134	71%	0.708	75%	0.747	S	S	*	*				54.8	48.2	65.5	-42.5	170.6	0	0	0	111.7	R685	I683-R685 HydrophobicContact CG2-CG 4.17Å; I683-R685 PolarHBondContact O-N 3.25Å
684	N	27.9	Very low	26.3	Very low	150 Å²	150	136.2 Å²	136.2	80%	0.802	75%	0.753	S	S	*	*			trans	-80	66.4	168.6	-74.6	5.6	0	0	0	111.2	I686	N684-I686 PolarHBondContact O-N 2.88Å
685	R	24.5	Very low	26.4	Very low	184 Å²	184	136 Å²	136	69%	0.694	75%	0.747	S	S	*	*			trans	-52.6	125.8	153	-79.3	177.6	176.5	165.7	-2.6	108.3	I683 T687	I683-R685 HydrophobicContact CG2-CG 4.17Å; I683-R685 PolarHBondContact O-N 3.25Å; R685-T687 WeakPolarHBondContact CB-O 3.47Å; R685-T687 WeakPolarHBondContact CD-O 3.12Å; R685-T687 PolarHBondContact O-N 3.48Å
686	I	24.5	Very low	26.5	Very low	178 Å²	178	136.8 Å²	136.8	91%	0.913	75%	0.747	S	S	*	*	S	Bend	trans	-80.4	67.8	152.4	-55.2	-178.3	0	0	0	106.2	N684	N684-I686 PolarHBondContact O-N 2.88Å
687	T	24.8	Very low	26.6	Very low	104 Å²	104	133.6 Å²	133.6	64%	0.638	74%	0.739	S	S	*	*			trans	-170	93.4	-174.9	-4.9	0	0	0	0	107.9	R685	R685-T687 WeakPolarHBondContact CB-O 3.47Å; R685-T687 WeakPolarHBondContact CD-O 3.12Å; R685-T687 PolarHBondContact O-N 3.48Å
688	G	25.1	Very low	26.9	Very low	70 Å²	70	131.4 Å²	131.4	72%	0.722	73%	0.728	S	S	*	*			trans	131.8	72.8	-155.7	0	0	0	0	0	108
689	S	26.7	Very low	27.4	Very low	111 Å²	111	133.2 Å²	133.2	78%	0.776	73%	0.731	S	S	*	*				70.5	137.3	55.1	-162.2	0	0	0	0	112.6
690	S	28.2	Very low	27.2	Very low	99 Å²	99	133.9 Å²	133.9	69%	0.692	73%	0.728	S	S	*	*			trans	64.8	137.8	-175.9	70.5	0	0	0	0	116.8
691	N	29	Very low	27.3	Very low	138 Å²	138	132 Å²	132	74%	0.738	73%	0.726	S	S	*	*			cis	-160.7	137.3	-12.7	-101.7	-15.8	0	0	0	108.7
692	N	27.9	Very low	27.3	Very low	144 Å²	144	130.9 Å²	130.9	77%	0.77	72%	0.719	S	S	*	*			trans	62.3	150.6	160.1	-53.1	-18.3	0	0	0	116.3
693	I	28.7	Very low	27.5	Very low	147 Å²	147	131.4 Å²	131.4	75%	0.754	72%	0.721	S	S	*	*			cis	-160.6	144	-10.3	-118.9	169.1	0	0	0	105.4
694	N	28.8	Very low	27.6	Very low	135 Å²	135	133.3 Å²	133.3	72%	0.722	73%	0.733	S	S	*	*			cis	-156.2	-176.9	-7.4	-153.9	1.8	0	0	0	110.6
695	N	28.7	Very low	27.5	Very low	118 Å²	118	131.7 Å²	131.7	63%	0.631	72%	0.724	S	S	*	*			trans	73.9	89.5	157.6	-68.4	9.3	0	0	0	120.3
696	N	29.2	Very low	27.5	Very low	131 Å²	131	131 Å²	131	70%	0.701	73%	0.728	S	S	*	*				98	108.7	114.5	-71.6	14.5	0	0	0	121.1
697	N	30.6	Very low	27.5	Very low	125 Å²	125	128.5 Å²	128.5	67%	0.668	72%	0.716	S	S	*	*			trans	83.9	98.3	140.1	-59	34.2	0	0	0	115.8
698	D	30.8	Very low	27.5	Very low	130 Å²	130	130.6 Å²	130.6	70%	0.695	72%	0.723	S	S	*	*				88.8	129.3	67.8	-78.6	13.2	0	0	0	110.2
699	N	32.7	Very low	27.5	Very low	131 Å²	131	133.9 Å²	133.9	70%	0.701	72%	0.723	S	S	*	*			cis	-149.3	145.4	-7.8	-86.4	-48.6	0	0	0	105.1
700	I	25.6	Very low	27.4	Very low	145 Å²	145	133.7 Å²	133.7	74%	0.744	72%	0.722	S	S	*	*			cis	60.9	85.4	32.1	-49.9	-175.1	0	0	0	114.4
701	C	25	Very low	27.3	Very low	107 Å²	107	133.8 Å²	133.8	72%	0.723	72%	0.722	S	S	*	*			trans	-167.1	130.5	132.1	-94.3	0	0	0	0	108.1
702	N	25.5	Very low	27.2	Very low	122 Å²	122	132.6 Å²	132.6	65%	0.652	72%	0.72	S	S	*	*				57.4	113.7	72.3	-59.4	-33.6	0	0	0	110.6
703	H	29.5	Very low	27.1	Very low	152 Å²	152	132.9 Å²	132.9	70%	0.704	72%	0.721	S	S	*	*				-156.2	121.4	57.6	-87.5	-88.4	0	0	0	113.4	L705	H703-L705 VanDerWaalsContact C-N 3.28Å; H703-L705 HydrophobicContact CB-CD1 4.13Å; H703-L705 PolarHBondContact O-N 3.39Å; H703-L705 VanDerWaalsContact O-N 3.13Å
704	N	25.5	Very low	27	Very low	178 Å²	178	134.3 Å²	134.3	95%	0.952	73%	0.725	S	S	*	*			trans	-82.1	74.4	159.8	-81.2	-33.1	0	0	0	110
705	L	25.5	Very low	26.8	Very low	116 Å²	116	132.2 Å²	132.2	61%	0.607	72%	0.72	S	S	*	*			trans	-94.2	138	151.7	-87	75.9	0	0	0	106.3	H703 L707	H703-L705 VanDerWaalsContact C-N 3.28Å; H703-L705 HydrophobicContact CB-CD1 4.13Å; H703-L705 PolarHBondContact O-N 3.39Å; H703-L705 VanDerWaalsContact O-N 3.13Å; L705-L707 HydrophobicContact CD2-CD1 4.43Å
706	H	24.9	Very low	26.8	Very low	169 Å²	169	132.5 Å²	132.5	78%	0.782	72%	0.716	S	S	*	*				65.5	142.8	55.1	-153.2	-81.5	0	0	0	111.8
707	L	25.4	Very low	26.8	Very low	126 Å²	126	130.9 Å²	130.9	66%	0.66	71%	0.714	S	S	*	*			trans	75.1	116.7	-168.7	-64.7	97.7	0	0	0	116.4	L705	L705-L707 HydrophobicContact CD2-CD1 4.43Å
708	L	24.2	Very low	26.5	Very low	149 Å²	149	130.5 Å²	130.5	78%	0.78	72%	0.72	S	S	*	*			trans	63.3	150.7	149.5	-77.7	88.4	0	0	0	119.4
709	L	24.4	Very low	26.3	Very low	138 Å²	138	130.3 Å²	130.3	72%	0.723	72%	0.724	S	S	*	*			cis	-165.7	151.5	-29.7	-157.4	75.1	0	0	0	106.8
710	S	24.9	Very low	26.1	Very low	108 Å²	108	131.6 Å²	131.6	76%	0.755	73%	0.73	S	S	*	*			trans	67.6	158.9	170.1	-50.7	0	0	0	0	115.2
711	S	26.9	Very low	26.2	Very low	100 Å²	100	132.4 Å²	132.4	70%	0.699	74%	0.736	S	S	*	*			cis	-155.1	125.5	-15.5	36.6	0	0	0	0	111.3
712	T	26.8	Very low	26.4	Very low	114 Å²	114	136.8 Å²	136.8	70%	0.699	75%	0.746	S	S	*	*			trans	28.4	136.2	143.2	57.5	0	0	0	0	122.6
713	N	26.1	Very low	26.7	Very low	149 Å²	149	135.3 Å²	135.3	80%	0.797	75%	0.75	S	S	*	*			trans	80.2	130.2	163.2	-46.2	-31.7	0	0	0	113.9
714	E	26.3	Very low	26.6	Very low	177 Å²	177	137.2 Å²	137.2	83%	0.827	75%	0.752	S	S	*	*			cis	-142.7	168	25.5	-73.1	-168.9	151	0	0	115.6
715	C	25.2	Very low	26.8	Very low	92 Å²	92	138 Å²	138	62%	0.622	75%	0.75	S	S	*	*			trans	40.1	98.4	144.5	-65.3	0	0	0	0	121.1
716	K	28.6	Very low	27	Very low	123 Å²	123	140.4 Å²	140.4	54%	0.535	76%	0.763	S	S	.	*			trans	-144.1	172.3	141	-144.2	153.3	-69	-174.9	0	112.6	N1048 D1049	K716-N1048 WeakPolarHBondContact CD-OD1 3.46Å; K716-N1048 WeakPolarHBondContact CE-OD1 3.46Å; K716-D1049 WeakPolarHBondContact CE-OD1 3.26Å; K716-D1049 IonicContact NZ-OD1 2.99Å; K716-D1049 PolarHBondContact NZ-OD1 3.11Å; K716-D1049 IonicContact NZ-OD2 2.67Å; K716-D1049 PolarHBondContact NZ-OD2 3.19Å
717	S	28	Very low	27.1	Very low	97 Å²	97	135.3 Å²	135.3	68%	0.678	75%	0.746	S	S	*	*			trans	-87.7	172.4	-149.9	59.4	0	0	0	0	116.6
718	C	24	Very low	27.4	Very low	117 Å²	117	137.3 Å²	137.3	79%	0.791	75%	0.752	S	S	*	*			trans	-63.5	170.5	-176.5	-55.5	0	0	0	0	115.3
719	V	27.5	Very low	27.7	Very low	127 Å²	127	137.9 Å²	137.9	77%	0.77	76%	0.756	S	S	*	*			trans	89.4	87.4	164.4	-166.8	0	0	0	0	115.9
720	N	28.9	Very low	27.9	Very low	157 Å²	157	141.6 Å²	141.6	84%	0.84	76%	0.761	S	S	*	*				-153.6	104	120	-123	-12.8	0	0	0	111.4
721	L	27.2	Very low	28.2	Very low	163 Å²	163	147.6 Å²	147.6	85%	0.853	77%	0.768	S	S	*	*			trans	-95.1	98.8	171.9	-94.2	72.9	0	0	0	109
722	Q	29.2	Very low	28.4	Very low	199 Å²	199	153.8 Å²	153.8	93%	0.93	78%	0.776	S	S	*	*	S	Bend	trans	-168.7	-5.1	155.6	-119.4	168.3	-21.6	0	0	117.2
723	A	30.6	Very low	28.5	Very low	90 Å²	90	155.8 Å²	155.8	74%	0.744	78%	0.783	S	S	*	*	S	Bend	trans	-132.7	35.6	-163	0	0	0	0	0	116.2
724	Y	28.6	Very low	28.7	Very low	193 Å²	193	154.2 Å²	154.2	76%	0.757	78%	0.781	S	S	*	*	S	Bend	trans	-140.2	20.8	177.8	-134.2	-92.4	0	0	0	115.5
725	E	29.6	Very low	28.8	Very low	194 Å²	194	151 Å²	151	91%	0.907	78%	0.778	S	S	*	*	S	Bend	trans	-104.7	14.8	169.3	-70.9	-178.1	133.8	0	0	112.1
726	L	29	Very low	29.1	Very low	166 Å²	166	152.1 Å²	152.1	87%	0.869	79%	0.786	S	S	*	*	S	Bend	trans	-139.4	31.9	-170.7	-81.3	171.2	0	0	0	114.2
727	S	28.5	Very low	29.1	Very low	63 Å²	63	149.4 Å²	149.4	44%	0.441	79%	0.793	S	S	.	*	S	Bend	trans	-150.6	32.7	-171.8	54.1	0	0	0	0	117.6
728	Q	30.7	Very low	29.2	Very low	167 Å²	167	150 Å²	150	78%	0.78	80%	0.798	S	S	*	*			trans	-150.8	15.4	155.9	-129.2	144.5	106.2	0	0	119	R730	Q728-R730 PolarHBondContact O-N 3.35Å
729	D	29.7	Very low	29.4	Very low	161 Å²	161	150.2 Å²	150.2	86%	0.861	80%	0.795	S	S	*	*			trans	-69.7	62	163.9	-72	-56.3	0	0	0	112.1
730	R	28.9	Very low	29.3	Very low	217 Å²	217	150.8 Å²	150.8	82%	0.819	80%	0.799	S	S	*	*			trans	-141.8	37.2	-175.7	-69.3	-162.1	-179.2	-162	2.3	116.3	Q728	Q728-R730 PolarHBondContact O-N 3.35Å
731	Y	31.4	Very low	29.4	Very low	233 Å²	233	148.9 Å²	148.9	91%	0.914	80%	0.798	S	S	*	*			trans	-143.6	78.3	155.7	-85.6	-77.1	0	0	0	107.7
732	R	31.2	Very low	29.3	Very low	231 Å²	231	149.4 Å²	149.4	87%	0.872	80%	0.796	S	S	*	*				50.3	87.8	76.4	-74.7	-167.6	167.6	-160.2	-3.8	114
733	N	28.7	Very low	29.2	Very low	155 Å²	155	147.4 Å²	147.4	83%	0.829	79%	0.79	S	S	*	*				35.3	144.3	111.1	-79.2	21.7	0	0	0	118.8
734	P	31.3	Very low	29.1	Very low	117 Å²	117	148.7 Å²	148.7	76%	0.76	79%	0.791	S	S	*	*				-149.9	173.4	50.1	43.3	-25.3	0	0	0	119.2
735	S	27.6	Very low	29	Very low	110 Å²	110	150.5 Å²	150.5	77%	0.769	80%	0.796	S	S	*	*			trans	66.7	146.2	153.8	-133.7	0	0	0	0	117.4
736	S	32.6	Very low	29.1	Very low	114 Å²	114	146.7 Å²	146.7	80%	0.797	79%	0.791	S	S	*	*			cis	-159.6	162.5	-10.9	13.5	0	0	0	0	105.6
737	G	28.1	Very low	29.1	Very low	66 Å²	66	145.3 Å²	145.3	68%	0.68	79%	0.785	S	S	*	*			cis	158	170.2	11.6	0	0	0	0	0	107.3
738	S	30.6	Very low	29.2	Very low	110 Å²	110	150.4 Å²	150.4	77%	0.769	81%	0.806	S	S	*	*			trans	65.9	108.8	-171.9	-162.4	0	0	0	0	114.1
739	T	27	Very low	29.2	Very low	121 Å²	121	147.4 Å²	147.4	74%	0.742	80%	0.801	S	S	*	*			cis	86.6	115.7	43.3	70.1	0	0	0	0	116.1
740	V	26.3	Very low	29.2	Very low	140 Å²	140	146.9 Å²	146.9	85%	0.848	80%	0.798	S	S	*	*			trans	64.3	101.8	145.3	-176.7	0	0	0	0	118.2
741	S	30.6	Very low	29.4	Very low	117 Å²	117	142 Å²	142	82%	0.818	79%	0.792	S	S	*	*				-149.6	146.8	113.2	39.9	0	0	0	0	110.2
742	Q	25.5	Very low	29.2	Very low	173 Å²	173	140.2 Å²	140.2	81%	0.808	79%	0.785	S	S	*	*			trans	-124.5	174.1	171.5	-70.5	-172.8	-12.7	0	0	108.2
743	I	26.3	Very low	29.3	Very low	157 Å²	157	136.7 Å²	136.7	81%	0.805	78%	0.783	S	S	*	*			trans	79.5	143.3	167.6	-52.2	157.5	0	0	0	112.9
744	P	28.6	Very low	29.4	Very low	117 Å²	117	135.5 Å²	135.5	76%	0.76	78%	0.777	S	S	*	*			cis	-109.6	-178.6	-3.3	17.9	4.6	0	0	0	114.1
745	R	26.5	Very low	29.5	Very low	231 Å²	231	135.4 Å²	135.4	87%	0.872	78%	0.776	S	S	*	*			trans	-80.2	156.7	163.5	-70.1	176.5	166.5	93.9	-5.2	110.4
746	S	32	Very low	29.7	Very low	115 Å²	115	135.7 Å²	135.7	80%	0.804	78%	0.775	S	S	*	*			trans	-137.1	141.6	157.1	-52	0	0	0	0	108.2
747	D	28.3	Very low	29.5	Very low	136 Å²	136	134.5 Å²	134.5	73%	0.727	77%	0.767	S	S	*	*			trans	-87.2	161.7	-164.8	-51.6	-87.3	0	0	0	113.8
748	L	32.4	Very low	29.6	Very low	170 Å²	170	139.9 Å²	139.9	89%	0.89	78%	0.777	S	S	*	*			trans	-173.3	161.7	130.8	-113.7	75.3	0	0	0	108.9
749	P	29.8	Very low	29.6	Very low	104 Å²	104	139.3 Å²	139.3	68%	0.675	77%	0.773	S	S	*	*			trans	-100.8	164.3	-137.1	37.4	-41.7	0	0	0	118.7	V751	P749-V751 PolarHBondContact O-N 2.83Å
750	D	29.4	Very low	29.8	Very low	150 Å²	150	139 Å²	139	80%	0.802	77%	0.771	S	S	*	*			trans	-60	118.7	164.1	-82.4	-48.4	0	0	0	112.6
751	V	33.7	Very low	29.9	Very low	114 Å²	114	139.1 Å²	139.1	69%	0.691	77%	0.766	S	S	*	*			trans	-101.7	90.1	170.7	-175.3	0	0	0	0	110.5	P749 L753	P749-V751 PolarHBondContact O-N 2.83Å; V751-L753 HydrophobicContact CG1-CD2 4.26Å; V751-L753 HydrophobicContact CG1-CG 4.21Å; V751-L753 PolarHBondContact O-N 3.08Å
752	Y	26.6	Very low	30	Very low	197 Å²	197	142 Å²	142	77%	0.773	77%	0.766	S	S	*	*			trans	-68.4	88.1	172.7	-105	-98.2	0	0	0	111.8	N754	Y752-N754 PolarHBondContact O-N 3.19Å
