A0A5K4E8J8_SCHMA Loading...

Actin binding LIM protein family member 2-related

AlphaFold DB , UniProt , Accession A0A5K4E8J8, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 984 aa.

						>A0A5K4E8J8_SCHMA|A0A5K4E8J8
MVKVYCTVCHKRCKGDVLKIEQQFVHYKCFQCIKCCKNLKQGGFFVKDQNFYCPNDYQTQFGVRCETCQGYVEGEVVTVLGKTFHTHCFRCTTCRRLFNSGERTTIVDGSYYCMSCSSNLTNGDVLHKTVGSNNRDGSAAAATVTNGSNGVCSTSSSPSSNSPSSKSDQFNPLSLSTSGHQSQTLPTIRTSPTPIHHPVNHIDDSNTQNHNHYQQNLISDANLKSFPSLNDQLSVQIHENGCSIPGSEYHKQKLEEHGMGPVTIDTLLSTTPGQTISPNSFTPSACERRICPPGVDYGRQYPISYLQLAEQGFTAIMSSEELNPNMSNENIGHRSRSLARSNNFSSSHYTPSHQHVSRRDVVRSATSNSMPFRRLNDTELQKQVNGCSPSKLPSYSGTSISVGVSNTPISLTGRPKRDMYVRQRQLSPGSSSLGSGLMGFRRSERMNSSTLPPGLENIRQSTGRYSCRSTPNVTGKRGMTQLAESLVRPRVDRTASPPSATLYWSEARRLASFPNARLPDSNSLPAIDRYDFPAPPSPAVVMIDKRREKRMTGVQSIGVDSRNGTLRNGTMTSVDTDWTDRDPVLNAKLDRIDAEIETLKRLGESSGITAALIQELEASKLHVHETDLDPISASRSPNANVEPGYKTRYRRHGYTSPSRDTRRDRRSGHNLSYRLEYSSTGGRSGTIPSFPSTPRPGYTSGILYGRAVSLPRPFIGVENGDTLLDQSTLSGHVPVASSGIRGSLSTTLRTIPSRHSYHPGGHSNHSGEAINGPDRTVTVSESLNTNFIENESRPIGFHDGLGSLTTSGLSMDGFMAESGDDITITSPHNGYFLKSRTVAGLPSSVTGLRPVGLPPHHPYHHHHYKSSSSAMRRGRTSTPAPATGGSGMGYLTDPDLLDIDAYPSVQSWLRPIASSSKYEKSFKIYPYEVLKSSSNQLLKGVDRTQLECYLSTDEFERLFNMCPEAFQRLPEWKRNDLKKKLDLL
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	54.5	Low	81.9	Confident	243 Å²	243	101.4 Å²	101.4	100%	1.197	51%	0.507	S	S	*	.				0	131.1	0	-69.8	173.1	172.7	0	0	108.7
2	V	71.7	Confident	82.4	Confident	135 Å²	135	105.2 Å²	105.2	82%	0.818	51%	0.511	S	S	*	.			trans	-79.4	138.5	173.9	-179.2	0	0	0	0	109.1	V4	V2-V4 PolarHBondContact O-N 3.46Å
3	K	78.4	Confident	82.6	Confident	147 Å²	147	98.7 Å²	98.7	64%	0.639	48%	0.483	S	S	*	.			trans	-84.8	110.4	176.7	-68.9	172.6	-176.7	166.4	0	108.9	Y5	K3-Y5 HydrophobicContact CB-CE2 3.78Å; K3-Y5 VanDerWaalsContact O-CD2 3.27Å; K3-Y5 WeakPolarHBondContact O-CD2 3.47Å; K3-Y5 VanDerWaalsContact O-CE2 3.3Å; K3-Y5 WeakPolarHBondContact O-CE2 3.42Å
4	V	85.9	Confident	82.5	Confident	42 Å²	42	104.9 Å²	104.9	26%	0.255	51%	0.506	S	S	.	.			trans	-88.6	138.9	179.7	178.1	0	0	0	0	110.6	V2 R12 C13 V17 F24	V2-V4 PolarHBondContact O-N 3.46Å; V4-R12 WeakPolarHBondContact O-CA 3.49Å; V4-C13 HydrophobicContact CB-CB 4.44Å; V4-C13 HydrophobicContact CG1-CB 4.06Å; V4-C13 PolarHBondContact O-N 3.07Å; V4-V17 HydrophobicContact CG1-CG1 4.38Å; V4-F24 HydrophobicContact CG1-CB 3.42Å; V4-F24 VanDerWaalsContact CG1-CB 3.42Å; V4-F24 HydrophobicContact CG1-CD1 3.65Å; V4-F24 HydrophobicContact CG1-CD2 3.76Å; V4-F24 HydrophobicContact CG1-CE1 4.3Å; V4-F24 HydrophobicContact CG1-CE2 4.4Å; V4-F24 HydrophobicContact CG1-CG 3.32Å; V4-F24 HydrophobicContact CG2-CZ 4.48Å
5	Y	89.3	Confident	82.2	Confident	103 Å²	103	102.2 Å²	102.2	40%	0.404	52%	0.517	S	S	.	.	B	Isolated β-bridge	trans	-129.2	144.9	179.9	-61.7	-96.8	0	0	0	110	K3 H10 R12	K3-Y5 HydrophobicContact CB-CE2 3.78Å; K3-Y5 VanDerWaalsContact O-CD2 3.27Å; K3-Y5 WeakPolarHBondContact O-CD2 3.47Å; K3-Y5 VanDerWaalsContact O-CE2 3.3Å; K3-Y5 WeakPolarHBondContact O-CE2 3.42Å; Y5-H10 WeakPolarHBondContact CD1-O 3.26Å; Y5-R12 HydrophobicContact CD1-CB 4.46Å; Y5-R12 HydrophobicContact CD1-CG 3.61Å; Y5-R12 HydrophobicContact CE1-CB 4.47Å; Y5-R12 HydrophobicContact CE1-CG 3.23Å; Y5-R12 HydrophobicContact CG-CG 4.46Å; Y5-R12 PolarHBondContact OH-NE 2.86Å; Y5-R12 PolarHBondContact OH-NH2 3.3Å