753	L	33.6	Very low	30.2	Very low	156 Å²	156	138.3 Å²	138.3	82%	0.817	76%	0.759	S	S	*	*			trans	-76.5	88.7	168	-69.7	-178.9	0	0	0	110.8	V751	V751-L753 HydrophobicContact CG1-CD2 4.26Å; V751-L753 HydrophobicContact CG1-CG 4.21Å; V751-L753 PolarHBondContact O-N 3.08Å
754	N	29.8	Very low	30.4	Very low	131 Å²	131	139.4 Å²	139.4	70%	0.701	76%	0.761	S	S	*	*	P	Polyproline II helix	trans	-56.7	129.2	167.3	-76	-59.3	0	0	0	110.1	Y752	Y752-N754 PolarHBondContact O-N 3.19Å
755	P	34.5	Very low	30.3	Very low	115 Å²	115	145.3 Å²	145.3	75%	0.747	77%	0.768	S	S	*	*	P	Polyproline II helix	trans	-66	129.2	175.1	27.1	-33.2	0	0	0	109.6
756	P	30.9	Very low	30.3	Very low	116 Å²	116	139.1 Å²	139.1	75%	0.753	76%	0.761	S	S	*	*	P	Polyproline II helix	trans	-64.3	140.3	-178.6	25.7	-33.8	0	0	0	111	M758	P756-M758 PolarHBondContact O-N 3.33Å
757	S	28.2	Very low	30	Very low	89 Å²	89	139 Å²	139	62%	0.622	76%	0.76	S	S	*	*	P	Polyproline II helix	trans	-61.8	135.2	176	37.8	0	0	0	0	111	S759	S757-S759 PolarHBondContact O-N 2.72Å
758	M	32	Very low	30.1	Very low	179 Å²	179	139.7 Å²	139.7	88%	0.882	76%	0.763	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.6	24.4	-171	-78.8	-79	-68.7	0	0	115.3	P756	P756-M758 PolarHBondContact O-N 3.33Å
759	S	30	Very low	30	Very low	98 Å²	98	137.3 Å²	137.3	69%	0.685	76%	0.759	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.5	-1.1	-169.4	46	0	0	0	0	115.5	S757	S757-S759 PolarHBondContact O-N 2.72Å
760	T	30.4	Very low	29.9	Very low	115 Å²	115	136 Å²	136	71%	0.706	76%	0.764	S	S	*	*	S	Bend	trans	-119.8	-14.6	-173.8	50.4	0	0	0	0	115.8	Q762	T760-Q762 VanDerWaalsContact C-N 3.26Å; T760-Q762 PolarHBondContact O-N 2.71Å; T760-Q762 VanDerWaalsContact O-N 3.1Å
761	L	29.7	Very low	29.8	Very low	142 Å²	142	139.9 Å²	139.9	74%	0.743	77%	0.768	S	S	*	*			trans	-87.3	43.3	-177.8	-73	173	0	0	0	113.9
762	Q	31.2	Very low	29.5	Very low	176 Å²	176	139.5 Å²	139.5	82%	0.822	77%	0.77	S	S	*	*	S	Bend	trans	-123.2	31.4	175	-151.8	170.7	-8.9	0	0	113.4	T760	T760-Q762 VanDerWaalsContact C-N 3.26Å; T760-Q762 PolarHBondContact O-N 2.71Å; T760-Q762 VanDerWaalsContact O-N 3.1Å
763	S	29.4	Very low	29.5	Very low	96 Å²	96	139.7 Å²	139.7	67%	0.671	77%	0.769	S	S	*	*	S	Bend	trans	-142.7	167.5	158.1	-170.3	0	0	0	0	108.4
764	Q	30.5	Very low	29.1	Very low	180 Å²	180	139.9 Å²	139.9	84%	0.841	77%	0.768	S	S	*	*			trans	57.9	60.5	-177.6	-56.7	-176.3	-4.3	0	0	115.6
765	R	28.2	Very low	29	Very low	242 Å²	242	139.5 Å²	139.5	91%	0.913	76%	0.762	S	S	*	*			trans	-127.8	51.9	156.4	-78.1	-162.2	167.5	-161.3	-4.8	112.5
766	S	25.7	Very low	28.5	Very low	101 Å²	101	140.5 Å²	140.5	71%	0.706	76%	0.76	S	S	*	*	S	Bend	trans	-147	146.5	163.4	47.7	0	0	0	0	107.7
767	S	26.2	Very low	28.4	Very low	112 Å²	112	142.7 Å²	142.7	78%	0.783	77%	0.765	S	S	*	*	S	Bend	trans	71.8	156.1	-163.1	82.2	0	0	0	0	115.8
768	L	29.6	Very low	28.2	Very low	151 Å²	151	148 Å²	148	79%	0.791	77%	0.773	S	S	*	*			trans	57.1	106.2	-167.6	-70.7	87.3	0	0	0	114.1
769	C	29.8	Very low	28.1	Very low	119 Å²	119	146.2 Å²	146.2	80%	0.804	77%	0.772	S	S	*	*				66	122.7	79.5	-65.1	0	0	0	0	111.6
770	G	27.9	Very low	28	Very low	77 Å²	77	147.5 Å²	147.5	79%	0.794	77%	0.771	S	S	*	*			cis	79.1	70.3	29.9	0	0	0	0	0	108.8
771	R	27.8	Very low	27.7	Very low	232 Å²	232	149.7 Å²	149.7	88%	0.875	78%	0.778	S	S	*	*			trans	-127.2	73.8	-177.1	-157.7	173.2	-168.6	174.8	2.5	110
772	S	27.3	Very low	27.7	Very low	106 Å²	106	151.7 Å²	151.7	74%	0.741	78%	0.783	S	S	*	*			trans	-61	147	164.2	46.8	0	0	0	0	110.8
773	R	26.8	Very low	27.6	Very low	200 Å²	200	150.2 Å²	150.2	76%	0.755	78%	0.78	S	S	*	*			trans	28.9	98.4	161.9	-68.3	167.2	80.2	131	-6.9	115.7	E775	R773-E775 VanDerWaalsContact C-N 3.25Å; R773-E775 HydrophobicContact CB-CG 4.44Å; R773-E775 IonicContact CZ-OE1 2.78Å; R773-E775 IonicContact NE-OE1 2.77Å; R773-E775 PolarHBondContact NE-OE1 2.9Å; R773-E775 IonicContact NH2-OE1 3.53Å; R773-E775 PolarHBondContact NH2-OE1 2.79Å; R773-E775 PolarHBondContact O-N 3.27Å
774	M	24.7	Very low	27.6	Very low	161 Å²	161	151.6 Å²	151.6	79%	0.793	78%	0.781	S	S	*	*			trans	-74	85.4	156	178.6	165.2	165.3	0	0	108.3	L776	M774-L776 HydrophobicContact CE-CD1 3.99Å; M774-L776 HydrophobicContact CG-CD1 4.34Å
775	E	28.4	Very low	27.5	Very low	123 Å²	123	153.9 Å²	153.9	58%	0.575	78%	0.781	S	S	*	*			trans	-79.2	120.8	165.4	-82.1	168.1	-172.5	0	0	108.7	R773 L777	R773-E775 VanDerWaalsContact C-N 3.25Å; R773-E775 HydrophobicContact CB-CG 4.44Å; R773-E775 IonicContact CZ-OE1 2.78Å; R773-E775 IonicContact NE-OE1 2.77Å; R773-E775 PolarHBondContact NE-OE1 2.9Å; R773-E775 IonicContact NH2-OE1 3.53Å; R773-E775 PolarHBondContact NH2-OE1 2.79Å; R773-E775 PolarHBondContact O-N 3.27Å; E775-L777 PolarHBondContact O-N 3.36Å
776	L	24.4	Very low	27.5	Very low	135 Å²	135	148.7 Å²	148.7	71%	0.707	78%	0.777	S	S	*	*			trans	-73.4	113.8	165.9	-87.9	73.3	0	0	0	108	M774	M774-L776 HydrophobicContact CE-CD1 3.99Å; M774-L776 HydrophobicContact CG-CD1 4.34Å
777	L	29.2	Very low	27.7	Very low	162 Å²	162	151.5 Å²	151.5	85%	0.848	78%	0.784	S	S	*	*			trans	-127.4	111	151.4	-76.7	176.2	0	0	0	108.3	E775	E775-L777 PolarHBondContact O-N 3.36Å
778	Y	23.9	Very low	27.8	Very low	201 Å²	201	155.1 Å²	155.1	79%	0.788	79%	0.785	S	S	*	*			trans	-59.6	130.7	157	-102.9	-105.7	0	0	0	108.9
779	V	28.4	Very low	27.8	Very low	142 Å²	142	153.4 Å²	153.4	86%	0.861	78%	0.783	S	S	*	*			trans	-151	143.1	130.4	179.2	0	0	0	0	106.3
780	D	29	Very low	27.7	Very low	125 Å²	125	158.1 Å²	158.1	67%	0.668	78%	0.784	S	S	*	*			trans	-78.1	171	-168	-59.3	-83.4	0	0	0	115.8
781	N	23.6	Very low	27.7	Very low	160 Å²	160	160.8 Å²	160.8	86%	0.856	79%	0.79	S	S	*	*			trans	-94.2	96.4	177.5	-68.5	-75	0	0	0	112
782	E	30.1	Very low	27.7	Very low	184 Å²	184	158.2 Å²	158.2	86%	0.86	78%	0.784	S	S	*	*			trans	-116.9	97	154.1	-66.7	-94.4	124.7	0	0	104.7
783	L	29.3	Very low	27.7	Very low	145 Å²	145	161.9 Å²	161.9	76%	0.759	80%	0.795	S	S	*	*				60.3	133.9	65	-152.8	72.1	0	0	0	113.4
784	D	28.2	Very low	27.8	Very low	126 Å²	126	156.3 Å²	156.3	67%	0.674	79%	0.787	S	S	*	*			trans	47	96.9	165	-74	0.2	0	0	0	120.4
785	R	28.9	Very low	28	Very low	227 Å²	227	155.1 Å²	155.1	86%	0.857	79%	0.789	S	S	*	*				-174.1	126.4	94.1	-92.5	143.2	-163.7	-161.2	2.5	113.4
786	T	27.7	Very low	28.1	Very low	133 Å²	133	156.6 Å²	156.6	82%	0.816	80%	0.801	S	S	*	*			trans	-99.4	85	173.7	44.5	0	0	0	0	112	K788	T786-K788 PolarHBondContact O-N 2.78Å
787	N	31.8	Very low	28.3	Very low	160 Å²	160	153.2 Å²	153.2	86%	0.856	80%	0.798	S	S	*	*			trans	-73.4	111.1	169.8	-81.4	-16.7	0	0	0	110.8
788	K	27.9	Very low	28.1	Very low	188 Å²	188	153.2 Å²	153.2	82%	0.817	80%	0.797	S	S	*	*			trans	-75.4	152	169.4	-58.4	170.3	-177.6	168.1	0	108.8	T786	T786-K788 PolarHBondContact O-N 2.78Å
789	P	28.5	Very low	28.3	Very low	115 Å²	115	150.9 Å²	150.9	75%	0.747	80%	0.797	S	S	*	*				-148.1	139.3	91.8	35.7	-18.2	0	0	0	117.4
790	R	28	Very low	28.1	Very low	218 Å²	218	149.2 Å²	149.2	82%	0.823	79%	0.792	S	S	*	*			trans	37	110	135	-61.2	175.3	171.7	173	-2.6	120.6
791	C	27.7	Very low	28.1	Very low	134 Å²	134	148.7 Å²	148.7	91%	0.905	80%	0.798	S	S	*	*				-150.2	85.1	123.7	-91.8	0	0	0	0	107.1
792	K	28.4	Very low	28.3	Very low	177 Å²	177	145.6 Å²	145.6	77%	0.77	79%	0.789	S	S	*	*				54.6	79.6	79.1	-111.7	-157.3	-179.9	-162.9	0	114.3
793	L	26.5	Very low	28.2	Very low	183 Å²	183	143.3 Å²	143.3	96%	0.958	78%	0.783	S	S	*	*			trans	-137.9	111.1	132.1	-116.9	168.1	0	0	0	106.2
794	S	29.9	Very low	28.1	Very low	84 Å²	84	142.3 Å²	142.3	59%	0.587	78%	0.777	S	S	*	*			trans	-126.5	123.2	-168.9	53.9	0	0	0	0	110.9	N796	S794-N796 PolarHBondContact O-N 3.41Å; S794-N796 VanDerWaalsContact O-N 3.16Å
795	T	29.1	Very low	28.2	Very low	135 Å²	135	139.6 Å²	139.6	83%	0.828	78%	0.779	S	S	*	*	S	Bend	trans	-66.9	104.3	158.7	36.9	0	0	0	0	109.1
796	N	29.4	Very low	28.2	Very low	155 Å²	155	135.6 Å²	135.6	83%	0.829	77%	0.77	S	S	*	*			trans	160.8	145.5	151.8	-81.6	-12.5	0	0	0	110.8	S794	S794-N796 PolarHBondContact O-N 3.41Å; S794-N796 VanDerWaalsContact O-N 3.16Å
797	G	28.4	Very low	28.2	Very low	64 Å²	64	136 Å²	136	66%	0.66	77%	0.767	S	S	*	*			trans	99.4	97.4	-166.4	0	0	0	0	0	109.4
798	I	25.7	Very low	27.9	Very low	161 Å²	161	134.6 Å²	134.6	83%	0.826	76%	0.759	S	S	*	*			cis	67.2	134.9	42.7	-38.8	167.5	0	0	0	111.9
799	I	27.1	Very low	27.8	Very low	153 Å²	153	131.3 Å²	131.3	79%	0.785	76%	0.759	S	S	*	*			trans	90.1	110.8	172.3	-49.1	-173.4	0	0	0	116.2
800	S	25.3	Very low	27.7	Very low	107 Å²	107	132.3 Å²	132.3	75%	0.748	76%	0.758	S	S	*	*			trans	53.6	84.9	150.3	-53.2	0	0	0	0	120.9
801	S	29	Very low	27.8	Very low	113 Å²	113	126.7 Å²	126.7	79%	0.79	75%	0.748	S	S	*	*				-132	124.4	95.5	52.7	0	0	0	0	107.9
802	S	27.6	Very low	27.7	Very low	96 Å²	96	126.3 Å²	126.3	67%	0.671	74%	0.736	S	S	*	*			cis	69.4	50.3	42.1	88.8	0	0	0	0	114
803	N	28.5	Very low	28.3	Very low	136 Å²	136	124.8 Å²	124.8	73%	0.727	74%	0.736	S	S	*	*				-176	144.2	124.8	-88.5	-0.6	0	0	0	107.7
804	L	27.2	Very low	28.3	Very low	124 Å²	124	120.1 Å²	120.1	65%	0.649	72%	0.719	S	S	*	*				40.4	112.6	92.8	-79	66.8	0	0	0	110.1	E806	L804-E806 WeakPolarHBondContact CD2-OE1 3.21Å
805	G	29.6	Very low	28.1	Very low	68 Å²	68	121.3 Å²	121.3	70%	0.701	72%	0.719	S	S	*	*			cis	71.8	170	28.7	0	0	0	0	0	110.3
806	E	28.4	Very low	28.1	Very low	144 Å²	144	121.9 Å²	121.9	67%	0.673	71%	0.712	S	S	*	*			trans	64.2	106.6	-173.5	-56.3	169.8	-155.5	0	0	113.5	L804	L804-E806 WeakPolarHBondContact CD2-OE1 3.21Å
807	N	27.9	Very low	27.9	Very low	140 Å²	140	118.9 Å²	118.9	75%	0.749	70%	0.702	S	S	*	*			trans	66.2	133.8	146	-40.5	-25.4	0	0	0	116.5
808	L	25.5	Very low	27.7	Very low	132 Å²	132	124.9 Å²	124.9	69%	0.691	71%	0.71	S	S	*	*	S	Bend	cis	-128.7	156.4	9	-53.9	91.9	0	0	0	106.9	I812	L808-I812 HydrophobicContact CD2-CG1 4.14Å
809	S	25.3	Very low	27.9	Very low	118 Å²	118	121.6 Å²	121.6	83%	0.825	70%	0.701	S	S	*	*	S	Bend		-136.2	73.9	52.9	63.8	0	0	0	0	114.1
810	D	26.5	Very low	27.9	Very low	136 Å²	136	119.3 Å²	119.3	73%	0.727	69%	0.694	S	S	*	*	S	Bend		-62	129.7	122.1	-83	-43.4	0	0	0	107.2	I812	D810-I812 PolarHBondContact O-N 2.91Å
811	V	30.1	Very low	28.1	Very low	100 Å²	100	123 Å²	123	61%	0.606	70%	0.7	S	S	*	*			trans	10.3	104.8	137.6	180	0	0	0	0	113.3	D813	V811-D813 HydrophobicContact CG1-CB 4.27Å; V811-D813 VanDerWaalsContact CG1-OD1 3.31Å; V811-D813 WeakPolarHBondContact CG1-OD1 3.37Å; V811-D813 PolarHBondContact O-N 3.2Å
812	I	26	Very low	28	Very low	126 Å²	126	124.7 Å²	124.7	65%	0.646	70%	0.695	S	S	*	*			trans	-64	112.7	142.8	-35.2	178.2	0	0	0	103.5	L808 D810 S814	L808-I812 HydrophobicContact CD2-CG1 4.14Å; D810-I812 PolarHBondContact O-N 2.91Å; I812-S814 CarbonylContact C-O 3.1Å; I812-S814 VanDerWaalsContact CB-O 3.24Å; I812-S814 WeakPolarHBondContact CB-O 3.43Å; I812-S814 WeakPolarHBondContact CG2-O 3.48Å; I812-S814 CarbonylContact O-C 3.6Å; I812-S814 PolarHBondContact O-N 3.05Å; I812-S814 VanDerWaalsContact O-O 3.04Å
813	D	41.6	Very low	28.4	Very low	145 Å²	145	127 Å²	127	78%	0.775	71%	0.705	S	S	*	*	S	Bend	trans	-65.7	101.8	178.2	-100.1	-37.5	0	0	0	107.2	V811	V811-D813 HydrophobicContact CG1-CB 4.27Å; V811-D813 VanDerWaalsContact CG1-OD1 3.31Å; V811-D813 WeakPolarHBondContact CG1-OD1 3.37Å; V811-D813 PolarHBondContact O-N 3.2Å