6	C	89.5	Confident	81.9	Confident	1 Å²	1	104.3 Å²	104.3	1%	0.007	53%	0.529	C	S	.	.			trans	-76.7	129.4	178.7	-179.6	0	0	0	0	111.2	V8 H10 K11 C13 F24 H26	C6-V8 PolarHBondContact O-N 2.84Å; C6-H10 WeakPolarHBondContact O-CA 3.44Å; C6-H10 PolarHBondContact O-N 3.14Å; C6-K11 PolarHBondContact N-O 3.48Å; C6-C13 PolarHBondContact N-SG 2.97Å; C6-C13 VanDerWaalsContact N-SG 3.44Å; C6-F24 CarbonylContact C-O 3.5Å; C6-F24 VanDerWaalsContact CA-O 3.26Å; C6-F24 WeakPolarHBondContact CA-O 3.49Å; C6-H26 VanDerWaalsContact CB-CE1 3.42Å; C6-H26 WeakPolarHBondContact CB-CE1 3.28Å; C6-H26 VanDerWaalsContact CB-ND1 3.26Å; C6-H26 WeakPolarHBondContact CB-ND1 3.47Å; C6-H26 PolarHBondContact SG-N 3.46Å; C6-H26 PolarHBondContact SG-ND1 3.07Å; C6-H26 VanDerWaalsContact SG-ND1 3.41Å
7	T	85.6	Confident	82.1	Confident	40 Å²	40	100.9 Å²	100.9	25%	0.245	52%	0.515	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.8	-32.2	-179.9	54.7	0	0	0	0	113.2	H10 Q23 F24	T7-H10 PolarHBondContact O-CE1 2.89Å; T7-H10 PolarHBondContact O-ND1 3.41Å; T7-Q23 VanDerWaalsContact CB-OE1 3.28Å; T7-Q23 HydrophobicContact CG2-CB 3.84Å; T7-Q23 HydrophobicContact CG2-CG 3.96Å; T7-Q23 PolarHBondContact OG1-OE1 3.09Å; T7-F24 PolarHBondContact N-O 3.26Å
8	V	84.7	Confident	82.3	Confident	69 Å²	69	96.4 Å²	96.4	42%	0.418	49%	0.492	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.3	-26.4	-179.6	-178.7	0	0	0	0	114	C6 V25 C29 F51	C6-V8 PolarHBondContact O-N 2.84Å; V8-V25 HydrophobicContact CG2-CG1 3.9Å; V8-C29 HydrophobicContact CB-CB 3.9Å; V8-C29 HydrophobicContact CG1-CB 4.01Å; V8-C29 HydrophobicContact CG2-CB 4.31Å; V8-F51 HydrophobicContact CG2-CD2 3.98Å; V8-F51 HydrophobicContact CG2-CE2 3.56Å
9	C	87.8	Confident	82.4	Confident	41 Å²	41	97.8 Å²	97.8	28%	0.277	50%	0.495	S	S	.	.	T	Hydrogen-bonded Turn	trans	-140.3	6.1	-172.1	74.4	0	0	0	0	115.6	K11 H26	C9-K11 PolarHBondContact O-N 3.27Å; C9-H26 PolarHBondContact SG-ND1 3.38Å; C9-H26 VanDerWaalsContact SG-ND1 3.41Å
10	H	85.2	Confident	82.3	Confident	143 Å²	143	93.4 Å²	93.4	66%	0.662	47%	0.472	S	S	*	.			trans	53.3	2.2	175.2	-47.9	-51.3	0	0	0	117.3	Y5 C6 T7	Y5-H10 WeakPolarHBondContact CD1-O 3.26Å; C6-H10 WeakPolarHBondContact O-CA 3.44Å; C6-H10 PolarHBondContact O-N 3.14Å; T7-H10 PolarHBondContact O-CE1 2.89Å; T7-H10 PolarHBondContact O-ND1 3.41Å
11	K	88.6	Confident	82.1	Confident	151 Å²	151	91.7 Å²	91.7	66%	0.657	46%	0.463	S	S	*	.	P	Polyproline II helix	trans	-74.1	146.5	174.1	-69.6	166.7	-172.9	178.7	0	110.4	C6 C9 C13	C6-K11 PolarHBondContact N-O 3.48Å; C9-K11 PolarHBondContact O-N 3.27Å; K11-C13 PolarHBondContact O-N 2.9Å
12	R	88	Confident	83.1	Confident	147 Å²	147	87.8 Å²	87.8	56%	0.555	44%	0.442	S	S	*	.	B	Isolated β-bridge	trans	-61.8	130.7	174.4	-74.2	-178.2	-175.8	141.5	10.8	110.5	V4 Y5	V4-R12 WeakPolarHBondContact O-CA 3.49Å; Y5-R12 HydrophobicContact CD1-CB 4.46Å; Y5-R12 HydrophobicContact CD1-CG 3.61Å; Y5-R12 HydrophobicContact CE1-CB 4.47Å; Y5-R12 HydrophobicContact CE1-CG 3.23Å; Y5-R12 HydrophobicContact CG-CG 4.46Å; Y5-R12 PolarHBondContact OH-NE 2.86Å; Y5-R12 PolarHBondContact OH-NH2 3.3Å
13	C	85.2	Confident	83.5	Confident	21 Å²	21	83.8 Å²	83.8	14%	0.142	41%	0.414	C	S	.	.	P	Polyproline II helix	trans	-73.7	136.7	177.3	-57.8	0	0	0	0	110.9	V4 C6 K11 V17 H26	V4-C13 HydrophobicContact CB-CB 4.44Å; V4-C13 HydrophobicContact CG1-CB 4.06Å; V4-C13 PolarHBondContact O-N 3.07Å; C6-C13 PolarHBondContact N-SG 2.97Å; C6-C13 VanDerWaalsContact N-SG 3.44Å; K11-C13 PolarHBondContact O-N 2.9Å; C13-V17 HydrophobicContact CB-CB 4.36Å; C13-V17 HydrophobicContact CB-CG1 3.83Å; C13-V17 HydrophobicContact CB-CG2 3.54Å; C13-H26 WeakPolarHBondContact CA-NE2 3.35Å
14	K	80.2	Confident	84	Confident	185 Å²	185	80.1 Å²	80.1	80%	0.804	40%	0.398	S	S	*	.			trans	-138.3	135.7	175.5	-67.3	-176.2	177.1	-175	0	108.2