814	S	25.3	Very low	28.5	Very low	86 Å²	86	128.1 Å²	128.1	60%	0.601	71%	0.711	S	S	*	*	S	Bend	trans	61.2	135.4	-147.6	2	0	0	0	0	111.7	I812	I812-S814 CarbonylContact C-O 3.1Å; I812-S814 VanDerWaalsContact CB-O 3.24Å; I812-S814 WeakPolarHBondContact CB-O 3.43Å; I812-S814 WeakPolarHBondContact CG2-O 3.48Å; I812-S814 CarbonylContact O-C 3.6Å; I812-S814 PolarHBondContact O-N 3.05Å; I812-S814 VanDerWaalsContact O-O 3.04Å
815	D	26.5	Very low	28.7	Very low	109 Å²	109	125.6 Å²	125.6	58%	0.583	72%	0.715	S	S	*	*			cis	-169.7	-180	15.7	-133.7	-31.4	0	0	0	112.8
816	H	28.4	Very low	28.7	Very low	147 Å²	147	127.6 Å²	127.6	68%	0.681	73%	0.725	S	S	*	*			trans	44.8	105.9	142.9	-64.4	-9.6	0	0	0	120.7
817	C	25.5	Very low	28.9	Very low	92 Å²	92	124.3 Å²	124.3	62%	0.622	73%	0.73	S	S	*	*				86.6	135.1	111.5	-71.3	0	0	0	0	122.4
818	F	25	Very low	29	Very low	190 Å²	190	124.8 Å²	124.8	83%	0.833	73%	0.732	S	S	*	*			trans	75.2	155.8	133.1	-77.3	-141.6	0	0	0	116.7
819	S	29.3	Very low	29.2	Very low	92 Å²	92	123.9 Å²	123.9	64%	0.643	73%	0.728	S	S	*	*			cis	-160.9	138.9	-7.1	39.4	0	0	0	0	113.5
820	V	27.7	Very low	29.3	Very low	105 Å²	105	129.1 Å²	129.1	64%	0.636	73%	0.73	S	S	*	*				52.6	118	127.6	-173.5	0	0	0	0	120.4	H822	V820-H822 WeakPolarHBondContact CG1-CD2 3.35Å
821	Q	29.6	Very low	29.3	Very low	184 Å²	184	127.9 Å²	127.9	86%	0.86	73%	0.732	S	S	*	*				-173.6	103.8	119.3	-98.6	172.4	28.7	0	0	108.8
822	H	27.5	Very low	29.1	Very low	149 Å²	149	130.9 Å²	130.9	69%	0.69	74%	0.743	S	S	*	*				70.2	83.6	87.6	-76.7	-57.6	0	0	0	116.3	V820	V820-H822 WeakPolarHBondContact CG1-CD2 3.35Å
823	T	35.5	Very low	29.1	Very low	144 Å²	144	130.8 Å²	130.8	88%	0.883	75%	0.749	S	S	*	*			trans	-141.1	112.6	149.7	53	0	0	0	0	109.7
824	N	29.5	Very low	28.5	Very low	160 Å²	160	131.1 Å²	131.1	86%	0.856	75%	0.75	S	S	*	*			trans	-97	160.2	-178.5	-65.4	-9.9	0	0	0	111.9
825	G	31.7	Very low	28.6	Very low	71 Å²	71	134.5 Å²	134.5	73%	0.732	76%	0.756	S	S	*	*			trans	126.2	83.3	175.2	0	0	0	0	0	111.5
826	A	30.4	Very low	28.5	Very low	110 Å²	110	136.1 Å²	136.1	91%	0.909	77%	0.765	S	S	*	*				61.6	113.2	64.7	0	0	0	0	0	112.1
827	G	31.3	Very low	28.5	Very low	75 Å²	75	135 Å²	135	77%	0.773	77%	0.767	S	S	*	*			trans	161	58.7	-169.4	0	0	0	0	0	114.7
828	D	31.4	Very low	28.6	Very low	150 Å²	150	136.8 Å²	136.8	80%	0.802	77%	0.77	S	S	*	*			trans	-49.3	162.5	172.2	-19	-43.4	0	0	0	112.8
829	N	29.3	Very low	28.6	Very low	113 Å²	113	136.6 Å²	136.6	60%	0.604	77%	0.769	S	S	*	*			cis	-158.4	157.1	2.5	-143.1	-8.9	0	0	0	106.2
830	W	26.6	Very low	28.5	Very low	228 Å²	228	137.4 Å²	137.4	86%	0.864	77%	0.772	S	S	*	*			cis	-145.3	163	13.8	-46.7	64.5	0	0	0	110
831	S	26.8	Very low	28.4	Very low	109 Å²	109	139.3 Å²	139.3	76%	0.762	77%	0.774	S	S	*	*			trans	-152.5	127.5	172.6	59.5	0	0	0	0	114.8
832	L	26.7	Very low	28.4	Very low	163 Å²	163	136.2 Å²	136.2	85%	0.853	77%	0.77	S	S	*	*	S	Bend	trans	35.1	119.5	140.6	-96.3	152.2	0	0	0	120.1
833	V	25.1	Very low	28.5	Very low	125 Å²	125	135.8 Å²	135.8	76%	0.758	77%	0.768	S	S	*	*			trans	78.3	95.5	163.3	-167.7	0	0	0	0	116.2
834	D	29.6	Very low	28.1	Very low	151 Å²	151	134.4 Å²	134.4	81%	0.807	76%	0.76	S	S	*	*			trans	-140.8	140.1	140.3	-76.5	-49.2	0	0	0	104.8
835	E	26.6	Very low	28	Very low	157 Å²	157	135.1 Å²	135.1	73%	0.734	76%	0.763	S	S	*	*			cis	90.6	120.8	37.6	-148.7	-170.8	-126.5	0	0	113.8
836	L	25.2	Very low	27.9	Very low	144 Å²	144	135.2 Å²	135.2	75%	0.754	76%	0.764	S	S	*	*			trans	62.4	160.6	179.8	-56.4	131.1	0	0	0	113.7
837	V	28.2	Very low	27.6	Very low	122 Å²	122	139.7 Å²	139.7	74%	0.739	76%	0.763	S	S	*	*			cis	-147	117.6	31.2	164.1	0	0	0	0	111.7
838	I	28.5	Very low	27.4	Very low	131 Å²	131	142.1 Å²	142.1	67%	0.672	76%	0.762	S	S	*	*			trans	70.5	112.5	137	-66.4	179.5	0	0	0	123.4
839	F	25	Very low	27.2	Very low	186 Å²	186	145.2 Å²	145.2	82%	0.816	76%	0.763	S	S	*	*			trans	63.1	155.1	136.8	-74.5	-122.7	0	0	0	122.1
840	P	27.2	Very low	27.1	Very low	108 Å²	108	146 Å²	146	70%	0.701	77%	0.767	S	S	*	*			cis	-140.3	177	-31.2	38.9	-21.5	0	0	0	115.8
841	Q	25.4	Very low	27.3	Very low	145 Å²	145	143 Å²	143	68%	0.678	76%	0.763	S	S	*	*			trans	-62	152.6	155	-97.2	-176.8	4.3	0	0	111.4
842	P	29.7	Very low	27.4	Very low	119 Å²	119	143.6 Å²	143.6	77%	0.773	76%	0.761	S	S	*	*				-134.2	154.5	84.4	30.1	-12.4	0	0	0	112.9
843	Q	29.4	Very low	27.4	Very low	140 Å²	140	145.4 Å²	145.4	65%	0.654	76%	0.763	S	S	*	*			cis	70.2	93.6	46.5	-67.2	-162.5	33	0	0	115.6
844	T	26.2	Very low	27.5	Very low	116 Å²	116	146.5 Å²	146.5	71%	0.712	76%	0.764	S	S	*	*			trans	70.8	148.8	131.9	-20.6	0	0	0	0	120.3
845	L	27.8	Very low	27.3	Very low	175 Å²	175	142.8 Å²	142.8	92%	0.916	76%	0.755	S	S	*	*			trans	67.3	167.4	163.2	-72.1	152	0	0	0	117.1
846	G	29.6	Very low	27.4	Very low	73 Å²	73	144.6 Å²	144.6	75%	0.753	76%	0.76	S	S	*	*			trans	99.9	85.2	162.2	0	0	0	0	0	116.7
847	F	24.5	Very low	27.6	Very low	204 Å²	204	144.2 Å²	144.2	90%	0.895	76%	0.759	S	S	*	*			trans	-63.2	169.6	144	-76.8	-109.3	0	0	0	109.6
848	V	27.2	Very low	27.8	Very low	126 Å²	126	143.7 Å²	143.7	76%	0.764	76%	0.756	S	S	*	*			trans	90.4	87.3	158.7	-166	0	0	0	0	118.3
849	R	25.9	Very low	27.8	Very low	215 Å²	215	146.8 Å²	146.8	81%	0.811	76%	0.761	S	S	*	*				69.8	142.3	109.5	-145.5	-172.1	-170.3	164.4	1.9	120.9
850	N	27.5	Very low	28.3	Very low	128 Å²	128	145.2 Å²	145.2	68%	0.684	76%	0.756	S	S	*	*			trans	71.9	144	166.3	-59.1	-28.9	0	0	0	116.2
851	Q	30.6	Very low	28.4	Very low	167 Å²	167	149 Å²	149	78%	0.78	76%	0.764	S	S	*	*			cis	-165.8	137.3	30.9	-134.1	157.5	34.7	0	0	111
852	T	29.1	Very low	28.6	Very low	120 Å²	120	147.6 Å²	147.6	74%	0.736	77%	0.767	S	S	*	*			trans	51.6	117.1	148.5	50.4	0	0	0	0	123.8
853	F	28.2	Very low	28.6	Very low	201 Å²	201	149.2 Å²	149.2	88%	0.882	77%	0.769	S	S	*	*	S	Bend		-139.2	99.4	118.1	-121.8	-80.1	0	0	0	110.2
854	N	26	Very low	28.9	Very low	148 Å²	148	147.6 Å²	147.6	79%	0.791	77%	0.771	S	S	*	*	S	Bend	trans	57.1	155.9	177.3	-66.3	-22.8	0	0	0	118.7
855	A	25.9	Very low	29.1	Very low	74 Å²	74	150.6 Å²	150.6	61%	0.612	78%	0.776	S	S	*	*			cis	-165.3	119.2	-35.9	0	0	0	0	0	107.9
856	K	28	Very low	29.4	Very low	194 Å²	194	148.4 Å²	148.4	84%	0.843	77%	0.773	S	S	*	*			trans	66.5	147.7	-173.7	-50.3	170.2	-175.8	173.9	0	113.1
857	N	30.3	Very low	29.4	Very low	137 Å²	137	150 Å²	150	73%	0.733	77%	0.772	S	S	*	*			cis	-155.6	158.5	-14.3	-113.9	5	0	0	0	109.4
858	T	31.5	Very low	29.6	Very low	110 Å²	110	147.4 Å²	147.4	68%	0.675	77%	0.767	S	S	*	*			trans	46.1	91.1	140.5	-50	0	0	0	0	117.4
859	Y	30	Very low	29.7	Very low	197 Å²	197	147.7 Å²	147.7	77%	0.773	76%	0.764	S	S	*	*				92.1	149.3	79.9	-93.5	-65.6	0	0	0	114
860	H	34.8	Very low	30	Very low	153 Å²	153	144.4 Å²	144.4	71%	0.708	76%	0.762	S	S	*	*			trans	55.2	100.5	157.2	-62.6	-57.9	0	0	0	120.5	P862	H860-P862 WeakPolarHBondContact O-CD 3.38Å
861	Q	29.5	Very low	30	Very low	187 Å²	187	142.8 Å²	142.8	87%	0.874	77%	0.766	S	S	*	*				-16.2	123.3	124.2	175.5	-176.6	36	0	0	113.3
862	P	28.8	Very low	30	Very low	115 Å²	115	140.9 Å²	140.9	75%	0.747	77%	0.768	S	S	*	*				-149.1	177.4	106.1	41.3	-25.8	0	0	0	115.8	H860	H860-P862 WeakPolarHBondContact O-CD 3.38Å
863	L	29.3	Very low	30.3	Very low	153 Å²	153	140.2 Å²	140.2	80%	0.801	77%	0.769	S	S	*	*			trans	-65.4	169.2	153.2	-91.4	71.8	0	0	0	110.5
864	P	36.5	Very low	30.5	Very low	107 Å²	107	138.3 Å²	138.3	70%	0.695	76%	0.761	S	S	*	*			cis	-133.5	-155.7	-4.2	31	-7.3	0	0	0	112.8
865	Q	29.8	Very low	30.7	Very low	178 Å²	178	141.6 Å²	141.6	83%	0.832	77%	0.768	S	S	*	*			trans	103.9	134	156.3	-57.9	-165.2	-4.4	0	0	117.8
866	P	34.7	Very low	31	Very low	129 Å²	129	146 Å²	146	84%	0.838	77%	0.774	S	S	*	*			trans	-95.8	141.8	177.2	36.8	-32.5	0	0	0	112.5
867	S	29.5	Very low	31.2	Very low	107 Å²	107	142 Å²	142	75%	0.748	77%	0.767	S	S	*	*			trans	-161	151.8	151.2	51.9	0	0	0	0	110.6
868	L	29.3	Very low	31.2	Very low	149 Å²	149	146.4 Å²	146.4	78%	0.78	78%	0.775	S	S	*	*			trans	29.2	123.7	144.8	-62.3	162.6	0	0	0	116.6
869	N	29.2	Very low	31.1	Very low	132 Å²	132	149.6 Å²	149.6	71%	0.706	78%	0.782	S	S	*	*				178	177.1	56.4	-127.4	-26.7	0	0	0	114
870	L	30.7	Very low	31.1	Very low	147 Å²	147	147.9 Å²	147.9	77%	0.77	79%	0.786	S	S	*	*			trans	67.8	96.5	155.2	-94.7	67.6	0	0	0	121.5
871	A	29.3	Very low	31.1	Very low	93 Å²	93	146.7 Å²	146.7	77%	0.769	79%	0.789	S	S	*	*				78.3	116.5	118.9	0	0	0	0	0	121.9
872	P	30.5	Very low	31.1	Very low	127 Å²	127	144.9 Å²	144.9	83%	0.825	79%	0.785	S	S	*	*			trans	-94.7	154.5	164.4	37.2	-32.8	0	0	0	113.1
873	S	33.8	Very low	31.1	Very low	107 Å²	107	146.4 Å²	146.4	75%	0.748	79%	0.787	S	S	*	*			trans	-116.9	104.1	-172.6	56.7	0	0	0	0	115.5
874	F	32.3	Very low	31.3	Very low	161 Å²	161	146.1 Å²	146.1	71%	0.706	79%	0.787	S	S	*	*			trans	44.7	111.8	145.2	-55	-78.9	0	0	0	121.8	K876	F874-K876 HydrophobicContact CD1-CG 4.4Å
875	F	31.2	Very low	31.1	Very low	217 Å²	217	151 Å²	151	95%	0.952	80%	0.798	S	S	*	*				-142.3	119.3	109.9	-110	-81.6	0	0	0	108.5
876	K	33	Very low	31.2	Very low	167 Å²	167	145.6 Å²	145.6	73%	0.726	79%	0.789	S	S	*	*			trans	-82.9	133.7	-172.5	-72.4	-179.2	175.6	179.4	0	111.8	F874	F874-K876 HydrophobicContact CD1-CG 4.4Å
877	P	31.1	Very low	31	Very low	108 Å²	108	147.2 Å²	147.2	70%	0.701	79%	0.791	S	S	*	*			trans	-70	149.4	150	32.7	-32.1	0	0	0	109.3	Q879	P877-Q879 PolarHBondContact O-N 3.2Å
878	Y	29.6	Very low	31.1	Very low	231 Å²	231	150.4 Å²	150.4	91%	0.906	80%	0.799	S	S	*	*			trans	-70.5	101.5	173.1	-88.9	-96.7	0	0	0	110.1
879	Q	30.2	Very low	31.3	Very low	176 Å²	176	148.9 Å²	148.9	82%	0.822	80%	0.798	S	S	*	*			trans	-92.3	93.5	169.6	-168.4	168.2	2.9	0	0	107.5	P877 T881	P877-Q879 PolarHBondContact O-N 3.2Å; Q879-T881 PolarHBondContact O-N 3.44Å
880	L	30.6	Very low	31.4	Very low	162 Å²	162	148 Å²	148	85%	0.848	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-62.1	124.3	166.7	-95.7	141.5	0	0	0	107.7
881	T	33.3	Very low	31.7	Very low	127 Å²	127	150 Å²	150	78%	0.779	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-70.6	143.3	179.7	43.6	0	0	0	0	110.9	Q879	Q879-T881 PolarHBondContact O-N 3.44Å
882	D	29.4	Very low	32.1	Very low	149 Å²	149	151.6 Å²	151.6	80%	0.797	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-56.7	136.4	166.6	-53	-89.6	0	0	0	110.6
883	D	30.3	Very low	32.6	Very low	147 Å²	147	152.9 Å²	152.9	79%	0.786	79%	0.788	S	S	*	*				-176.7	141.3	126.4	-97.1	-28.3	0	0	0	110.9
884	N	33.1	Very low	32.8	Very low	147 Å²	147	156 Å²	156	79%	0.786	79%	0.79	S	S	*	*	S	Bend	trans	76.4	159.6	-174.8	-49.4	-81.2	0	0	0	116.5
885	F	32.8	Very low	33.2	Very low	211 Å²	211	154.8 Å²	154.8	93%	0.925	79%	0.786	S	S	*	*			trans	71.6	42.5	-178.6	-58.1	-74.9	0	0	0	118.3
886	G	31.6	Very low	33.5	Very low	64 Å²	64	150.7 Å²	150.7	66%	0.66	77%	0.77	S	S	*	*				46.3	120.9	115.7	0	0	0	0	0	121.7
887	N	30.7	Very low	34.1	Very low	162 Å²	162	147.7 Å²	147.7	87%	0.866	76%	0.761	S	S	*	*			trans	55	84.4	142.3	-61.3	-13.7	0	0	0	119.2
888	L	31.3	Very low	34.5	Very low	175 Å²	175	144.8 Å²	144.8	92%	0.916	74%	0.743	S	S	*	*			trans	-149.8	150.8	140.8	-96.8	131.9	0	0	0	110.4
889	P	32.5	Very low	35.1	Very low	116 Å²	116	138 Å²	138	75%	0.753	72%	0.721	S	S	*	*			trans	-89.7	149	-155.3	33.9	-35.2	0	0	0	115.3	K891	P889-K891 PolarHBondContact O-N 3.38Å
890	V	33	Very low	35.5	Very low	113 Å²	113	135.9 Å²	135.9	69%	0.685	71%	0.711	S	S	*	*			trans	-58.6	119.5	176.2	-180	0	0	0	0	111.9	K893	V890-K893 HydrophobicContact CG1-CD 4.22Å; V890-K893 HydrophobicContact CG1-CG 4.45Å