15	G	78.7	Confident	84.1	Confident	65 Å²	65	78.1 Å²	78.1	67%	0.67	39%	0.386	S	S	*	.	S	Bend	trans	71	-148.8	-169.3	0	0	0	0	0	111.2	V17	G15-V17 VanDerWaalsContact O-CG2 3.24Å; G15-V17 WeakPolarHBondContact O-CG2 3.36Å
16	D	77.6	Confident	84.1	Confident	135 Å²	135	74.9 Å²	74.9	72%	0.722	38%	0.375	S	S	*	.			trans	-71.6	129.3	-168.8	-43.1	-58	0	0	0	112.7
17	V	85.1	Confident	83.8	Confident	48 Å²	48	80.3 Å²	80.3	29%	0.291	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	130.9	-175.3	-157.8	0	0	0	0	109.1	V4 C13 G15 K19 F24	V4-V17 HydrophobicContact CG1-CG1 4.38Å; C13-V17 HydrophobicContact CB-CB 4.36Å; C13-V17 HydrophobicContact CB-CG1 3.83Å; C13-V17 HydrophobicContact CB-CG2 3.54Å; G15-V17 VanDerWaalsContact O-CG2 3.24Å; G15-V17 WeakPolarHBondContact O-CG2 3.36Å; V17-K19 PolarHBondContact O-N 3.23Å; V17-F24 HydrophobicContact CG1-CB 3.89Å; V17-F24 HydrophobicContact CG1-CD1 4.05Å; V17-F24 HydrophobicContact CG1-CG 4.46Å
18	L	84.7	Confident	83.8	Confident	19 Å²	19	87 Å²	87	10%	0.099	42%	0.421	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	115.3	172.4	-56	-174.4	0	0	0	108	F24 V25 Y27 F30 K40 L254	L18-F24 CarbonylContact O-C 3.58Å; L18-F24 WeakPolarHBondContact O-CA 3.46Å; L18-V25 PolarHBondContact N-O 3.41Å; L18-V25 PolarHBondContact O-N 3.34Å; L18-Y27 HydrophobicContact CD2-CD2 3.92Å; L18-F30 HydrophobicContact CD1-CB 3.65Å; L18-F30 HydrophobicContact CD1-CD1 3.37Å; L18-F30 HydrophobicContact CD1-CE1 4.21Å; L18-F30 HydrophobicContact CD1-CG 3.72Å; L18-K40 HydrophobicContact CD1-CG 4.38Å; L18-L254 HydrophobicContact CD1-CD2 4.4Å; L18-L254 HydrophobicContact CD2-CD2 3.54Å; L18-L254 HydrophobicContact CD2-CG 4.07Å
19	K	85.5	Confident	83.9	Confident	124 Å²	124	84.9 Å²	84.9	54%	0.539	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	121.5	168.6	-176.2	-173.6	171.6	-170	0	108	V17 E21 Q23 F24	V17-K19 PolarHBondContact O-N 3.23Å; K19-E21 WeakPolarHBondContact CE-O 3.29Å; K19-Q23 WeakPolarHBondContact CA-O 3.4Å; K19-F24 HydrophobicContact CB-CD1 4.14Å; K19-F24 HydrophobicContact CB-CE1 3.99Å; K19-F24 HydrophobicContact CD-CE1 4.23Å; K19-F24 HydrophobicContact CD-CZ 4.39Å; K19-F24 HydrophobicContact CG-CD1 4.33Å; K19-F24 HydrophobicContact CG-CE1 3.92Å; K19-F24 HydrophobicContact CG-CZ 4.28Å
20	I	80.6	Confident	83.8	Confident	9 Å²	9	83 Å²	83	5%	0.046	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	108.8	175.3	-63.5	170.7	0	0	0	105.2	Q22 Q23 V25 F30 F44 F51	I20-Q22 PolarHBondContact O-N 3.23Å; I20-Q23 PolarHBondContact N-O 3.39Å; I20-Q23 WeakPolarHBondContact O-CA 3.49Å; I20-Q23 PolarHBondContact O-N 3.17Å; I20-V25 HydrophobicContact CD1-CG2 4.25Å; I20-F30 HydrophobicContact CD1-CD2 3.65Å; I20-F30 HydrophobicContact CD1-CE2 3.36Å; I20-F30 HydrophobicContact CD1-CG 4.46Å; I20-F30 HydrophobicContact CD1-CZ 3.95Å; I20-F44 HydrophobicContact CD1-CE2 4.13Å; I20-F44 HydrophobicContact CD1-CZ 4.05Å; I20-F44 HydrophobicContact CG1-CZ 4.13Å; I20-F44 HydrophobicContact CG2-CE2 3.78Å; I20-F44 HydrophobicContact CG2-CZ 3.84Å; I20-F51 HydrophobicContact CD1-CE1 3.73Å; I20-F51 HydrophobicContact CD1-CZ 4.18Å
21	E	76.7	Confident	84.1	Confident	57 Å²	57	79.8 Å²	79.8	27%	0.266	38%	0.382	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.3	-101.4	-172.4	-58.5	151.9	-151.8	0	0	113.1	K19 H250	K19-E21 WeakPolarHBondContact CE-O 3.29Å; E21-H250 WeakPolarHBondContact CG-NE2 3.48Å; E21-H250 IonicContact OE1-CD2 3.38Å; E21-H250 IonicContact OE1-CE1 2.77Å; E21-H250 IonicContact OE1-CG 3.55Å; E21-H250 IonicContact OE1-ND1 3.56Å; E21-H250 IonicContact OE1-NE2 3.53Å
22	Q	75.2	Confident	84.2	Confident	162 Å²	162	72.6 Å²	72.6	76%	0.757	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.6	-9	176.5	-53.5	-171.8	23.1	0	0	112.5	I20	I20-Q22 PolarHBondContact O-N 3.23Å
23	Q	82.2	Confident	84.2	Confident	51 Å²	51	69.5 Å²	69.5	24%	0.238	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87	155	177.2	-59.6	-160.5	21.4	0	0	111.7	T7 K19 I20	T7-Q23 VanDerWaalsContact CB-OE1 3.28Å; T7-Q23 HydrophobicContact CG2-CB 3.84Å; T7-Q23 HydrophobicContact CG2-CG 3.96Å; T7-Q23 PolarHBondContact OG1-OE1 3.09Å; K19-Q23 WeakPolarHBondContact CA-O 3.4Å; I20-Q23 PolarHBondContact N-O 3.39Å; I20-Q23 WeakPolarHBondContact O-CA 3.49Å; I20-Q23 PolarHBondContact O-N 3.17Å
24	F	87.4	Confident	84.3	Confident	69 Å²	69	73.8 Å²	73.8	30%	0.303	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	135.8	175.3	-67.6	-87.7	0	0	0	109.3	V4 C6 T7 V17 L18 K19	V4-F24 HydrophobicContact CG1-CB 3.42Å; V4-F24 VanDerWaalsContact CG1-CB 3.42Å; V4-F24 HydrophobicContact CG1-CD1 3.65Å; V4-F24 HydrophobicContact CG1-CD2 3.76Å; V4-F24 HydrophobicContact CG1-CE1 4.3Å; V4-F24 HydrophobicContact CG1-CE2 4.4Å; V4-F24 HydrophobicContact CG1-CG 3.32Å; V4-F24 HydrophobicContact CG2-CZ 4.48Å; C6-F24 CarbonylContact C-O 3.5Å; C6-F24 VanDerWaalsContact CA-O 3.26Å; C6-F24 WeakPolarHBondContact CA-O 3.49Å; T7-F24 PolarHBondContact N-O 3.26Å; V17-F24 HydrophobicContact CG1-CB 3.89Å; V17-F24 HydrophobicContact CG1-CD1 4.05Å; V17-F24 HydrophobicContact CG1-CG 4.46Å; L18-F24 CarbonylContact O-C 3.58Å; L18-F24 WeakPolarHBondContact O-CA 3.46Å; K19-F24 HydrophobicContact CB-CD1 4.14Å; K19-F24 HydrophobicContact CB-CE1 3.99Å; K19-F24 HydrophobicContact CD-CE1 4.23Å; K19-F24 HydrophobicContact CD-CZ 4.39Å; K19-F24 HydrophobicContact CG-CD1 4.33Å; K19-F24 HydrophobicContact CG-CE1 3.92Å; K19-F24 HydrophobicContact CG-CZ 4.28Å
25	V	88.7	Confident	84.8	Confident	0 Å²	0	66.9 Å²	66.9	0%	0	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	139.4	-175.3	-169.1	0	0	0	0	109.7	V8 L18 I20 C29 F30 F51	V8-V25 HydrophobicContact CG2-CG1 3.9Å; L18-V25 PolarHBondContact N-O 3.41Å; L18-V25 PolarHBondContact O-N 3.34Å; I20-V25 HydrophobicContact CD1-CG2 4.25Å; V25-C29 HydrophobicContact CG1-CB 3.73Å; V25-F30 HydrophobicContact CG1-CB 4.02Å; V25-F51 HydrophobicContact CG2-CE2 4.12Å; V25-F51 HydrophobicContact CG2-CZ 3.83Å
26	H	88.5	Confident	85.1	Confident	36 Å²	36	67.4 Å²	67.4	17%	0.167	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.8	145.9	171.1	-65.4	111.7	0	0	0	111	C6 C9 C13 K28 C29 F30	C6-H26 VanDerWaalsContact CB-CE1 3.42Å; C6-H26 WeakPolarHBondContact CB-CE1 3.28Å; C6-H26 VanDerWaalsContact CB-ND1 3.26Å; C6-H26 WeakPolarHBondContact CB-ND1 3.47Å; C6-H26 PolarHBondContact SG-N 3.46Å; C6-H26 PolarHBondContact SG-ND1 3.07Å; C6-H26 VanDerWaalsContact SG-ND1 3.41Å; C9-H26 PolarHBondContact SG-ND1 3.38Å; C9-H26 VanDerWaalsContact SG-ND1 3.41Å; C13-H26 WeakPolarHBondContact CA-NE2 3.35Å; H26-K28 PolarHBondContact O-N 3.34Å; H26-C29 HydrophobicContact CB-CB 4.16Å; H26-C29 PolarHBondContact O-N 3Å; H26-F30 PolarHBondContact O-N 2.86Å
27	Y	84.3	Confident	85.4	Confident	114 Å²	114	67 Å²	67	45%	0.447	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.7	-16.5	172.8	-165.5	-75.8	0	0	0	113.5	L18 K40 L254	L18-Y27 HydrophobicContact CD2-CD2 3.92Å; Y27-K40 HydrophobicContact CD1-CD 3.72Å; Y27-K40 HydrophobicContact CD2-CD 3.47Å; Y27-K40 VanDerWaalsContact CD2-CD 3.47Å; Y27-K40 HydrophobicContact CD2-CG 4.41Å; Y27-K40 HydrophobicContact CE1-CD 3.1Å; Y27-K40 HydrophobicContact CE1-CG 4.42Å; Y27-K40 HydrophobicContact CE2-CD 2.81Å; Y27-K40 HydrophobicContact CE2-CG 4.12Å; Y27-K40 HydrophobicContact CG-CD 3.87Å; Y27-K40 VanDerWaalsContact OH-CD 3.25Å; Y27-K40 WeakPolarHBondContact OH-CD 3.4Å; Y27-K40 WeakPolarHBondContact OH-CE 3.43Å; Y27-K40 PolarHBondContact OH-NZ 3.19Å; Y27-L254 HydrophobicContact CE2-CD2 4.23Å