891	K	36.4	Very low	36.3	Very low	190 Å²	190	133.3 Å²	133.3	83%	0.826	70%	0.695	S	S	*	*			trans	-150.1	-20.3	161.9	-118.5	169	-172.2	178	0	118.2	P889	P889-K891 PolarHBondContact O-N 3.38Å
892	D	38.3	Very low	36.7	Very low	126 Å²	126	133.7 Å²	133.7	67%	0.674	69%	0.688	S	S	*	*			trans	-98.9	19.7	-171	-61.5	-60.6	0	0	0	116.3	E894	D892-E894 PolarHBondContact O-N 2.87Å
893	K	39.6	Very low	36.9	Very low	155 Å²	155	131.3 Å²	131.3	67%	0.674	68%	0.675	S	S	*	*	H	α-helix	trans	-69.5	-24.8	-173.8	-73.2	-169.8	175.2	-176.7	0	114.9	V890	V890-K893 HydrophobicContact CG1-CD 4.22Å; V890-K893 HydrophobicContact CG1-CG 4.45Å
894	E	38.6	Very low	37.2	Very low	171 Å²	171	133.7 Å²	133.7	80%	0.799	67%	0.673	S	S	*	*	H	α-helix	trans	-75.9	-35.3	-178.6	-64.1	-171.7	129.8	0	0	113.2	D892 H896 I897 S898	D892-E894 PolarHBondContact O-N 2.87Å; E894-H896 PolarHBondContact O-N 3.18Å; E894-I897 PolarHBondContact O-N 3.39Å; E894-S898 PolarHBondContact O-N 3.38Å
895	H	40.3	Very low	37.3	Very low	136 Å²	136	135 Å²	135	63%	0.63	67%	0.667	S	S	*	*	H	α-helix	trans	-66.6	-35.8	-176.4	-108.9	-48.7	0	0	0	112.8	I897 S898 I899	H895-I897 VanDerWaalsContact C-N 3.34Å; H895-I897 PolarHBondContact O-N 3.13Å; H895-S898 PolarHBondContact O-N 2.77Å; H895-S898 PolarHBondContact O-OG 2.94Å; H895-I899 PolarHBondContact O-N 3.28Å
896	H	38.8	Very low	37.2	Very low	132 Å²	132	127.6 Å²	127.6	61%	0.611	65%	0.645	S	S	*	*	H	α-helix	trans	-64.7	-33.9	177	-83.9	-85	0	0	0	113.5	E894 I899 Q900	E894-H896 PolarHBondContact O-N 3.18Å; H896-I899 PolarHBondContact O-N 2.8Å; H896-Q900 WeakPolarHBondContact O-CB 3.29Å; H896-Q900 PolarHBondContact O-N 3.01Å
897	I	45	Very low	37.3	Very low	103 Å²	103	130.1 Å²	130.1	53%	0.528	64%	0.643	S	S	.	*	H	α-helix	trans	-66.2	-42.8	178.8	-61.1	172	0	0	0	110.2	E894 H895 I899 Q900 Q901	E894-I897 PolarHBondContact O-N 3.39Å; H895-I897 VanDerWaalsContact C-N 3.34Å; H895-I897 PolarHBondContact O-N 3.13Å; I897-I899 PolarHBondContact O-N 3Å; I897-Q900 PolarHBondContact O-N 2.95Å; I897-Q901 WeakPolarHBondContact O-CB 3.47Å; I897-Q901 WeakPolarHBondContact O-CG 3.46Å; I897-Q901 PolarHBondContact O-N 3.06Å
898	S	40.2	Very low	37.4	Very low	47 Å²	47	125.7 Å²	125.7	33%	0.329	62%	0.624	S	S	.	*	H	α-helix	trans	-63.3	-41.9	178.8	72.1	0	0	0	0	112.5	E894 H895 Q901 Q902	E894-S898 PolarHBondContact O-N 3.38Å; H895-S898 PolarHBondContact O-N 2.77Å; H895-S898 PolarHBondContact O-OG 2.94Å; S898-Q901 PolarHBondContact O-N 3.42Å; S898-Q902 WeakPolarHBondContact O-CG 3.45Å; S898-Q902 PolarHBondContact O-N 2.84Å
899	I	41.7	Very low	37.7	Very low	88 Å²	88	124 Å²	124	45%	0.451	62%	0.615	S	S	.	*	H	α-helix	trans	-70.4	-41.6	178.5	-63.6	171	0	0	0	110.7	H895 H896 I897 Q901 Q902 L903	H895-I899 PolarHBondContact O-N 3.28Å; H896-I899 PolarHBondContact O-N 2.8Å; I897-I899 PolarHBondContact O-N 3Å; I899-Q901 PolarHBondContact O-N 3.03Å; I899-Q902 PolarHBondContact O-N 2.96Å; I899-L903 HydrophobicContact CG2-CD1 4.2Å; I899-L903 WeakPolarHBondContact O-CB 3.39Å; I899-L903 PolarHBondContact O-N 3.35Å
900	Q	39.2	Very low	37.8	Very low	132 Å²	132	123.4 Å²	123.4	62%	0.617	61%	0.614	S	S	*	*	H	α-helix	trans	-64.9	-36.1	173.5	-79	-164.2	-6.8	0	0	112.8	H896 I897 R904	H896-Q900 WeakPolarHBondContact O-CB 3.29Å; H896-Q900 PolarHBondContact O-N 3.01Å; I897-Q900 PolarHBondContact O-N 2.95Å; Q900-R904 WeakPolarHBondContact O-CB 3.34Å; Q900-R904 PolarHBondContact O-N 3.05Å
901	Q	45.9	Very low	37.6	Very low	108 Å²	108	122.3 Å²	122.3	51%	0.505	61%	0.612	S	S	.	*	H	α-helix	trans	-67.2	-40.2	172.7	-79.8	-164.9	0.1	0	0	112.1	I897 S898 I899 R904 R905	I897-Q901 WeakPolarHBondContact O-CB 3.47Å; I897-Q901 WeakPolarHBondContact O-CG 3.46Å; I897-Q901 PolarHBondContact O-N 3.06Å; S898-Q901 PolarHBondContact O-N 3.42Å; I899-Q901 PolarHBondContact O-N 3.03Å; Q901-R904 PolarHBondContact O-N 2.86Å; Q901-R905 WeakPolarHBondContact O-CB 3.3Å; Q901-R905 WeakPolarHBondContact O-CG 3.45Å; Q901-R905 PolarHBondContact O-N 3.32Å
902	Q	41.3	Very low	37.3	Very low	135 Å²	135	123.1 Å²	123.1	63%	0.631	61%	0.609	S	S	*	*	H	α-helix	trans	-64.8	-42.1	175.1	-73.9	-179.8	9	0	0	111.7	S898 I899 R905 A906	S898-Q902 WeakPolarHBondContact O-CG 3.45Å; S898-Q902 PolarHBondContact O-N 2.84Å; I899-Q902 PolarHBondContact O-N 2.96Å; Q902-R905 PolarHBondContact O-N 3.46Å; Q902-A906 WeakPolarHBondContact O-CB 3.27Å; Q902-A906 PolarHBondContact O-N 2.96Å
903	L	34	Very low	36.9	Very low	100 Å²	100	128.9 Å²	128.9	52%	0.524	62%	0.622	S	S	.	*	H	α-helix	trans	-64.5	-44.6	172.7	-83.2	164.7	0	0	0	112.4	I899 R905 A906 L907	I899-L903 HydrophobicContact CG2-CD1 4.2Å; I899-L903 WeakPolarHBondContact O-CB 3.39Å; I899-L903 PolarHBondContact O-N 3.35Å; L903-R905 VanDerWaalsContact C-N 3.3Å; L903-R905 PolarHBondContact O-N 3.32Å; L903-A906 PolarHBondContact O-N 3.39Å; L903-L907 WeakPolarHBondContact O-CB 3.42Å; L903-L907 VanDerWaalsContact O-CG 3.27Å; L903-L907 WeakPolarHBondContact O-CG 3.35Å; L903-L907 PolarHBondContact O-N 2.92Å
904	R	37.5	Very low	36.9	Very low	197 Å²	197	130.2 Å²	130.2	74%	0.743	63%	0.627	S	S	*	*	H	α-helix	trans	-59.4	-38.8	172.8	-86.4	-171	171	-167.9	-0.9	111.9	Q900 Q901 S908	Q900-R904 WeakPolarHBondContact O-CB 3.34Å; Q900-R904 PolarHBondContact O-N 3.05Å; Q901-R904 PolarHBondContact O-N 2.86Å; R904-S908 VanDerWaalsContact O-CB 3.28Å; R904-S908 WeakPolarHBondContact O-CB 3.36Å; R904-S908 PolarHBondContact O-N 3.38Å; R904-S908 PolarHBondContact O-OG 3.31Å
905	R	34.6	Very low	36.6	Very low	173 Å²	173	126.8 Å²	126.8	65%	0.653	62%	0.622	S	S	*	*	H	α-helix	trans	-68.5	-43.5	175.5	-76.3	178.3	177.1	-172.9	0.5	111.9	Q901 Q902 L903 S908 L909	Q901-R905 WeakPolarHBondContact O-CB 3.3Å; Q901-R905 WeakPolarHBondContact O-CG 3.45Å; Q901-R905 PolarHBondContact O-N 3.32Å; Q902-R905 PolarHBondContact O-N 3.46Å; L903-R905 VanDerWaalsContact C-N 3.3Å; L903-R905 PolarHBondContact O-N 3.32Å; R905-S908 WeakPolarHBondContact CA-OG 3.43Å; R905-S908 PolarHBondContact O-OG 2.84Å; R905-L909 WeakPolarHBondContact O-CB 3.48Å; R905-L909 VanDerWaalsContact O-CG 3.23Å; R905-L909 WeakPolarHBondContact O-CG 3.44Å; R905-L909 PolarHBondContact O-N 2.95Å
906	A	31.7	Very low	36.5	Very low	57 Å²	57	126.6 Å²	126.6	47%	0.471	63%	0.633	S	S	.	*	H	α-helix	trans	-62.4	-45.7	175.6	0	0	0	0	0	112.2	Q902 L903 L909 S910	Q902-A906 WeakPolarHBondContact O-CB 3.27Å; Q902-A906 PolarHBondContact O-N 2.96Å; L903-A906 PolarHBondContact O-N 3.39Å; A906-L909 PolarHBondContact O-N 3.25Å; A906-S910 PolarHBondContact O-N 3.07Å
907	L	33.1	Very low	36.6	Very low	116 Å²	116	127 Å²	127	61%	0.607	63%	0.63	S	S	*	*	H	α-helix	trans	-68.4	-39.4	178.8	-67.8	169.6	0	0	0	112.3	L903 S910 S911	L903-L907 WeakPolarHBondContact O-CB 3.42Å; L903-L907 VanDerWaalsContact O-CG 3.27Å; L903-L907 WeakPolarHBondContact O-CG 3.35Å; L903-L907 PolarHBondContact O-N 2.92Å; L907-S910 CarbonylContact O-C 3.58Å; L907-S910 PolarHBondContact O-N 2.92Å; L907-S911 VanDerWaalsContact O-CB 3.27Å; L907-S911 WeakPolarHBondContact O-CB 3.44Å; L907-S911 PolarHBondContact O-N 2.93Å
908	S	33.4	Very low	36.8	Very low	69 Å²	69	124.7 Å²	124.7	48%	0.483	62%	0.622	S	S	.	*	H	α-helix	trans	-72.5	-27.1	175.7	54.7	0	0	0	0	113.7	R904 R905	R904-S908 VanDerWaalsContact O-CB 3.28Å; R904-S908 WeakPolarHBondContact O-CB 3.36Å; R904-S908 PolarHBondContact O-N 3.38Å; R904-S908 PolarHBondContact O-OG 3.31Å; R905-S908 WeakPolarHBondContact CA-OG 3.43Å; R905-S908 PolarHBondContact O-OG 2.84Å
909	L	35.7	Very low	37.2	Very low	139 Å²	139	128.4 Å²	128.4	73%	0.728	64%	0.638	S	S	*	*	H	α-helix	trans	-69.2	-32.3	167.3	-74.7	168.7	0	0	0	112.4	R905 A906	R905-L909 WeakPolarHBondContact O-CB 3.48Å; R905-L909 VanDerWaalsContact O-CG 3.23Å; R905-L909 WeakPolarHBondContact O-CG 3.44Å; R905-L909 PolarHBondContact O-N 2.95Å; A906-L909 PolarHBondContact O-N 3.25Å
910	S	34.7	Very low	37.7	Very low	105 Å²	105	129.4 Å²	129.4	73%	0.734	64%	0.644	S	S	*	*	H	α-helix	trans	-78.1	-26.4	174.6	-153.7	0	0	0	0	113.3	A906 L907	A906-S910 PolarHBondContact O-N 3.07Å; L907-S910 CarbonylContact O-C 3.58Å; L907-S910 PolarHBondContact O-N 2.92Å
911	S	30.7	Very low	38.8	Very low	90 Å²	90	128 Å²	128	63%	0.629	64%	0.637	S	S	*	*			trans	-89.5	-4.1	-174.3	-163.3	0	0	0	0	114.9	L907 R913	L907-S911 VanDerWaalsContact O-CB 3.27Å; L907-S911 WeakPolarHBondContact O-CB 3.44Å; L907-S911 PolarHBondContact O-N 2.93Å; S911-R913 PolarHBondContact O-N 2.85Å
912	R	28.9	Very low	39.5	Very low	206 Å²	206	128.4 Å²	128.4	78%	0.777	64%	0.639	S	S	*	*			trans	-67.1	95.5	169.2	-82	-165.2	174.5	-152.5	-1.5	109.8	K914	R912-K914 VanDerWaalsContact C-N 3.33Å; R912-K914 PolarHBondContact O-N 3.4Å
913	R	30.7	Very low	40.5	Very low	248 Å²	248	124.5 Å²	124.5	94%	0.936	62%	0.623	S	S	*	*			trans	-49.9	92.9	167.7	-69.4	-178.4	178.2	178.4	-1	109.8	S911	S911-R913 PolarHBondContact O-N 2.85Å
914	K	38.4	Very low	42.1	Very low	182 Å²	182	123.4 Å²	123.4	79%	0.791	61%	0.614	S	S	*	*			trans	-66	133.4	162.1	-68.7	172	-176.5	169.3	0	106	R912	R912-K914 VanDerWaalsContact C-N 3.33Å; R912-K914 PolarHBondContact O-N 3.4Å
915	S	33.6	Very low	43.6	Very low	99 Å²	99	116.6 Å²	116.6	69%	0.692	60%	0.597	S	S	*	*			trans	-51.1	147.6	170.7	41.8	0	0	0	0	109.6	R917	S915-R917 PolarHBondContact O-N 3.18Å
916	P	36.7	Very low	45.1	Very low	132 Å²	132	113 Å²	113	86%	0.857	59%	0.59	S	S	*	*			trans	-58.9	106.2	179.8	24.3	-33.4	0	0	0	108.7
917	R	41	Very low	46.8	Very low	142 Å²	142	110.5 Å²	110.5	54%	0.536	57%	0.569	S	S	.	*			trans	-56.7	140.8	172.6	-76.9	-167.9	159.3	-177	-8.2	108	S915 E921 S925	S915-R917 PolarHBondContact O-N 3.18Å; R917-E921 HydrophobicContact CB-CB 4.07Å; R917-E921 WeakPolarHBondContact CB-OE2 3.28Å; R917-E921 HydrophobicContact CG-CB 4.49Å; R917-E921 VanDerWaalsContact CG-OE2 3.32Å; R917-E921 WeakPolarHBondContact CG-OE2 2.98Å; R917-S925 PolarHBondContact NH1-OG 3.42Å
918	S	50	Low	48.5	Very low	54 Å²	54	109 Å²	109	38%	0.378	56%	0.561	S	S	.	*			trans	-59.5	147.3	172	70.3	0	0	0	0	109.4	N920 E921 E922	S918-N920 PolarHBondContact O-N 3.43Å; S918-E921 WeakPolarHBondContact O-CA 3.44Å; S918-E921 WeakPolarHBondContact O-CB 3.2Å; S918-E921 PolarHBondContact O-N 2.81Å; S918-E921 WeakPolarHBondContact OG-CG 3.31Å; S918-E921 PolarHBondContact OG-N 3.43Å; S918-E922 PolarHBondContact O-N 2.82Å
919	L	48.4	Very low	50.3	Low	124 Å²	124	111.8 Å²	111.8	65%	0.649	57%	0.565	S	S	*	*	H	α-helix	trans	-56	-26.7	176.8	176.9	141.4	0	0	0	111.8	I923	L919-I923 HydrophobicContact CD2-CD1 3.54Å; L919-I923 HydrophobicContact CG-CD1 4.06Å; L919-I923 WeakPolarHBondContact O-CB 3.43Å; L919-I923 VanDerWaalsContact O-CG1 3.23Å; L919-I923 WeakPolarHBondContact O-CG1 3.27Å; L919-I923 PolarHBondContact O-N 3Å
920	N	51.9	Low	51.6	Low	110 Å²	110	107.6 Å²	107.6	59%	0.588	54%	0.541	S	S	*	.	H	α-helix	trans	-67.5	-42.7	170.4	-68.1	-12.1	0	0	0	113	S918 Q924	S918-N920 PolarHBondContact O-N 3.43Å; N920-Q924 WeakPolarHBondContact O-CB 3.22Å; N920-Q924 PolarHBondContact O-N 2.81Å
921	E	62.1	Low	52.8	Low	101 Å²	101	107.3 Å²	107.3	47%	0.472	53%	0.525	S	S	.	.	H	α-helix	trans	-66.7	-36.6	175.2	-79.3	172	-151.5	0	0	112.8	R917 S918 S925	R917-E921 HydrophobicContact CB-CB 4.07Å; R917-E921 WeakPolarHBondContact CB-OE2 3.28Å; R917-E921 HydrophobicContact CG-CB 4.49Å; R917-E921 VanDerWaalsContact CG-OE2 3.32Å; R917-E921 WeakPolarHBondContact CG-OE2 2.98Å; S918-E921 WeakPolarHBondContact O-CA 3.44Å; S918-E921 WeakPolarHBondContact O-CB 3.2Å; S918-E921 PolarHBondContact O-N 2.81Å; S918-E921 WeakPolarHBondContact OG-CG 3.31Å; S918-E921 PolarHBondContact OG-N 3.43Å; E921-S925 WeakPolarHBondContact O-CB 3.44Å; E921-S925 PolarHBondContact O-N 3.35Å