28	K	85.3	Confident	85.4	Confident	180 Å²	180	69.8 Å²	69.8	78%	0.783	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.4	-10.8	172.2	-66.8	-173.2	177.2	-175.1	0	115.4	H26	H26-K28 PolarHBondContact O-N 3.34Å
29	C	86.2	Confident	85.4	Confident	25 Å²	25	69.2 Å²	69.2	17%	0.169	33%	0.33	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.8	-12.7	177.5	-66.2	0	0	0	0	112.4	V8 V25 H26 Q31	V8-C29 HydrophobicContact CB-CB 3.9Å; V8-C29 HydrophobicContact CG1-CB 4.01Å; V8-C29 HydrophobicContact CG2-CB 4.31Å; V25-C29 HydrophobicContact CG1-CB 3.73Å; H26-C29 HydrophobicContact CB-CB 4.16Å; H26-C29 PolarHBondContact O-N 3Å; C29-Q31 VanDerWaalsContact C-N 3.25Å; C29-Q31 PolarHBondContact O-N 3.17Å
30	F	87.1	Confident	84.8	Confident	2 Å²	2	65.9 Å²	65.9	1%	0.009	32%	0.315	C	S	.	.			trans	-84.8	66.7	178.9	-173.2	-124.8	0	0	0	111.9	L18 I20 V25 H26 L39 K40 F44 F51	L18-F30 HydrophobicContact CD1-CB 3.65Å; L18-F30 HydrophobicContact CD1-CD1 3.37Å; L18-F30 HydrophobicContact CD1-CE1 4.21Å; L18-F30 HydrophobicContact CD1-CG 3.72Å; I20-F30 HydrophobicContact CD1-CD2 3.65Å; I20-F30 HydrophobicContact CD1-CE2 3.36Å; I20-F30 HydrophobicContact CD1-CG 4.46Å; I20-F30 HydrophobicContact CD1-CZ 3.95Å; V25-F30 HydrophobicContact CG1-CB 4.02Å; H26-F30 PolarHBondContact O-N 2.86Å; F30-L39 HydrophobicContact CD1-CB 3.88Å; F30-L39 HydrophobicContact CD2-CB 4.29Å; F30-L39 HydrophobicContact CD2-CD1 4.44Å; F30-L39 HydrophobicContact CE1-CB 3.47Å; F30-L39 VanDerWaalsContact CE1-CB 3.47Å; F30-L39 HydrophobicContact CE2-CB 3.87Å; F30-L39 HydrophobicContact CE2-CD1 4.11Å; F30-L39 HydrophobicContact CG-CB 4.29Å; F30-L39 HydrophobicContact CZ-CB 3.45Å; F30-L39 VanDerWaalsContact CZ-CB 3.45Å; F30-L39 HydrophobicContact CZ-CD1 4.47Å; F30-L39 PolarHBondContact O-N 2.74Å; F30-K40 HydrophobicContact CD1-CG 4.31Å; F30-F44 HydrophobicContact CE2-CD1 4.27Å; F30-F44 HydrophobicContact CE2-CD2 4.04Å; F30-F44 HydrophobicContact CE2-CE1 4.39Å; F30-F44 HydrophobicContact CE2-CE2 4.18Å; F30-F44 HydrophobicContact CE2-CG 4.08Å; F30-F44 HydrophobicContact CE2-CZ 4.34Å; F30-F44 HydrophobicContact CZ-CB 4.39Å; F30-F44 AromaticContact CZ-CD1 3.55Å; F30-F44 HydrophobicContact CZ-CD1 3.55Å; F30-F44 HydrophobicContact CZ-CD2 4.14Å; F30-F44 AromaticContact CZ-CE1 3.69Å; F30-F44 HydrophobicContact CZ-CE1 3.69Å; F30-F44 HydrophobicContact CZ-CE2 4.28Å; F30-F44 AromaticContact CZ-CG 3.77Å; F30-F44 HydrophobicContact CZ-CG 3.77Å; F30-F44 HydrophobicContact CZ-CZ 4.05Å; F30-F51 HydrophobicContact CD2-CD1 4.05Å; F30-F51 HydrophobicContact CD2-CE1 4.29Å; F30-F51 HydrophobicContact CD2-CG 4.29Å; F30-F51 AromaticContact CE2-CD1 3.78Å; F30-F51 HydrophobicContact CE2-CD1 3.78Å; F30-F51 HydrophobicContact CE2-CE1 4.11Å; F30-F51 HydrophobicContact CE2-CG 4.37Å
31	Q	89.5	Confident	84.2	Confident	76 Å²	76	74.9 Å²	74.9	36%	0.355	36%	0.357	S	S	.	.	B	Isolated β-bridge	trans	-123.9	152.8	178	64.8	-177.9	45	0	0	109.8	C29 K37	C29-Q31 VanDerWaalsContact C-N 3.25Å; C29-Q31 PolarHBondContact O-N 3.17Å; Q31-K37 CarbonylContact C-O 3.56Å; Q31-K37 WeakPolarHBondContact CA-O 3.49Å
32	C	91.3	Very high	83.9	Confident	0 Å²	0	74.4 Å²	74.4	0%	0	37%	0.367	C	S	.	.			trans	-68.1	134.6	172.1	-178.8	0	0	0	0	111.1	K34 C36 K37 L39 F51 C53 D56	C32-K34 PolarHBondContact O-N 3.13Å; C32-K34 PolarHBondContact SG-N 3.42Å; C32-K34 VanDerWaalsContact SG-N 3.43Å; C32-C36 WeakPolarHBondContact O-CA 3.39Å; C32-C36 PolarHBondContact O-N 2.88Å; C32-K37 PolarHBondContact N-O 2.97Å; C32-L39 HydrophobicContact CB-CD1 4.36Å; C32-L39 HydrophobicContact CB-CD2 4.23Å; C32-L39 HydrophobicContact CB-CG 4.41Å; C32-F51 WeakPolarHBondContact CA-O 3.23Å; C32-C53 HydrophobicContact CB-CB 4.1Å; C32-C53 PolarHBondContact SG-N 3.1Å; C32-D56 PolarHBondContact SG-OD2 3.15Å