922	E	61.4	Low	54.5	Low	117 Å²	117	110.8 Å²	110.8	55%	0.547	53%	0.531	S	S	.	.	H	α-helix	trans	-68.2	-48.1	175.9	-176.1	162.8	-143.8	0	0	111	S918 Q924 S925 I926	S918-E922 PolarHBondContact O-N 2.82Å; E922-Q924 VanDerWaalsContact C-N 3.34Å; E922-Q924 PolarHBondContact O-N 3.41Å; E922-S925 PolarHBondContact O-N 2.77Å; E922-I926 HydrophobicContact CG-CD1 4.05Å; E922-I926 WeakPolarHBondContact O-CG1 3.37Å; E922-I926 PolarHBondContact O-N 3.49Å
923	I	61.3	Low	55.6	Low	54 Å²	54	106.5 Å²	106.5	28%	0.277	52%	0.521	S	S	.	.	H	α-helix	trans	-62.2	-41.7	175	-62.9	167.7	0	0	0	110.7	L919 S925 I926 M927 I940	L919-I923 HydrophobicContact CD2-CD1 3.54Å; L919-I923 HydrophobicContact CG-CD1 4.06Å; L919-I923 WeakPolarHBondContact O-CB 3.43Å; L919-I923 VanDerWaalsContact O-CG1 3.23Å; L919-I923 WeakPolarHBondContact O-CG1 3.27Å; L919-I923 PolarHBondContact O-N 3Å; I923-S925 PolarHBondContact O-N 3.16Å; I923-I926 CarbonylContact O-C 3.56Å; I923-I926 PolarHBondContact O-N 3.27Å; I923-I926 VanDerWaalsContact O-N 3.14Å; I923-M927 HydrophobicContact CG2-CE 4.32Å; I923-M927 HydrophobicContact CG2-CG 4.22Å; I923-M927 HydrophobicContact CG2-SD 4.36Å; I923-M927 VanDerWaalsContact O-CG 3.31Å; I923-M927 WeakPolarHBondContact O-CG 3.36Å; I923-M927 PolarHBondContact O-N 3.17Å; I923-I940 HydrophobicContact CB-CD1 4.24Å; I923-I940 HydrophobicContact CG2-CD1 3.69Å; I923-I940 HydrophobicContact CG2-CG1 4.05Å
924	Q	68.5	Low	56.4	Low	76 Å²	76	96.6 Å²	96.6	36%	0.355	49%	0.488	S	S	.	.	H	α-helix	trans	-60.6	-44.8	174.8	-172	62.3	53	0	0	111.3	N920 E922 I926 M927 D928	N920-Q924 WeakPolarHBondContact O-CB 3.22Å; N920-Q924 PolarHBondContact O-N 2.81Å; E922-Q924 VanDerWaalsContact C-N 3.34Å; E922-Q924 PolarHBondContact O-N 3.41Å; Q924-I926 PolarHBondContact O-N 3.48Å; Q924-M927 HydrophobicContact CB-CE 4.41Å; Q924-M927 PolarHBondContact O-N 3.04Å; Q924-M927 VanDerWaalsContact O-N 3.14Å; Q924-D928 PolarHBondContact NE2-OD1 3.23Å; Q924-D928 PolarHBondContact NE2-OD2 3.45Å; Q924-D928 WeakPolarHBondContact O-CB 3.47Å; Q924-D928 VanDerWaalsContact O-CG 3.25Å; Q924-D928 PolarHBondContact O-N 2.96Å
925	S	68.2	Low	57.1	Low	54 Å²	54	88.5 Å²	88.5	38%	0.378	46%	0.456	S	S	.	.	H	α-helix	trans	-63.3	-28.7	175.8	-168.2	0	0	0	0	113	R917 E921 E922 I923 K929	R917-S925 PolarHBondContact NH1-OG 3.42Å; E921-S925 WeakPolarHBondContact O-CB 3.44Å; E921-S925 PolarHBondContact O-N 3.35Å; E922-S925 PolarHBondContact O-N 2.77Å; I923-S925 PolarHBondContact O-N 3.16Å; S925-K929 VanDerWaalsContact O-CB 3.26Å; S925-K929 WeakPolarHBondContact O-CB 3.32Å; S925-K929 PolarHBondContact O-N 3.08Å
926	I	67.6	Low	57.5	Low	97 Å²	97	86.5 Å²	86.5	50%	0.497	44%	0.437	S	S	.	.	H	α-helix	trans	-76.2	-42.4	172.4	-68.5	164.4	0	0	0	110.7	E922 I923 Q924 H930	E922-I926 HydrophobicContact CG-CD1 4.05Å; E922-I926 WeakPolarHBondContact O-CG1 3.37Å; E922-I926 PolarHBondContact O-N 3.49Å; I923-I926 CarbonylContact O-C 3.56Å; I923-I926 PolarHBondContact O-N 3.27Å; I923-I926 VanDerWaalsContact O-N 3.14Å; Q924-I926 PolarHBondContact O-N 3.48Å; I926-H930 VanDerWaalsContact O-CB 3.23Å; I926-H930 WeakPolarHBondContact O-CB 3.47Å; I926-H930 PolarHBondContact O-N 3.36Å
927	M	67.8	Low	58.4	Low	6 Å²	6	86.5 Å²	86.5	3%	0.03	42%	0.42	C	S	.	.	H	α-helix	trans	-64.1	-42.1	176.7	-69.7	-168.3	-60.8	0	0	112.3	I923 Q924 H930 Y931 M938 I940	I923-M927 HydrophobicContact CG2-CE 4.32Å; I923-M927 HydrophobicContact CG2-CG 4.22Å; I923-M927 HydrophobicContact CG2-SD 4.36Å; I923-M927 VanDerWaalsContact O-CG 3.31Å; I923-M927 WeakPolarHBondContact O-CG 3.36Å; I923-M927 PolarHBondContact O-N 3.17Å; Q924-M927 HydrophobicContact CB-CE 4.41Å; Q924-M927 PolarHBondContact O-N 3.04Å; Q924-M927 VanDerWaalsContact O-N 3.14Å; M927-H930 PolarHBondContact O-N 2.99Å; M927-Y931 WeakPolarHBondContact O-CB 3.49Å; M927-Y931 PolarHBondContact O-N 3.44Å; M927-M938 HydrophobicContact CB-CB 4.24Å; M927-M938 HydrophobicContact CG-CB 3.79Å; M927-M938 HydrophobicContact CG-CE 4.05Å; M927-M938 HydrophobicContact SD-CB 3.97Å; M927-I940 HydrophobicContact CE-CD1 3.92Å; M927-I940 HydrophobicContact CE-CG1 3.74Å; M927-I940 HydrophobicContact SD-CG1 3.85Å
928	D	67.1	Low	58.6	Low	83 Å²	83	81.1 Å²	81.1	44%	0.444	40%	0.401	S	S	.	.	H	α-helix	trans	-67.2	-45	178.4	-67.7	-24.8	0	0	0	110.9	Q924 H930 Y931 E932	Q924-D928 PolarHBondContact NE2-OD1 3.23Å; Q924-D928 PolarHBondContact NE2-OD2 3.45Å; Q924-D928 WeakPolarHBondContact O-CB 3.47Å; Q924-D928 VanDerWaalsContact O-CG 3.25Å; Q924-D928 PolarHBondContact O-N 2.96Å; D928-H930 VanDerWaalsContact C-N 3.33Å; D928-H930 PolarHBondContact O-N 2.84Å; D928-Y931 WeakPolarHBondContact O-CB 3.36Å; D928-Y931 PolarHBondContact O-N 2.8Å; D928-E932 PolarHBondContact O-N 3.17Å
929	K	72	Confident	58.4	Low	129 Å²	129	80.8 Å²	80.8	56%	0.561	40%	0.397	S	S	*	.	H	α-helix	trans	-64.9	-36	174.6	-169.7	176.1	-178.2	-179.8	0	112	S925 E932 M933	S925-K929 VanDerWaalsContact O-CB 3.26Å; S925-K929 WeakPolarHBondContact O-CB 3.32Å; S925-K929 PolarHBondContact O-N 3.08Å; K929-E932 PolarHBondContact O-N 3.38Å; K929-M933 HydrophobicContact CG-CE 4.2Å; K929-M933 HydrophobicContact CG-SD 4.49Å; K929-M933 VanDerWaalsContact O-CG 3.28Å; K929-M933 WeakPolarHBondContact O-CG 3.47Å; K929-M933 PolarHBondContact O-N 2.92Å
930	H	63.8	Low	58.1	Low	50 Å²	50	78.8 Å²	78.8	23%	0.231	39%	0.386	C	S	.	.	H	α-helix	trans	-64.6	-44.8	171.9	-179.2	-87.5	0	0	0	111.3	I926 M927 D928 E932 M933 T934 I936 M938	I926-H930 VanDerWaalsContact O-CB 3.23Å; I926-H930 WeakPolarHBondContact O-CB 3.47Å; I926-H930 PolarHBondContact O-N 3.36Å; M927-H930 PolarHBondContact O-N 2.99Å; D928-H930 VanDerWaalsContact C-N 3.33Å; D928-H930 PolarHBondContact O-N 2.84Å; H930-E932 VanDerWaalsContact C-N 3.34Å; H930-E932 PolarHBondContact O-N 3.46Å; H930-M933 PolarHBondContact O-N 3.3Å; H930-T934 PolarHBondContact CE1-OG1 2.72Å; H930-T934 VanDerWaalsContact CE1-OG1 3.3Å; H930-T934 PolarHBondContact ND1-OG1 3.41Å; H930-T934 VanDerWaalsContact O-CB 3.29Å; H930-T934 WeakPolarHBondContact O-CB 3.26Å; H930-T934 WeakPolarHBondContact O-CG2 3.37Å; H930-T934 PolarHBondContact O-N 3.05Å; H930-T934 PolarHBondContact O-OG1 2.95Å; H930-I936 PolarHBondContact ND1-O 2.83Å; H930-M938 HydrophobicContact CB-CE 3.63Å
931	Y	59.9	Low	57.3	Low	100 Å²	100	74.6 Å²	74.6	39%	0.392	37%	0.37	S	S	.	.	H	α-helix	trans	-59.5	-44.2	176	177.3	-113.5	0	0	0	111.4	M927 D928 M933 T934 G935 R937	M927-Y931 WeakPolarHBondContact O-CB 3.49Å; M927-Y931 PolarHBondContact O-N 3.44Å; D928-Y931 WeakPolarHBondContact O-CB 3.36Å; D928-Y931 PolarHBondContact O-N 2.8Å; Y931-M933 PolarHBondContact O-N 2.85Å; Y931-T934 PolarHBondContact O-N 3.28Å; Y931-G935 WeakPolarHBondContact O-CA 3.36Å; Y931-G935 PolarHBondContact O-N 3.2Å; Y931-R937 HydrophobicContact CD2-CB 3.79Å; Y931-R937 HydrophobicContact CD2-CG 4.27Å; Y931-R937 HydrophobicContact CE2-CB 4.11Å
932	E	65	Low	55.9	Low	163 Å²	163	75.1 Å²	75.1	76%	0.762	38%	0.384	S	S	*	.	H	α-helix	trans	-58.7	-45.8	174.4	-174.6	176.2	-146.5	0	0	112.6	D928 K929 H930	D928-E932 PolarHBondContact O-N 3.17Å; K929-E932 PolarHBondContact O-N 3.38Å; H930-E932 VanDerWaalsContact C-N 3.34Å; H930-E932 PolarHBondContact O-N 3.46Å
933	M	51.4	Low	54.2	Low	115 Å²	115	71.4 Å²	71.4	57%	0.567	38%	0.377	S	S	*	.	H	α-helix	trans	-76.8	-25.5	-179.5	-67.5	-175.1	-56.5	0	0	114.7	R178 K929 H930 Y931	R178-M933 PolarHBondContact NH2-O 2.95Å; K929-M933 HydrophobicContact CG-CE 4.2Å; K929-M933 HydrophobicContact CG-SD 4.49Å; K929-M933 VanDerWaalsContact O-CG 3.28Å; K929-M933 WeakPolarHBondContact O-CG 3.47Å; K929-M933 PolarHBondContact O-N 2.92Å; H930-M933 PolarHBondContact O-N 3.3Å; Y931-M933 PolarHBondContact O-N 2.85Å
934	T	49.4	Very low	52.6	Low	40 Å²	40	73.8 Å²	73.8	25%	0.245	40%	0.399	C	S	.	.	H	α-helix	trans	-116.3	-31	-168.2	67.2	0	0	0	0	115.2	H930 Y931 I936	H930-T934 PolarHBondContact CE1-OG1 2.72Å; H930-T934 VanDerWaalsContact CE1-OG1 3.3Å; H930-T934 PolarHBondContact ND1-OG1 3.41Å; H930-T934 VanDerWaalsContact O-CB 3.29Å; H930-T934 WeakPolarHBondContact O-CB 3.26Å; H930-T934 WeakPolarHBondContact O-CG2 3.37Å; H930-T934 PolarHBondContact O-N 3.05Å; H930-T934 PolarHBondContact O-OG1 2.95Å; Y931-T934 PolarHBondContact O-N 3.28Å; T934-I936 WeakPolarHBondContact OG1-CB 3.39Å; T934-I936 PolarHBondContact OG1-N 2.93Å; T934-I936 PolarHBondContact OG1-O 3.22Å
935	G	52.5	Low	50.6	Low	12 Å²	12	74.9 Å²	74.9	12%	0.124	42%	0.415	C	S	.	.	S	Bend	trans	72.7	11.8	-162.7	0	0	0	0	0	114.1	Y931	Y931-G935 WeakPolarHBondContact O-CA 3.36Å; Y931-G935 PolarHBondContact O-N 3.2Å
936	I	42.3	Very low	48.6	Very low	57 Å²	57	80.5 Å²	80.5	29%	0.292	44%	0.435	S	S	.	.			trans	-109.5	114.9	178.8	-55.7	171.5	0	0	0	107.6	H930 T934 M938 F981	H930-I936 PolarHBondContact ND1-O 2.83Å; T934-I936 WeakPolarHBondContact OG1-CB 3.39Å; T934-I936 PolarHBondContact OG1-N 2.93Å; T934-I936 PolarHBondContact OG1-O 3.22Å; I936-M938 PolarHBondContact O-N 2.96Å; I936-F981 HydrophobicContact CG2-CD1 4.47Å
937	R	54.2	Low	46.6	Very low	133 Å²	133	84 Å²	84	50%	0.502	45%	0.446	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82	113.3	-179.3	-164	178.1	-170.7	-147.8	-0.5	108.5	Y931 T939	Y931-R937 HydrophobicContact CD2-CB 3.79Å; Y931-R937 HydrophobicContact CD2-CG 4.27Å; Y931-R937 HydrophobicContact CE2-CB 4.11Å; R937-T939 HydrophobicContact CG-CG2 4.35Å
938	M	45	Very low	44.5	Very low	28 Å²	28	91.4 Å²	91.4	14%	0.138	49%	0.487	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83	143.1	165.8	-62.9	-168.3	-55.7	0	0	108.5	M927 H930 I936 W979	M927-M938 HydrophobicContact CB-CB 4.24Å; M927-M938 HydrophobicContact CG-CB 3.79Å; M927-M938 HydrophobicContact CG-CE 4.05Å; M927-M938 HydrophobicContact SD-CB 3.97Å; H930-M938 HydrophobicContact CB-CE 3.63Å; I936-M938 PolarHBondContact O-N 2.96Å; M938-W979 HydrophobicContact SD-CZ3 4.34Å
939	T	46.8	Very low	42.5	Very low	48 Å²	48	90.8 Å²	90.8	29%	0.294	49%	0.489	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	130	175.6	49.4	0	0	0	0	109.2	R937 G941	R937-T939 HydrophobicContact CG-CG2 4.35Å; T939-G941 PolarHBondContact O-N 3.49Å; T939-G941 VanDerWaalsContact O-N 3.07Å
940	I	42.4	Very low	40.2	Very low	81 Å²	81	91.3 Å²	91.3	42%	0.415	50%	0.503	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.3	107.6	171.3	-56.8	167	0	0	0	107.7	I923 M927 S942	I923-I940 HydrophobicContact CB-CD1 4.24Å; I923-I940 HydrophobicContact CG2-CD1 3.69Å; I923-I940 HydrophobicContact CG2-CG1 4.05Å; M927-I940 HydrophobicContact CE-CD1 3.92Å; M927-I940 HydrophobicContact CE-CG1 3.74Å; M927-I940 HydrophobicContact SD-CG1 3.85Å; I940-S942 PolarHBondContact O-N 2.92Å
941	G	33.7	Very low	38.4	Very low	23 Å²	23	94.2 Å²	94.2	24%	0.237	52%	0.524	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.2	98.3	164.5	0	0	0	0	0	108.9	T939 G943 S978	T939-G941 PolarHBondContact O-N 3.49Å; T939-G941 VanDerWaalsContact O-N 3.07Å; G941-G943 PolarHBondContact O-N 2.99Å; G941-S978 PolarHBondContact N-O 3.28Å
942	S	33	Very low	36.8	Very low	111 Å²	111	94.6 Å²	94.6	78%	0.776	54%	0.537	S	S	*	.			trans	-71.3	79.7	172	41	0	0	0	0	109	I940 S944	I940-S942 PolarHBondContact O-N 2.92Å; S942-S944 VanDerWaalsContact C-N 3.25Å; S942-S944 PolarHBondContact O-N 3.02Å
943	G	27.1	Very low	34.9	Very low	39 Å²	39	97 Å²	97	40%	0.402	55%	0.545	S	S	.	.			trans	-63.3	79.8	-177.5	0	0	0	0	0	112.3	G941 S945	G941-G943 PolarHBondContact O-N 2.99Å; G943-S945 PolarHBondContact O-N 3Å
944	S	26.1	Very low	33.6	Very low	105 Å²	105	95.9 Å²	95.9	73%	0.734	55%	0.549	S	S	*	.			trans	-57.3	109.6	162.7	57.4	0	0	0	0	107.1	S942 Q946	S942-S944 VanDerWaalsContact C-N 3.25Å; S942-S944 PolarHBondContact O-N 3.02Å; S944-Q946 PolarHBondContact O-N 3.18Å
945	S	27.1	Very low	32.3	Very low	98 Å²	98	103.9 Å²	103.9	69%	0.685	58%	0.576	S	S	*	*			trans	-67.1	83.6	173.3	-173.5	0	0	0	0	108.5	G943 K947	G943-S945 PolarHBondContact O-N 3Å; S945-K947 PolarHBondContact O-N 2.9Å
946	Q	26.8	Very low	31.1	Very low	172 Å²	172	109.8 Å²	109.8	80%	0.804	60%	0.603	S	S	*	*			trans	-57.4	121.2	165.5	-162.2	169.1	11.3	0	0	106	S944 N948	S944-Q946 PolarHBondContact O-N 3.18Å; Q946-N948 PolarHBondContact O-N 3.23Å
947	K	25.4	Very low	30.5	Very low	170 Å²	170	113.9 Å²	113.9	74%	0.739	63%	0.625	S	S	*	*			trans	-63.4	127.7	180	-68.6	179.7	177.4	-179.3	0	107.6	S945 S949	S945-K947 PolarHBondContact O-N 2.9Å; K947-S949 WeakPolarHBondContact CB-OG 3.49Å; K947-S949 PolarHBondContact O-N 2.78Å
948	N	23.7	Very low	29.2	Very low	163 Å²	163	113.9 Å²	113.9	87%	0.872	64%	0.635	S	S	*	*			trans	-71.5	71.8	156.2	-75.1	7.5	0	0	0	107.9	Q946	Q946-N948 PolarHBondContact O-N 3.23Å
949	S	24.7	Very low	28.3	Very low	70 Å²	70	121.9 Å²	121.9	49%	0.49	67%	0.669	S	S	.	*			trans	-118.9	56.2	172.9	63.7	0	0	0	0	109.5	K947	K947-S949 WeakPolarHBondContact CB-OG 3.49Å; K947-S949 PolarHBondContact O-N 2.78Å
950	T	24.9	Very low	27.4	Very low	140 Å²	140	122.8 Å²	122.8	86%	0.859	69%	0.688	S	S	*	*			trans	-110.9	24.8	157.2	45.6	0	0	0	0	111.1
951	T	25.1	Very low	26.7	Very low	110 Å²	110	126.2 Å²	126.2	68%	0.675	71%	0.707	S	S	*	*				-55.1	133.6	129.6	48.2	0	0	0	0	107.8
952	T	26.5	Very low	26.4	Very low	109 Å²	109	132.5 Å²	132.5	67%	0.669	73%	0.729	S	S	*	*			cis	-137.9	138.6	9	39.2	0	0	0	0	112.5	S954	T952-S954 WeakPolarHBondContact CB-OG 3.42Å; T952-S954 WeakPolarHBondContact CG2-OG 3.4Å
953	K	24.1	Very low	26.2	Very low	213 Å²	213	133.6 Å²	133.6	93%	0.926	73%	0.732	S	S	*	*			trans	-116.1	52.3	143.9	-98.5	-164	176.2	-172.8	0	109.3	Y955	K953-Y955 PolarHBondContact O-N 2.76Å
954	S	25.3	Very low	26.3	Very low	92 Å²	92	134.7 Å²	134.7	64%	0.643	74%	0.743	S	S	*	*			trans	-85.6	92.6	169.3	54.3	0	0	0	0	108.9	T952	T952-S954 WeakPolarHBondContact CB-OG 3.42Å; T952-S954 WeakPolarHBondContact CG2-OG 3.4Å
955	Y	22.7	Very low	26.3	Very low	208 Å²	208	137.3 Å²	137.3	82%	0.816	75%	0.749	S	S	*	*			trans	-70.8	145.5	157.8	-101.8	-96.7	0	0	0	108.8	K953	K953-Y955 PolarHBondContact O-N 2.76Å
956	I	27	Very low	26.5	Very low	135 Å²	135	141.9 Å²	141.9	69%	0.692	76%	0.756	S	S	*	*			trans	64.9	87.9	160.8	-53.6	155.6	0	0	0	115.7
957	N	28.5	Very low	26.5	Very low	143 Å²	143	140.4 Å²	140.4	77%	0.765	76%	0.759	S	S	*	*				-165.9	116.6	108.5	-90.6	-29.3	0	0	0	108
958	L	27	Very low	26.7	Very low	133 Å²	133	140.4 Å²	140.4	70%	0.696	76%	0.762	S	S	*	*				73.9	111.5	75.8	-117.9	71.2	0	0	0	113.8
959	F	27.4	Very low	26.9	Very low	196 Å²	196	138 Å²	138	86%	0.86	76%	0.755	S	S	*	*			trans	69.5	146.3	171.2	-61	-80.3	0	0	0	119.6
960	G	27.1	Very low	26.9	Very low	67 Å²	67	140.4 Å²	140.4	69%	0.691	77%	0.772	S	S	*	*			trans	83.5	118.8	179.4	0	0	0	0	0	114.4
961	L	28.8	Very low	27.2	Very low	154 Å²	154	144.8 Å²	144.8	81%	0.806	77%	0.772	S	S	*	*			cis	55.5	128.2	16.2	-64.3	173.5	0	0	0	114.3
962	Q	26.6	Very low	27.4	Very low	154 Å²	154	144.3 Å²	144.3	72%	0.72	77%	0.771	S	S	*	*			cis	-164.3	167.9	-15.2	-144.5	179.9	4.4	0	0	108.4
963	T	29.5	Very low	27.4	Very low	135 Å²	135	150.6 Å²	150.6	83%	0.828	78%	0.783	S	S	*	*			trans	53.8	145.3	156.6	53.9	0	0	0	0	122.4
964	G	28.1	Very low	27.8	Very low	61 Å²	61	147.4 Å²	147.4	63%	0.629	77%	0.769	S	S	*	*			trans	121	79.8	131.5	0	0	0	0	0	121.4
965	N	26.2	Very low	27.8	Very low	161 Å²	161	153.4 Å²	153.4	86%	0.861	78%	0.777	S	S	*	*			trans	72.3	160	135.7	-56.2	-20.8	0	0	0	122.6
966	K	31.7	Very low	28.1	Very low	194 Å²	194	150.5 Å²	150.5	84%	0.843	77%	0.765	S	S	*	*			trans	73.1	86.4	166.5	-60.5	-172.1	-179	-179.5	0	119.3
967	T	27.2	Very low	28	Very low	140 Å²	140	147.3 Å²	147.3	86%	0.859	75%	0.754	S	S	*	*			trans	25.9	119	131.8	-0.2	0	0	0	0	120.2
968	Q	28.8	Very low	27.9	Very low	171 Å²	171	143.1 Å²	143.1	80%	0.799	74%	0.736	S	S	*	*			trans	-136.4	139.9	160.3	-88.3	-80.9	-31.8	0	0	109.2
969	P	27.1	Very low	28	Very low	113 Å²	113	142.1 Å²	142.1	73%	0.734	72%	0.723	S	S	*	*			trans	-70.5	149.1	-175.1	28.1	-34.7	0	0	0	113.2	R971	P969-R971 PolarHBondContact O-N 3.01Å
970	S	26.5	Very low	28	Very low	119 Å²	119	135.1 Å²	135.1	83%	0.832	70%	0.696	S	S	*	*			trans	-68.5	112.6	-174.3	58.4	0	0	0	0	112.8
971	R	29.8	Very low	28	Very low	232 Å²	232	135.7 Å²	135.7	88%	0.875	68%	0.68	S	S	*	*			trans	-59.7	141.7	174.9	-71	-179.8	173.2	175	-2.7	112.1	P969	P969-R971 PolarHBondContact O-N 3.01Å
972	P	29.2	Very low	27.9	Very low	101 Å²	101	131.1 Å²	131.1	66%	0.656	66%	0.659	S	S	*	*			trans	-62.5	138.7	178.2	25.1	-33.6	0	0	0	112.1	K974	P972-K974 PolarHBondContact O-N 3.49Å
973	R	27.4	Very low	28.2	Very low	240 Å²	240	128.5 Å²	128.5	91%	0.906	65%	0.645	S	S	*	*			trans	-83.4	96.6	-166.9	-166.5	173	-175.5	167.3	-0.9	111.2	R975	R973-R975 PolarHBondContact O-N 3.19Å
974	K	31.7	Very low	28.1	Very low	146 Å²	146	127.2 Å²	127.2	64%	0.635	63%	0.633	S	S	*	*			trans	-45	122.4	177.5	-76.8	-164.7	169.4	-158.8	0	111.8	D59 P972	D59-K974 IonicContact OD1-NZ 2.75Å; D59-K974 PolarHBondContact OD1-NZ 2.79Å; D59-K974 IonicContact OD2-NZ 3.62Å; P972-K974 PolarHBondContact O-N 3.49Å
975	R	26.5	Very low	28.2	Very low	218 Å²	218	128.2 Å²	128.2	82%	0.823	62%	0.623	S	S	*	*			trans	-95.7	128.7	168.2	-76.8	179.3	166.6	163.3	-4	109.1	R973	R973-R975 PolarHBondContact O-N 3.19Å
976	R	27.1	Very low	28.3	Very low	148 Å²	148	125.3 Å²	125.3	56%	0.558	61%	0.611	S	S	*	*			trans	-97.6	133.7	169.3	-80	-178.5	162	177.6	-8	109.3
977	C	26	Very low	28.3	Very low	67 Å²	67	123.7 Å²	123.7	45%	0.453	61%	0.612	S	S	.	*			trans	-121.9	120.3	174.1	-63.7	0	0	0	0	108.6
978	S	26.7	Very low	28.5	Very low	56 Å²	56	124.1 Å²	124.1	39%	0.392	60%	0.604	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-110.2	132.7	178.7	54.6	0	0	0	0	110.2	G941	G941-S978 PolarHBondContact N-O 3.28Å
979	W	28.1	Very low	28.7	Very low	112 Å²	112	121.2 Å²	121.2	42%	0.424	59%	0.589	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-107.4	130.9	178	-63.1	70.8	0	0	0	109.5	M938	M938-W979 HydrophobicContact SD-CZ3 4.34Å
980	T	27.2	Very low	29	Very low	49 Å²	49	123.5 Å²	123.5	30%	0.301	59%	0.59	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-126.1	140.7	175.9	47.5	0	0	0	0	110.1
981	F	26.9	Very low	29.2	Very low	78 Å²	78	122.7 Å²	122.7	34%	0.342	58%	0.58	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-116.1	87.8	-173	-65.8	-81.7	0	0	0	111.3	V54 I936	V54-F981 WeakPolarHBondContact O-CD2 3.45Å; I936-F981 HydrophobicContact CG2-CD1 4.47Å
982	T	28.4	Very low	29.2	Very low	59 Å²	59	114.2 Å²	114.2	36%	0.362	56%	0.556	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-86.2	138.5	174.5	53.2	0	0	0	0	111.8
983	K	31.5	Very low	29.4	Very low	99 Å²	99	114.7 Å²	114.7	43%	0.43	55%	0.553	S	S	.	*			trans	-131.3	95.1	-177.9	-179.6	-172.4	177.5	-176.8	0	110.3	Q51 I985	Q51-K983 PolarHBondContact NE2-O 3.31Å; K983-I985 WeakPolarHBondContact O-CG1 3.34Å; K983-I985 PolarHBondContact O-N 2.9Å
984	D	28.7	Very low	29.6	Very low	108 Å²	108	110.6 Å²	110.6	58%	0.578	54%	0.542	S	S	*	.			trans	-70.3	125.3	179.3	-66.9	-43.7	0	0	0	111.4
985	I	28.6	Very low	29.4	Very low	81 Å²	81	109.3 Å²	109.3	42%	0.415	54%	0.542	S	S	.	.			trans	-107.5	45.5	-179.1	-45.5	-177.4	0	0	0	109.3	N50 K983	N50-I985 HydrophobicContact CB-CD1 3.84Å; N50-I985 WeakPolarHBondContact O-CD1 3.46Å; K983-I985 WeakPolarHBondContact O-CG1 3.34Å; K983-I985 PolarHBondContact O-N 2.9Å
986	T	29.6	Very low	29.6	Very low	101 Å²	101	103.1 Å²	103.1	62%	0.62	53%	0.528	S	S	*	.	S	Bend	trans	-118.1	85.5	-172.6	47.7	0	0	0	0	112.2	E988	T986-E988 VanDerWaalsContact C-N 3.3Å; T986-E988 PolarHBondContact O-N 2.84Å
987	N	30.7	Very low	29.7	Very low	160 Å²	160	99.9 Å²	99.9	86%	0.856	53%	0.528	S	S	*	.	S	Bend	trans	43.3	-19.9	156.4	-68.6	-17.2	0	0	0	124	F989	N987-F989 PolarHBondContact O-N 2.79Å
988	E	32.4	Very low	29.7	Very low	148 Å²	148	100.4 Å²	100.4	69%	0.692	53%	0.532	S	S	*	.	G	3₁₀ helix	trans	-69.2	-18.2	-174.2	-67.3	-168.4	127.1	0	0	114.1	T986 Q990 T991	T986-E988 VanDerWaalsContact C-N 3.3Å; T986-E988 PolarHBondContact O-N 2.84Å; E988-Q990 PolarHBondContact O-N 3.48Å; E988-T991 PolarHBondContact O-N 2.86Å; E988-T991 PolarHBondContact O-OG1 2.92Å; E988-T991 VanDerWaalsContact O-OG1 3.05Å
989	F	32.3	Very low	29.7	Very low	111 Å²	111	101.5 Å²	101.5	49%	0.487	54%	0.544	S	S	.	.	G	3₁₀ helix	trans	-64.8	1.1	-177.8	-107.7	-79.6	0	0	0	116.3	N987	N987-F989 PolarHBondContact O-N 2.79Å
990	Q	33.6	Very low	29.7	Very low	161 Å²	161	102.5 Å²	102.5	75%	0.752	56%	0.557	S	S	*	*	G	3₁₀ helix	trans	-94.4	-20.2	173.5	-75.9	-165.1	-13.6	0	0	114.7	E988	E988-Q990 PolarHBondContact O-N 3.48Å
991	T	30.3	Very low	29.6	Very low	101 Å²	101	107 Å²	107	62%	0.62	58%	0.575	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.2	-43.5	-178.6	49.6	0	0	0	0	112	E988 L993 K994	E988-T991 PolarHBondContact O-N 2.86Å; E988-T991 PolarHBondContact O-OG1 2.92Å; E988-T991 VanDerWaalsContact O-OG1 3.05Å; T991-L993 PolarHBondContact O-N 3.43Å; T991-K994 PolarHBondContact O-N 3.5Å
992	S	31.3	Very low	29.6	Very low	55 Å²	55	110.7 Å²	110.7	39%	0.385	60%	0.597	S	S	.	*	H	α-helix	trans	-59.5	-44.3	178.2	55.3	0	0	0	0	112.9	K994 N995 V996	S992-K994 VanDerWaalsContact C-N 3.29Å; S992-K994 PolarHBondContact O-N 3.29Å; S992-N995 PolarHBondContact O-N 3.32Å; S992-N995 VanDerWaalsContact O-N 3.12Å; S992-V996 PolarHBondContact O-N 3.41Å
993	L	31.6	Very low	29.4	Very low	110 Å²	110	113.9 Å²	113.9	58%	0.576	61%	0.612	S	S	*	*	H	α-helix	trans	-61.9	-31.6	-177.9	-99	167.8	0	0	0	113.8	T991 S997	T991-L993 PolarHBondContact O-N 3.43Å; L993-S997 VanDerWaalsContact O-CB 3.27Å; L993-S997 WeakPolarHBondContact O-CB 3.33Å; L993-S997 PolarHBondContact O-N 3.2Å; L993-S997 PolarHBondContact O-OG 3.27Å; L993-S997 VanDerWaalsContact O-OG 3.13Å
994	K	32	Very low	29.1	Very low	155 Å²	155	114 Å²	114	67%	0.674	63%	0.625	S	S	*	*	H	α-helix	trans	-66.8	-41.7	174.5	-86.3	-170.5	170.3	-172.9	0	112	T991 S992 S997 S998	T991-K994 PolarHBondContact O-N 3.5Å; S992-K994 VanDerWaalsContact C-N 3.29Å; S992-K994 PolarHBondContact O-N 3.29Å; K994-S997 WeakPolarHBondContact CA-OG 3.24Å; K994-S997 PolarHBondContact O-N 2.92Å; K994-S997 PolarHBondContact O-OG 2.82Å; K994-S998 PolarHBondContact O-N 2.86Å; K994-S998 PolarHBondContact O-OG 3.03Å
995	N	28.5	Very low	28.9	Very low	119 Å²	119	114.6 Å²	114.6	64%	0.636	63%	0.634	S	S	*	*	H	α-helix	trans	-74.6	-34.1	-177.1	-65.4	7.9	0	0	0	111.7	S992 S998 A999	S992-N995 PolarHBondContact O-N 3.32Å; S992-N995 VanDerWaalsContact O-N 3.12Å; N995-S998 WeakPolarHBondContact CA-OG 3.15Å; N995-S998 PolarHBondContact O-N 2.87Å; N995-S998 PolarHBondContact O-OG 2.86Å; N995-S998 VanDerWaalsContact O-OG 3.09Å; N995-A999 PolarHBondContact O-N 3.31Å