33	I	88	Confident	84.2	Confident	81 Å²	81	67.1 Å²	67.1	42%	0.415	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.9	-16.8	-179.9	-74.1	155.3	0	0	0	113.7	N50 F51	I33-N50 HydrophobicContact CD1-CB 3.46Å; I33-N50 VanDerWaalsContact CD1-CB 3.46Å; I33-N50 WeakPolarHBondContact CD1-OD1 3.42Å; I33-F51 PolarHBondContact N-O 3.01Å; I33-F51 VanDerWaalsContact N-O 3.14Å
34	K	88.2	Confident	84.5	Confident	112 Å²	112	65 Å²	65	49%	0.487	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.8	-57.5	-179.4	-65.7	-75	152.7	155.8	0	112.4	C32 Y52 D56 Q60	C32-K34 PolarHBondContact O-N 3.13Å; C32-K34 PolarHBondContact SG-N 3.42Å; C32-K34 VanDerWaalsContact SG-N 3.43Å; K34-Y52 HydrophobicContact CG-CD1 4.3Å; K34-Y52 HydrophobicContact CG-CE1 4.13Å; K34-D56 HydrophobicContact CB-CB 3.89Å; K34-D56 HydrophobicContact CG-CB 4.33Å; K34-Q60 VanDerWaalsContact NZ-OE1 3.16Å
35	C	89.3	Confident	84.4	Confident	39 Å²	39	63.3 Å²	63.3	26%	0.264	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.2	1.1	-180	71	0	0	0	0	115.9	K37 D56	C35-K37 HydrophobicContact CB-CD 4.27Å; C35-K37 HydrophobicContact CB-CG 4.25Å; C35-K37 PolarHBondContact O-N 2.87Å; C35-K37 WeakPolarHBondContact SG-CD 3.42Å; C35-K37 WeakPolarHBondContact SG-CG 3.43Å; C35-D56 VanDerWaalsContact CB-OD2 3.25Å; C35-D56 WeakPolarHBondContact CB-OD2 3.49Å; C35-D56 PolarHBondContact N-OD2 3.28Å; C35-D56 PolarHBondContact SG-OD2 3.24Å
36	C	85.5	Confident	84.4	Confident	77 Å²	77	64.7 Å²	64.7	52%	0.52	33%	0.326	S	S	.	.			trans	55.4	11.3	-176.7	-65.4	0	0	0	0	116.2	C32	C32-C36 WeakPolarHBondContact O-CA 3.39Å; C32-C36 PolarHBondContact O-N 2.88Å
37	K	84.1	Confident	84.1	Confident	127 Å²	127	65.3 Å²	65.3	55%	0.552	33%	0.328	S	S	*	.			trans	-71.4	137.8	177.8	-64.9	172.4	-166.1	162.9	0	110.8	Q31 C32 C35 L39	Q31-K37 CarbonylContact C-O 3.56Å; Q31-K37 WeakPolarHBondContact CA-O 3.49Å; C32-K37 PolarHBondContact N-O 2.97Å; C35-K37 HydrophobicContact CB-CD 4.27Å; C35-K37 HydrophobicContact CB-CG 4.25Å; C35-K37 PolarHBondContact O-N 2.87Å; C35-K37 WeakPolarHBondContact SG-CD 3.42Å; C35-K37 WeakPolarHBondContact SG-CG 3.43Å; K37-L39 PolarHBondContact O-N 2.99Å
38	N	84.3	Confident	84.1	Confident	105 Å²	105	65.6 Å²	65.6	56%	0.561	34%	0.338	S	S	*	.	B	Isolated β-bridge	trans	-62.5	125.2	172.6	-64.5	-74.4	0	0	0	110	K40	N38-K40 VanDerWaalsContact C-N 3.3Å; N38-K40 PolarHBondContact O-N 3.04Å
39	L	85.1	Confident	83.8	Confident	8 Å²	8	63.7 Å²	63.7	4%	0.042	33%	0.332	C	S	.	.			trans	-85.1	-1.9	-174.6	-68.8	168.9	0	0	0	113.7	F30 C32 K37 Q41 G42 F44 F51 C53	F30-L39 HydrophobicContact CD1-CB 3.88Å; F30-L39 HydrophobicContact CD2-CB 4.29Å; F30-L39 HydrophobicContact CD2-CD1 4.44Å; F30-L39 HydrophobicContact CE1-CB 3.47Å; F30-L39 VanDerWaalsContact CE1-CB 3.47Å; F30-L39 HydrophobicContact CE2-CB 3.87Å; F30-L39 HydrophobicContact CE2-CD1 4.11Å; F30-L39 HydrophobicContact CG-CB 4.29Å; F30-L39 HydrophobicContact CZ-CB 3.45Å; F30-L39 VanDerWaalsContact CZ-CB 3.45Å; F30-L39 HydrophobicContact CZ-CD1 4.47Å; F30-L39 PolarHBondContact O-N 2.74Å; C32-L39 HydrophobicContact CB-CD1 4.36Å; C32-L39 HydrophobicContact CB-CD2 4.23Å; C32-L39 HydrophobicContact CB-CG 4.41Å; K37-L39 PolarHBondContact O-N 2.99Å; L39-Q41 PolarHBondContact O-N 2.85Å; L39-G42 PolarHBondContact O-N 2.9Å; L39-F44 HydrophobicContact CB-CB 4.32Å; L39-F44 HydrophobicContact CD1-CB 4.1Å; L39-F44 HydrophobicContact CD2-CB 4.24Å; L39-F44 HydrophobicContact CG-CB 4.45Å; L39-F51 HydrophobicContact CD1-CB 3.65Å; L39-C53 HydrophobicContact CD2-CB 3.64Å
40	K	72.6	Confident	83.7	Confident	54 Å²	54	65.5 Å²	65.5	24%	0.235	34%	0.34	C	S	.	.	T	Hydrogen-bonded Turn	trans	-51	-19.8	-176.6	-72.4	-164.6	-179.6	-169.7	0	116.6	L18 Y27 F30 N38 L254	L18-K40 HydrophobicContact CD1-CG 4.38Å; Y27-K40 HydrophobicContact CD1-CD 3.72Å; Y27-K40 HydrophobicContact CD2-CD 3.47Å; Y27-K40 VanDerWaalsContact CD2-CD 3.47Å; Y27-K40 HydrophobicContact CD2-CG 4.41Å; Y27-K40 HydrophobicContact CE1-CD 3.1Å; Y27-K40 HydrophobicContact CE1-CG 4.42Å; Y27-K40 HydrophobicContact CE2-CD 2.81Å; Y27-K40 HydrophobicContact CE2-CG 4.12Å; Y27-K40 HydrophobicContact CG-CD 3.87Å; Y27-K40 VanDerWaalsContact OH-CD 3.25Å; Y27-K40 WeakPolarHBondContact OH-CD 3.4Å; Y27-K40 WeakPolarHBondContact OH-CE 3.43Å; Y27-K40 PolarHBondContact OH-NZ 3.19Å; F30-K40 HydrophobicContact CD1-CG 4.31Å; N38-K40 VanDerWaalsContact C-N 3.3Å; N38-K40 PolarHBondContact O-N 3.04Å; K40-L254 HydrophobicContact CB-CD2 4.18Å; K40-L254 HydrophobicContact CD-CD2 4.14Å; K40-L254 HydrophobicContact CG-CD2 3.99Å
41	Q	68.9	Low	83.8	Confident	198 Å²	198	65.6 Å²	65.6	93%	0.925	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-131.3	13.7	-170.5	-154.7	163.5	7.8	0	0	114.1	L39	L39-Q41 PolarHBondContact O-N 2.85Å
42	G	70.5	Confident	83.8	Confident	46 Å²	46	62.8 Å²	62.8	47%	0.474	33%	0.326	S	S	.	.	S	Bend	trans	-130.3	168.2	173.2	0	0	0	0	0	111.4	L39	L39-G42 PolarHBondContact O-N 2.9Å
43	G	81.7	Confident	83.8	Confident	9 Å²	9	63.3 Å²	63.3	9%	0.093	33%	0.33	C	S	.	.			trans	-65.1	145.3	160.9	0	0	0	0	0	109.4	P54	G43-P54 VanDerWaalsContact O-CD 3.28Å; G43-P54 WeakPolarHBondContact O-CD 3.36Å; G43-P54 VanDerWaalsContact O-CG 3.24Å; G43-P54 WeakPolarHBondContact O-CG 3.43Å
44	F	87.5	Confident	83.8	Confident	6 Å²	6	61.7 Å²	61.7	3%	0.026	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	156.6	178.1	60.4	-84.3	0	0	0	110.1	I20 F30 L39 V46 F51 H250	I20-F44 HydrophobicContact CD1-CE2 4.13Å; I20-F44 HydrophobicContact CD1-CZ 4.05Å; I20-F44 HydrophobicContact CG1-CZ 4.13Å; I20-F44 HydrophobicContact CG2-CE2 3.78Å; I20-F44 HydrophobicContact CG2-CZ 3.84Å; F30-F44 HydrophobicContact CE2-CD1 4.27Å; F30-F44 HydrophobicContact CE2-CD2 4.04Å; F30-F44 HydrophobicContact CE2-CE1 4.39Å; F30-F44 HydrophobicContact CE2-CE2 4.18Å; F30-F44 HydrophobicContact CE2-CG 4.08Å; F30-F44 HydrophobicContact CE2-CZ 4.34Å; F30-F44 HydrophobicContact CZ-CB 4.39Å; F30-F44 AromaticContact CZ-CD1 3.55Å; F30-F44 HydrophobicContact CZ-CD1 3.55Å; F30-F44 HydrophobicContact CZ-CD2 4.14Å; F30-F44 AromaticContact CZ-CE1 3.69Å; F30-F44 HydrophobicContact CZ-CE1 3.69Å; F30-F44 HydrophobicContact CZ-CE2 4.28Å; F30-F44 AromaticContact CZ-CG 3.77Å; F30-F44 HydrophobicContact CZ-CG 3.77Å; F30-F44 HydrophobicContact CZ-CZ 4.05Å; L39-F44 HydrophobicContact CB-CB 4.32Å; L39-F44 HydrophobicContact CD1-CB 4.1Å; L39-F44 HydrophobicContact CD2-CB 4.24Å; L39-F44 HydrophobicContact CG-CB 4.45Å; F44-V46 HydrophobicContact CD2-CG2 3.89Å; F44-V46 HydrophobicContact CE2-CG2 3.8Å; F44-F51 HydrophobicContact CD2-CD1 4.22Å; F44-F51 HydrophobicContact CE2-CE1 4.48Å; F44-H250 VanDerWaalsContact CD1-O 3.25Å; F44-H250 WeakPolarHBondContact CD1-O 3.31Å; F44-H250 HydrophobicContact CD2-CB 4.42Å; F44-H250 HydrophobicContact CE1-CB 4.35Å; F44-H250 WeakPolarHBondContact CE1-O 3.46Å; F44-H250 HydrophobicContact CE2-CB 3.77Å; F44-H250 HydrophobicContact CZ-CB 3.74Å; F44-H250 PolarHBondContact O-N 3.47Å