996	V	29.7	Very low	28.7	Very low	87 Å²	87	116 Å²	116	53%	0.527	65%	0.647	S	S	.	*	H	α-helix	trans	-71.3	-36.5	171.6	179.9	0	0	0	0	111.4	S992 S998 A999 L1000	S992-V996 PolarHBondContact O-N 3.41Å; V996-S998 PolarHBondContact O-N 3.16Å; V996-A999 PolarHBondContact O-N 2.84Å; V996-L1000 PolarHBondContact O-N 3.23Å
997	S	28.7	Very low	28.6	Very low	81 Å²	81	119.9 Å²	119.9	57%	0.566	66%	0.655	S	S	*	*	H	α-helix	trans	-68.4	-17.8	176	69.6	0	0	0	0	114.6	L993 K994	L993-S997 VanDerWaalsContact O-CB 3.27Å; L993-S997 WeakPolarHBondContact O-CB 3.33Å; L993-S997 PolarHBondContact O-N 3.2Å; L993-S997 PolarHBondContact O-OG 3.27Å; L993-S997 VanDerWaalsContact O-OG 3.13Å; K994-S997 WeakPolarHBondContact CA-OG 3.24Å; K994-S997 PolarHBondContact O-N 2.92Å; K994-S997 PolarHBondContact O-OG 2.82Å
998	S	26.5	Very low	28.4	Very low	77 Å²	77	120.3 Å²	120.3	54%	0.538	66%	0.657	S	S	.	*	H	α-helix	trans	-95.7	-18.4	174.2	38.3	0	0	0	0	113.3	K994 N995 V996 L1000	K994-S998 PolarHBondContact O-N 2.86Å; K994-S998 PolarHBondContact O-OG 3.03Å; N995-S998 WeakPolarHBondContact CA-OG 3.15Å; N995-S998 PolarHBondContact O-N 2.87Å; N995-S998 PolarHBondContact O-OG 2.86Å; N995-S998 VanDerWaalsContact O-OG 3.09Å; V996-S998 PolarHBondContact O-N 3.16Å; S998-L1000 VanDerWaalsContact C-N 3.31Å
999	A	27	Very low	28.3	Very low	79 Å²	79	120.5 Å²	120.5	65%	0.653	66%	0.663	S	S	*	*	H	α-helix	trans	-78.9	-12.6	171.1	0	0	0	0	0	113.6	N995 V996	N995-A999 PolarHBondContact O-N 3.31Å; V996-A999 PolarHBondContact O-N 2.84Å
1000	L	27.3	Very low	28.1	Very low	133 Å²	133	123.8 Å²	123.8	70%	0.696	68%	0.677	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.4	31.6	175.3	-73.3	169.9	0	0	0	113	V996 S998 L1002	V996-L1000 PolarHBondContact O-N 3.23Å; S998-L1000 VanDerWaalsContact C-N 3.31Å; L1000-L1002 PolarHBondContact O-N 3.19Å
1001	H	26.1	Very low	27.9	Very low	144 Å²	144	125.6 Å²	125.6	67%	0.667	69%	0.685	S	S	*	*			trans	-89.7	75.5	161.6	-125	-85.8	0	0	0	109.1	D1003	H1001-D1003 VanDerWaalsContact C-N 3.28Å; H1001-D1003 IonicContact CE1-OD1 3.09Å; H1001-D1003 IonicContact CG-OD1 2.72Å; H1001-D1003 IonicContact ND1-OD1 2.65Å; H1001-D1003 PolarHBondContact ND1-OD1 3.2Å; H1001-D1003 PolarHBondContact O-N 3.49Å; H1001-D1003 VanDerWaalsContact O-N 3.11Å
1002	L	27.1	Very low	27.9	Very low	155 Å²	155	129.8 Å²	129.8	81%	0.812	70%	0.695	S	S	*	*			trans	-79.9	83.9	167.2	-81.7	173.1	0	0	0	108.7	L1000 C1004	L1000-L1002 PolarHBondContact O-N 3.19Å; L1002-C1004 PolarHBondContact O-N 2.79Å
1003	D	23.3	Very low	27.8	Very low	127 Å²	127	135.6 Å²	135.6	68%	0.679	71%	0.713	S	S	*	*			trans	-62.4	106.4	170.7	-64.1	-26.3	0	0	0	108.7	H1001 P1005	H1001-D1003 VanDerWaalsContact C-N 3.28Å; H1001-D1003 IonicContact CE1-OD1 3.09Å; H1001-D1003 IonicContact CG-OD1 2.72Å; H1001-D1003 IonicContact ND1-OD1 2.65Å; H1001-D1003 PolarHBondContact ND1-OD1 3.2Å; H1001-D1003 PolarHBondContact O-N 3.49Å; H1001-D1003 VanDerWaalsContact O-N 3.11Å; D1003-P1005 VanDerWaalsContact C-CD 3.44Å; D1003-P1005 VanDerWaalsContact O-CD 3.25Å; D1003-P1005 WeakPolarHBondContact O-CD 3.38Å
1004	C	25.7	Very low	27.7	Very low	102 Å²	102	139.9 Å²	139.9	69%	0.689	73%	0.728	S	S	*	*			trans	-118.2	74.2	-178.5	-162	0	0	0	0	110.4	L1002 T1006	L1002-C1004 PolarHBondContact O-N 2.79Å; C1004-T1006 PolarHBondContact O-N 3.28Å
1005	P	24	Very low	27.8	Very low	119 Å²	119	142 Å²	142	77%	0.773	74%	0.737	S	S	*	*			trans	-81.6	42.4	-166.8	36.2	-39.7	0	0	0	114.2	D1003	D1003-P1005 VanDerWaalsContact C-CD 3.44Å; D1003-P1005 VanDerWaalsContact O-CD 3.25Å; D1003-P1005 WeakPolarHBondContact O-CD 3.38Å
1006	T	25.7	Very low	27.9	Very low	111 Å²	111	142 Å²	142	68%	0.681	74%	0.743	S	S	*	*			trans	-156.9	93.2	179.4	17.8	0	0	0	0	111.9	C1004	C1004-T1006 PolarHBondContact O-N 3.28Å
1007	F	27.7	Very low	27.9	Very low	183 Å²	183	145 Å²	145	80%	0.803	76%	0.757	S	S	*	*			trans	-150.9	33.9	163.5	-124.8	-76.1	0	0	0	114.6
1008	D	26.2	Very low	27.8	Very low	168 Å²	168	151.4 Å²	151.4	90%	0.898	77%	0.768	S	S	*	*	S	Bend	trans	-109	26.2	-174.5	-146.5	5.6	0	0	0	113
1009	L	29	Very low	28	Very low	153 Å²	153	154.9 Å²	154.9	80%	0.801	78%	0.776	S	S	*	*	S	Bend	trans	-133.3	-1.5	-164	-125.2	129.7	0	0	0	116.6
1010	F	28.9	Very low	28.1	Very low	180 Å²	180	159.5 Å²	159.5	79%	0.789	78%	0.782	S	S	*	*			trans	-114.9	18.9	-175.3	-89.1	-78.8	0	0	0	115.6
1011	Q	29.5	Very low	28.2	Very low	199 Å²	199	158.8 Å²	158.8	93%	0.93	79%	0.785	S	S	*	*	S	Bend	trans	-95	11.9	174.9	-73.4	-162.7	-0.5	0	0	115.2
1012	K	29.2	Very low	28.3	Very low	188 Å²	188	155.6 Å²	155.6	82%	0.817	78%	0.779	S	S	*	*	S	Bend	trans	-136.4	124.1	179	-77.1	-179.4	177.3	171.9	0	112.4
1013	K	29.2	Very low	28.5	Very low	177 Å²	177	154 Å²	154	77%	0.77	78%	0.775	S	S	*	*			trans	70.4	139.9	-174.7	-40.4	168.7	-174.5	176.2	0	111.3
1014	F	30.9	Very low	28.9	Very low	200 Å²	200	154.4 Å²	154.4	88%	0.877	78%	0.776	S	S	*	*			cis	-125.3	177.6	11.2	-87.1	-88.2	0	0	0	113.7
1015	K	33	Very low	29.1	Very low	199 Å²	199	156 Å²	156	87%	0.865	77%	0.774	S	S	*	*			trans	-82.1	154.7	-179.2	-71.3	178.6	177.1	177.6	0	112.1
1016	P	30.6	Very low	29.3	Very low	120 Å²	120	154.4 Å²	154.4	78%	0.779	77%	0.766	S	S	*	*			trans	-79.1	145.6	174.8	33.3	-35.3	0	0	0	112.3
1017	N	30	Very low	29.4	Very low	151 Å²	151	154.8 Å²	154.8	81%	0.807	76%	0.763	S	S	*	*			trans	-160	141.8	153	-107.5	-22.4	0	0	0	109.7
1018	R	27.9	Very low	29.5	Very low	214 Å²	214	149.4 Å²	149.4	81%	0.808	75%	0.748	S	S	*	*			trans	9	127.7	153.4	-60.9	174.7	-176.8	172.7	-1.4	116.1
1019	E	29.4	Very low	29.5	Very low	151 Å²	151	149 Å²	149	71%	0.706	74%	0.743	S	S	*	*			cis	-170.5	163.9	45.9	-125.6	153.9	-112.6	0	0	113
1020	K	29.4	Very low	29.5	Very low	176 Å²	176	147.1 Å²	147.1	77%	0.765	74%	0.737	S	S	*	*			trans	60.3	104.1	166.4	-62.6	168.7	-172.8	169.1	0	117	S1022	K1020-S1022 PolarHBondContact O-N 3.49Å
1021	P	28.7	Very low	29.4	Very low	117 Å²	117	142 Å²	142	76%	0.76	73%	0.728	S	S	*	*			trans	-69.7	126.8	175.2	29.9	-33.5	0	0	0	110.9
1022	S	29	Very low	29.3	Very low	78 Å²	78	139.1 Å²	139.1	55%	0.545	72%	0.718	S	S	.	*			trans	-86.8	154.6	176.4	72.6	0	0	0	0	111.6	K1020 L1024 E1025	K1020-S1022 PolarHBondContact O-N 3.49Å; S1022-L1024 PolarHBondContact O-N 2.72Å; S1022-E1025 PolarHBondContact O-N 2.64Å; S1022-E1025 VanDerWaalsContact O-N 3.15Å
1023	V	31.1	Very low	29.1	Very low	121 Å²	121	135.5 Å²	135.5	73%	0.733	71%	0.714	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64	1.9	-170.5	-176.1	0	0	0	0	114.3	S1026	V1023-S1026 PolarHBondContact O-OG 3.43Å
1024	L	31.3	Very low	29	Very low	135 Å²	135	131.3 Å²	131.3	71%	0.707	71%	0.706	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86	-22.4	175.1	-75.9	158.4	0	0	0	113.6	S1022 L1027	S1022-L1024 PolarHBondContact O-N 2.72Å; L1024-L1027 PolarHBondContact O-N 3.13Å
1025	E	30.1	Very low	28.7	Very low	137 Å²	137	129.8 Å²	129.8	64%	0.64	71%	0.706	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.3	-20.2	-176.2	-160.2	161.4	-140.8	0	0	113.1	S1022 L1027 S1028	S1022-E1025 PolarHBondContact O-N 2.64Å; S1022-E1025 VanDerWaalsContact O-N 3.15Å; E1025-L1027 VanDerWaalsContact C-N 3.33Å; E1025-S1028 PolarHBondContact O-OG 2.8Å; E1025-S1028 VanDerWaalsContact O-OG 3.05Å
1026	S	28.1	Very low	28.5	Very low	85 Å²	85	126.7 Å²	126.7	59%	0.594	70%	0.698	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.5	-10.5	170.9	50.2	0	0	0	0	114	V1023	V1023-S1026 PolarHBondContact O-OG 3.43Å
1027	L	29	Very low	28.3	Very low	119 Å²	119	127 Å²	127	62%	0.623	70%	0.699	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.4	-12.5	177.3	-84	162.9	0	0	0	113.8	L1024 E1025	L1024-L1027 PolarHBondContact O-N 3.13Å; E1025-L1027 VanDerWaalsContact C-N 3.33Å
1028	S	28.2	Very low	28.2	Very low	69 Å²	69	126.6 Å²	126.6	48%	0.483	70%	0.697	S	S	.	*	T	Hydrogen-bonded Turn	trans	-85.6	-23.5	179.6	60.1	0	0	0	0	113.8	E1025	E1025-S1028 PolarHBondContact O-OG 2.8Å; E1025-S1028 VanDerWaalsContact O-OG 3.05Å
1029	M	27.7	Very low	28.2	Very low	161 Å²	161	126.7 Å²	126.7	79%	0.793	70%	0.697	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.2	-8.3	-174.2	-77.8	-63.3	-62.5	0	0	115.5
1030	T	28.7	Very low	28.1	Very low	112 Å²	112	125 Å²	125	69%	0.687	70%	0.699	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.6	3.6	-176.9	46.4	0	0	0	0	114.2
1031	A	27.3	Very low	27.8	Very low	72 Å²	72	127.4 Å²	127.4	60%	0.595	70%	0.703	S	S	*	*	S	Bend	trans	-112.8	20.1	-170.4	0	0	0	0	0	115.5
1032	L	26.2	Very low	27.8	Very low	139 Å²	139	129 Å²	129	73%	0.728	70%	0.704	S	S	*	*			trans	-133.5	89.2	-177.6	-76.2	174.9	0	0	0	115.3
1033	P	25.2	Very low	27.7	Very low	112 Å²	112	133.7 Å²	133.7	73%	0.727	72%	0.717	S	S	*	*	S	Bend	trans	-113.1	27.5	154.5	38.4	-30.7	0	0	0	111.9
1034	C	26.5	Very low	27.5	Very low	89 Å²	89	133.2 Å²	133.2	60%	0.601	72%	0.72	S	S	*	*	S	Bend	trans	-131.9	148.2	-177.2	-65.5	0	0	0	0	110.6
1035	L	25.6	Very low	27.3	Very low	168 Å²	168	134.3 Å²	134.3	88%	0.88	73%	0.726	S	S	*	*	S	Bend	trans	75.3	40.3	172.2	-52.5	175.8	0	0	0	119
1036	I	29	Very low	27.2	Very low	135 Å²	135	132.6 Å²	132.6	69%	0.692	74%	0.735	S	S	*	*			trans	-128.8	116.1	150.1	-44.4	179.3	0	0	0	111	L1038	I1036-L1038 HydrophobicContact CB-CG 4.35Å; I1036-L1038 HydrophobicContact CG2-CD2 3.74Å; I1036-L1038 HydrophobicContact CG2-CG 3.67Å; I1036-L1038 PolarHBondContact O-N 3.41Å
1037	P	25.9	Very low	27.1	Very low	125 Å²	125	131.5 Å²	131.5	81%	0.812	73%	0.725	S	S	*	*			trans	-81.5	66.7	171.1	34.7	-34.4	0	0	0	110.6	R1039	P1037-R1039 PolarHBondContact O-N 3Å
1038	L	27.6	Very low	27	Very low	143 Å²	143	130.7 Å²	130.7	75%	0.749	72%	0.721	S	S	*	*			trans	-63.8	102.5	171.1	-70.4	-177.1	0	0	0	109.3	I1036 P1040	I1036-L1038 HydrophobicContact CB-CG 4.35Å; I1036-L1038 HydrophobicContact CG2-CD2 3.74Å; I1036-L1038 HydrophobicContact CG2-CG 3.67Å; I1036-L1038 PolarHBondContact O-N 3.41Å; L1038-P1040 WeakPolarHBondContact O-CD 3.38Å
1039	R	28.1	Very low	26.8	Very low	216 Å²	216	132.4 Å²	132.4	82%	0.815	73%	0.725	S	S	*	*			trans	-57.9	125.6	167.1	-78.6	176	166.3	158	-5.8	108.8	P1037 R1041	P1037-R1039 PolarHBondContact O-N 3Å; R1039-R1041 VanDerWaalsContact C-N 3.31Å; R1039-R1041 PolarHBondContact O-N 3.39Å
1040	P	27.2	Very low	27	Very low	116 Å²	116	133 Å²	133	75%	0.753	73%	0.728	S	S	*	*			trans	-65.7	97.3	157.2	-10.5	26.5	0	0	0	107.4	L1038 I1042	L1038-P1040 WeakPolarHBondContact O-CD 3.38Å; P1040-I1042 PolarHBondContact O-N 2.91Å
1041	R	24.2	Very low	27	Very low	226 Å²	226	133.5 Å²	133.5	85%	0.853	73%	0.731	S	S	*	*			trans	-79.5	79.1	157.9	-91.5	-178	164.8	158.2	-8.5	106.9	R1039	R1039-R1041 VanDerWaalsContact C-N 3.31Å; R1039-R1041 PolarHBondContact O-N 3.39Å
1042	I	27.3	Very low	27	Very low	151 Å²	151	135.1 Å²	135.1	77%	0.774	74%	0.738	S	S	*	*			trans	-107.3	130.5	159.1	-60	-179.4	0	0	0	105.3	P1040	P1040-I1042 PolarHBondContact O-N 2.91Å
1043	Q	27.7	Very low	27.3	Very low	176 Å²	176	136.5 Å²	136.5	82%	0.822	74%	0.744	S	S	*	*	P	Polyproline II helix	trans	-69.6	142.3	-175.8	-72.4	141.2	-73.3	0	0	110
1044	S	26.3	Very low	27.4	Very low	112 Å²	112	137.9 Å²	137.9	78%	0.783	75%	0.746	S	S	*	*	P	Polyproline II helix	trans	-76	132.9	158.8	53.1	0	0	0	0	108.2
1045	D	26.6	Very low	27.6	Very low	158 Å²	158	142 Å²	142	85%	0.845	76%	0.756	S	S	*	*	P	Polyproline II helix	trans	-56.8	137.2	-170.3	-51.7	-81.5	0	0	0	113.5
1046	A	28.8	Very low	27.6	Very low	100 Å²	100	141.7 Å²	141.7	83%	0.826	75%	0.75	S	S	*	*			trans	-106.9	122.2	157.7	0	0	0	0	0	106.6
1047	T	26.2	Very low	27.6	Very low	63 Å²	63	143.2 Å²	143.2	39%	0.387	75%	0.752	S	S	.	*			trans	-67.8	148.5	-178	53.9	0	0	0	0	111.5
1048	N	26.1	Very low	27.8	Very low	101 Å²	101	144 Å²	144	54%	0.54	75%	0.748	S	S	.	*				171.1	134.5	118.5	-88.2	14.1	0	0	0	113.6	K716	K716-N1048 WeakPolarHBondContact CD-OD1 3.46Å; K716-N1048 WeakPolarHBondContact CE-OD1 3.46Å
1049	D	25.6	Very low	28	Very low	106 Å²	106	141 Å²	141	57%	0.567	75%	0.751	S	S	*	*			trans	62.3	103.6	136.5	-49.4	-28.9	0	0	0	121.7	K716	K716-D1049 WeakPolarHBondContact CE-OD1 3.26Å; K716-D1049 IonicContact NZ-OD1 2.99Å; K716-D1049 PolarHBondContact NZ-OD1 3.11Å; K716-D1049 IonicContact NZ-OD2 2.67Å; K716-D1049 PolarHBondContact NZ-OD2 3.19Å
1050	M	31.6	Very low	28.1	Very low	172 Å²	172	142.2 Å²	142.2	85%	0.847	76%	0.756	S	S	*	*			trans	162.2	85.9	133.4	-85.2	-95.5	144.4	0	0	109.2
1051	T	27.4	Very low	28	Very low	123 Å²	123	148.1 Å²	148.1	76%	0.755	76%	0.763	S	S	*	*				69.5	116.4	94.1	56.8	0	0	0	0	115.7
1052	S	27.4	Very low	28.3	Very low	107 Å²	107	142.5 Å²	142.5	75%	0.748	76%	0.756	S	S	*	*			trans	-83.7	155.2	178	51.8	0	0	0	0	114.3
1053	I	32.9	Very low	28.3	Very low	167 Å²	167	144 Å²	144	86%	0.856	76%	0.76	S	S	*	*			trans	-132.6	146.8	152.7	-56.6	-176.8	0	0	0	107.4
1054	N	26.6	Very low	28.4	Very low	142 Å²	142	147.2 Å²	147.2	76%	0.759	76%	0.764	S	S	*	*			trans	-75.7	-179.3	175.6	-55.9	-41.4	0	0	0	109.7
1055	E	32.2	Very low	28.4	Very low	174 Å²	174	150.3 Å²	150.3	81%	0.813	76%	0.763	S	S	*	*			cis	-148.1	139.7	49.3	-75.7	159.8	175.5	0	0	107.9
1056	E	26.1	Very low	28.4	Very low	163 Å²	163	151.6 Å²	151.6	76%	0.762	76%	0.762	S	S	*	*				50.7	108.9	80.2	-158.5	-179	-170.2	0	0	113.7
1057	F	28.1	Very low	28.4	Very low	167 Å²	167	155.4 Å²	155.4	73%	0.732	76%	0.762	S	S	*	*				-178.3	126.3	122.5	-114	-117.1	0	0	0	113
1058	I	30.5	Very low	28.6	Very low	142 Å²	142	157.5 Å²	157.5	73%	0.728	78%	0.779	S	S	*	*			trans	29.8	123.1	140.9	-49	-176.6	0	0	0	119.9
1059	G	31.5	Very low	28.6	Very low	78 Å²	78	160 Å²	160	80%	0.804	79%	0.793	S	S	*	*			trans	-166.4	109.6	161.7	0	0	0	0	0	114.5
1060	R	29.2	Very low	28.9	Very low	242 Å²	242	161.9 Å²	161.9	91%	0.913	80%	0.802	S	S	*	*			trans	-88.5	159.6	-178	-62.2	174.6	179.1	179.5	-0.6	112.5
1061	R	26.7	Very low	28.8	Very low	240 Å²	240	160.2 Å²	160.2	91%	0.906	80%	0.797	S	S	*	*			trans	-6.9	152.5	152.2	-68.1	179.2	177.2	173.8	-2.5	117.7
1062	P	29.4	Very low	28.9	Very low	109 Å²	109	161.1 Å²	161.1	71%	0.708	80%	0.797	S	S	*	*			cis	-142.1	-173.7	29.3	42.5	-24.3	0	0	0	116.3
1063	E	27.6	Very low	28.9	Very low	182 Å²	182	162.5 Å²	162.5	85%	0.85	79%	0.794	S	S	*	*			trans	-59.4	134.9	155.6	-55.4	171.3	142.7	0	0	110.8
1064	R	29.1	Very low	28.9	Very low	244 Å²	244	163.5 Å²	163.5	92%	0.921	79%	0.792	S	S	*	*			trans	-158	154.8	150.7	-110.7	161.9	-164.9	-159.1	1	110.6
1065	K	27.5	Very low	28.9	Very low	176 Å²	176	163.6 Å²	163.6	77%	0.765	79%	0.792	S	S	*	*			trans	-91.2	175.4	-162.3	-67.1	-179.2	179.5	-177.9	0	113.7
1066	F	26.1	Very low	28.8	Very low	185 Å²	185	161.2 Å²	161.2	81%	0.811	78%	0.784	S	S	*	*			trans	86.8	103.6	157.8	-56	-69.2	0	0	0	117.6
1067	H	29.6	Very low	29	Very low	181 Å²	181	159.5 Å²	159.5	84%	0.838	78%	0.78	S	S	*	*	S	Bend	trans	-88.7	147.7	133.9	-96.1	-83	0	0	0	109.1
1068	S	28.7	Very low	29.2	Very low	106 Å²	106	159 Å²	159	74%	0.741	78%	0.778	S	S	*	*			trans	44.3	94.7	158.8	58.4	0	0	0	0	117.9
1069	D	27.8	Very low	29.1	Very low	155 Å²	155	160.6 Å²	160.6	83%	0.829	78%	0.775	S	S	*	*				-154.3	158.5	120.2	-115	-31.3	0	0	0	111.6
1070	L	31.1	Very low	29	Very low	144 Å²	144	165.8 Å²	165.8	75%	0.754	77%	0.77	S	S	*	*			trans	60.2	98.4	166.3	-64.9	163.4	0	0	0	119.8
1071	N	29.3	Very low	29.2	Very low	137 Å²	137	160.9 Å²	160.9	73%	0.733	76%	0.762	S	S	*	*				39.5	150.5	118.3	-63.8	-21.4	0	0	0	123.1
1072	N	30.7	Very low	29.5	Very low	142 Å²	142	153.8 Å²	153.8	76%	0.759	75%	0.749	S	S	*	*			trans	84.6	102.6	172.7	-54.5	-32.5	0	0	0	114.9
1073	I	27.2	Very low	29.5	Very low	136 Å²	136	156.9 Å²	156.9	70%	0.697	76%	0.756	S	S	*	*				89.9	123.2	54	-69.4	167.7	0	0	0	112.5
1074	K	31.4	Very low	29.7	Very low	188 Å²	188	153.2 Å²	153.2	82%	0.817	75%	0.746	S	S	*	*			trans	69.3	156.7	167.9	-73.4	167.2	-174.3	176.9	0	117.1
1075	L	27	Very low	29.9	Very low	144 Å²	144	146.9 Å²	146.9	75%	0.754	74%	0.735	S	S	*	*			cis	-172.5	-178.2	-30.9	-156.6	66.8	0	0	0	107.9
1076	I	31.3	Very low	30	Very low	124 Å²	124	144.5 Å²	144.5	64%	0.636	73%	0.73	S	S	*	*			trans	80.5	114.2	155.6	-63.2	151.1	0	0	0	117.2	F1078	I1076-F1078 HydrophobicContact CG2-CE2 4.42Å
1077	D	30.1	Very low	30.2	Very low	127 Å²	127	141.4 Å²	141.4	68%	0.679	72%	0.722	S	S	*	*				32.3	150.7	124	-41.2	-38.4	0	0	0	120
1078	F	32.1	Very low	30.1	Very low	157 Å²	157	142 Å²	142	69%	0.689	72%	0.722	S	S	*	*			cis	-140.9	140.9	37	-85.6	-112.4	0	0	0	110.6	I1076	I1076-F1078 HydrophobicContact CG2-CE2 4.42Å
1079	R	28.8	Very low	29.9	Very low	176 Å²	176	142.2 Å²	142.2	66%	0.664	72%	0.724	S	S	*	*				71.9	90.9	52	-168.5	-144	-167.6	-178.3	7.6	113.9
1080	R	28.9	Very low	29.7	Very low	186 Å²	186	140.5 Å²	140.5	70%	0.702	72%	0.719	S	S	*	*				173.4	146.7	123	-101.6	176.7	172.6	137	-4.8	115.2
1081	N	33.7	Very low	29.4	Very low	140 Å²	140	140.1 Å²	140.1	75%	0.749	72%	0.716	S	S	*	*			trans	68.8	135.2	154.7	-56.9	-0.8	0	0	0	118.7
1082	S	31.8	Very low	29.1	Very low	90 Å²	90	140 Å²	140	63%	0.629	71%	0.714	S	S	*	*			cis	-168.4	136	-14	45.7	0	0	0	0	111.7
1083	M	29.1	Very low	28.8	Very low	175 Å²	175	144.3 Å²	144.3	86%	0.862	72%	0.721	S	S	*	*			trans	68.1	145.3	146.8	-67.4	174.7	76	0	0	116.6
1084	V	33	Very low	28.7	Very low	104 Å²	104	140.6 Å²	140.6	63%	0.63	72%	0.717	S	S	*	*			cis	-153.6	135.9	4.3	86.3	0	0	0	0	111.3
1085	T	32.9	Very low	28.5	Very low	112 Å²	112	139.8 Å²	139.8	69%	0.687	72%	0.72	S	S	*	*			trans	46.6	151.8	150	55.3	0	0	0	0	123.1
1086	N	28.7	Very low	28.5	Very low	125 Å²	125	140 Å²	140	67%	0.668	72%	0.717	S	S	*	*			cis	-165.8	179.5	-24.8	-116.5	32.2	0	0	0	108.3
1087	D	30.4	Very low	28.3	Very low	121 Å²	121	140.3 Å²	140.3	65%	0.647	71%	0.714	S	S	*	*			trans	22.1	115.3	147	-48.8	-38.9	0	0	0	118.8
1088	K	28.1	Very low	28.3	Very low	192 Å²	192	141.6 Å²	141.6	84%	0.835	72%	0.72	S	S	*	*				58.3	129.9	69.5	-68	-176.2	174.8	174.8	0	115
1089	S	24.5	Very low	27.8	Very low	111 Å²	111	140 Å²	140	78%	0.776	72%	0.718	S	S	*	*			trans	84.2	153.6	162.3	88.2	0	0	0	0	118
1090	V	24.1	Very low	27.6	Very low	119 Å²	119	142.2 Å²	142.2	72%	0.721	73%	0.726	S	S	*	*			trans	72.2	105.4	147.3	170.4	0	0	0	0	119.7
1091	I	23.5	Very low	27.5	Very low	137 Å²	137	140.5 Å²	140.5	70%	0.703	73%	0.73	S	S	*	*				65.7	111.7	128.5	-59.2	-178.7	0	0	0	120.7
1092	I	23.2	Very low	27	Very low	134 Å²	134	139.2 Å²	139.2	69%	0.687	73%	0.727	S	S	*	*				43.2	134.6	126.5	-42.6	175.9	0	0	0	120.6
1093	Y	24.3	Very low	26.6	Very low	232 Å²	232	143.6 Å²	143.6	91%	0.91	74%	0.735	S	S	*	*			trans	83.1	119.7	160.6	-78.6	-54.4	0	0	0	120
1094	G	25.3	Very low	26.4	Very low	59 Å²	59	140.1 Å²	140.1	61%	0.608	72%	0.724	S	S	*	*				152.9	137.8	119.3	0	0	0	0	0	118
1095	I	27	Very low	26	Very low	171 Å²	171	143.9 Å²	143.9	88%	0.877	73%	0.728	S	S	*	*			trans	72.1	132.6	144.6	-52.4	166.4	0	0	0	117
1096	E	27.3	Very low	25.9	Very low	147 Å²	147	148.4 Å²	148.4	69%	0.687	73%	0.734	S	S	*	*			cis	-173.9	178.2	-29.7	-129.8	-163.4	173.2	0	0	107.9
1097	K	27.5	Very low	25.9	Very low	132 Å²	132	147.3 Å²	147.3	57%	0.574	73%	0.731	S	S	*	*			cis	-157.7	124	-3.3	-164.1	-178.5	-149.7	102	0	109.5	I1099	K1097-I1099 HydrophobicContact CD-CD1 4.38Å; K1097-I1099 HydrophobicContact CG-CD1 3.96Å
1098	N	29.2	Very low	25.8	Very low	153 Å²	153	148.1 Å²	148.1	82%	0.818	74%	0.736	S	S	*	*			trans	168.6	106.8	154.6	-91.6	-29.9	0	0	0	108.6
1099	I	23.5	Very low	26.1	Very low	124 Å²	124	144.1 Å²	144.1	64%	0.636	73%	0.727	S	S	*	*				68.8	95.4	55.1	-50.6	167.7	0	0	0	112.8	K1097	K1097-I1099 HydrophobicContact CD-CD1 4.38Å; K1097-I1099 HydrophobicContact CG-CD1 3.96Å
1100	R	24.4	Very low	26.4	Very low	222 Å²	222	146.6 Å²	146.6	84%	0.838	72%	0.724	S	S	*	*				-179.2	121	122.1	-98.2	-172.9	179.1	-177.1	0.7	113.1
1101	L	25.3	Very low	26.7	Very low	150 Å²	150	147.8 Å²	147.8	79%	0.785	72%	0.72	S	S	*	*			trans	55.8	160.9	146.2	-77.9	86	0	0	0	121.2
1102	V	23.6	Very low	27.1	Very low	114 Å²	114	148.1 Å²	148.1	69%	0.691	72%	0.719	S	S	*	*			cis	177.2	141.6	-42.6	129.2	0	0	0	0	108.9
1103	K	24.1	Very low	27.7	Very low	182 Å²	182	149 Å²	149	79%	0.791	72%	0.723	S	S	*	*			trans	70.8	120	160.1	-83.5	171.7	179.8	-178.3	0	122.5
1104	T	24.3	Very low	28.3	Very low	102 Å²	102	143.5 Å²	143.5	63%	0.626	72%	0.716	S	S	*	*				91.5	135.7	122.2	53	0	0	0	0	125.2
1105	Y	25.6	Very low	28.8	Very low	182 Å²	182	146.2 Å²	146.2	71%	0.714	73%	0.725	S	S	*	*			trans	65.5	130.5	159.2	-58.5	-57.7	0	0	0	117.4
1106	Y	30.1	Very low	29.1	Very low	208 Å²	208	147.3 Å²	147.3	82%	0.816	72%	0.724	S	S	*	*			cis	-145.6	170.5	7.5	-79	-80.9	0	0	0	109.3
1107	V	29.1	Very low	29.6	Very low	102 Å²	102	149.4 Å²	149.4	62%	0.618	73%	0.731	S	S	*	*			cis	-179.9	148.5	-42.2	126.2	0	0	0	0	108.5
1108	D	29	Very low	30.1	Very low	138 Å²	138	151.7 Å²	151.7	74%	0.738	74%	0.743	S	S	*	*			trans	58.8	145.1	165.5	-70.1	-0.8	0	0	0	120.6
1109	T	32.7	Very low	30.6	Very low	107 Å²	107	152.6 Å²	152.6	66%	0.656	74%	0.74	S	S	*	*			cis	-159.4	143.5	-0.7	20.7	0	0	0	0	113.2
1110	F	31	Very low	30.8	Very low	164 Å²	164	152.2 Å²	152.2	72%	0.719	77%	0.767	S	S	*	*			trans	81.6	105.7	135.2	-83.2	-130.3	0	0	0	125.6
1111	F	30.6	Very low	31.1	Very low	143 Å²	143	148.8 Å²	148.8	63%	0.627	76%	0.764	S	S	*	*				107.7	124.8	107.3	-92.9	-137.9	0	0	0	124.3
1112	E	31.2	Very low	31.4	Very low	144 Å²	144	148.7 Å²	148.7	67%	0.673	76%	0.762	S	S	*	*			trans	55	121.9	142.4	-61.2	-178.5	147.4	0	0	121.8
1113	I	36.1	Very low	31.8	Very low	153 Å²	153	150.6 Å²	150.6	79%	0.785	77%	0.766	S	S	*	*				70.9	115.8	51.6	-60.6	175.3	0	0	0	110.5
1114	P	37.2	Very low	32.3	Very low	117 Å²	117	148.8 Å²	148.8	76%	0.76	77%	0.765	S	S	*	*				-146.3	148.4	80.1	37.7	-19.3	0	0	0	118.3
1115	S	35.1	Very low	32.8	Very low	115 Å²	115	151.7 Å²	151.7	80%	0.804	77%	0.774	S	S	*	*			trans	-112.1	130.2	155.4	-73.3	0	0	0	0	108.8
1116	F	33.8	Very low	33.3	Very low	194 Å²	194	149.7 Å²	149.7	85%	0.851	78%	0.778	S	S	*	*			trans	-155.7	106.6	168.5	-110.5	-70.5	0	0	0	112.1
1117	K	38.5	Very low	33.5	Very low	192 Å²	192	145.5 Å²	145.5	84%	0.835	78%	0.775	S	S	*	*				174.1	114.3	111.8	-95	167.9	-178.7	177.4	0	111.3
1118	H	37.7	Very low	33.9	Very low	179 Å²	179	148.8 Å²	148.8	83%	0.829	79%	0.787	S	S	*	*			trans	-66.5	155.7	142.6	-114.6	-79	0	0	0	108.9
1119	K	39.1	Very low	34.3	Very low	172 Å²	172	149.8 Å²	149.8	75%	0.748	79%	0.791	S	S	*	*			trans	-117.8	149.4	143.3	-87.7	-160.8	133.7	-94	0	108.6
1120	G	28	Very low	34.4	Very low	117 Å²	117	153.6 Å²	153.6	100%	1.206	80%	0.803	S	S	*	*			cis	48.8	0	-16.8	0	0	0	0	0	118.3

Retrieved 1,120 of 1,120 residues in 920.6 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).