45	F	86.6	Confident	83.8	Confident	34 Å²	34	61.5 Å²	61.5	15%	0.149	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	133.1	173.3	-67.6	-92.2	0	0	0	108.7	Y52 P54 Y57 Y249	F45-Y52 PolarHBondContact N-O 3.14Å; F45-Y52 PolarHBondContact O-N 3.12Å; F45-P54 HydrophobicContact CE2-CB 4.1Å; F45-P54 HydrophobicContact CE2-CG 4.4Å; F45-Y57 HydrophobicContact CB-CD1 4.11Å; F45-Y57 HydrophobicContact CB-CD2 3.4Å; F45-Y57 VanDerWaalsContact CB-CD2 3.4Å; F45-Y57 HydrophobicContact CB-CE2 3.97Å; F45-Y57 HydrophobicContact CB-CG 3.52Å; F45-Y57 AromaticContact CD1-CD1 3.68Å; F45-Y57 HydrophobicContact CD1-CD1 3.68Å; F45-Y57 HydrophobicContact CD1-CD2 4.41Å; F45-Y57 AromaticContact CD1-CE1 3.85Å; F45-Y57 HydrophobicContact CD1-CE1 3.85Å; F45-Y57 HydrophobicContact CD1-CG 4.02Å; F45-Y57 AromaticContact CD2-CD1 3.83Å; F45-Y57 HydrophobicContact CD2-CD1 3.83Å; F45-Y57 HydrophobicContact CD2-CD2 4.46Å; F45-Y57 AromaticContact CD2-CG 3.68Å; F45-Y57 HydrophobicContact CD2-CG 3.68Å; F45-Y57 AromaticContact CE1-CD1 3.94Å; F45-Y57 HydrophobicContact CE1-CD1 3.94Å; F45-Y57 HydrophobicContact CE1-CE1 4.12Å; F45-Y57 HydrophobicContact CE2-CD1 4.09Å; F45-Y57 HydrophobicContact CE2-CG 4.35Å; F45-Y57 AromaticContact CG-CD1 3.61Å; F45-Y57 HydrophobicContact CG-CD1 3.61Å; F45-Y57 AromaticContact CG-CD2 3.89Å; F45-Y57 HydrophobicContact CG-CD2 3.89Å; F45-Y57 HydrophobicContact CG-CE1 4.19Å; F45-Y57 HydrophobicContact CG-CE2 4.43Å; F45-Y57 AromaticContact CG-CG 3.48Å; F45-Y57 HydrophobicContact CG-CG 3.48Å; F45-Y57 VanDerWaalsContact CG-CG 3.48Å; F45-Y57 HydrophobicContact CZ-CD1 4.12Å; F45-Y249 HydrophobicContact CD1-CD2 4.3Å; F45-Y249 AromaticContact CE1-CD2 3.67Å; F45-Y249 HydrophobicContact CE1-CD2 3.67Å; F45-Y249 HydrophobicContact CE1-CG 4.36Å; F45-Y249 AromaticContact CE2-CD2 3.88Å; F45-Y249 HydrophobicContact CE2-CD2 3.88Å; F45-Y249 HydrophobicContact CE2-CE2 4.09Å; F45-Y249 AromaticContact CZ-CD2 3.43Å; F45-Y249 HydrophobicContact CZ-CD2 3.43Å; F45-Y249 VanDerWaalsContact CZ-CD2 3.43Å; F45-Y249 AromaticContact CZ-CE2 3.96Å; F45-Y249 HydrophobicContact CZ-CE2 3.96Å; F45-Y249 HydrophobicContact CZ-CG 4.43Å
46	V	87.5	Confident	83.9	Confident	29 Å²	29	60.9 Å²	60.9	18%	0.176	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	127.9	170.3	-172.6	0	0	0	0	107.7	F44 F51	F44-V46 HydrophobicContact CD2-CG2 3.89Å; F44-V46 HydrophobicContact CE2-CG2 3.8Å; V46-F51 HydrophobicContact CG2-CD1 3.91Å; V46-F51 HydrophobicContact CG2-CE1 3.77Å
47	K	82.8	Confident	84.1	Confident	49 Å²	49	57.8 Å²	57.8	21%	0.213	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.3	132.5	173	-178.1	169.2	178.7	175.7	0	109.2	Q49 N50 Y52 Y57 F61	K47-Q49 PolarHBondContact O-N 2.88Å; K47-N50 PolarHBondContact N-O 2.81Å; K47-N50 WeakPolarHBondContact O-CA 3.22Å; K47-N50 VanDerWaalsContact O-CB 3.31Å; K47-N50 WeakPolarHBondContact O-CB 3.42Å; K47-N50 PolarHBondContact O-N 2.94Å; K47-Y52 HydrophobicContact CB-CE2 4.29Å; K47-Y57 HydrophobicContact CB-CE2 4.09Å; K47-Y57 HydrophobicContact CD-CE2 3.94Å; K47-F61 HydrophobicContact CD-CD1 4.2Å; K47-F61 HydrophobicContact CD-CD2 4.13Å; K47-F61 HydrophobicContact CD-CE1 4.09Å; K47-F61 HydrophobicContact CD-CE2 4.02Å; K47-F61 HydrophobicContact CD-CG 4.2Å; K47-F61 HydrophobicContact CD-CZ 3.98Å; K47-F61 VanDerWaalsContact NZ-CD1 3.31Å
48	D	83.8	Confident	84.4	Confident	121 Å²	121	54.2 Å²	54.2	65%	0.647	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.9	39.7	-179.4	-48.4	-37.6	0	0	0	113.2	N50	D48-N50 PolarHBondContact O-N 3.12Å; D48-N50 VanDerWaalsContact O-N 3.1Å; D48-N50 PolarHBondContact O-ND2 2.91Å
49	Q	78.4	Confident	84.6	Confident	139 Å²	139	53.3 Å²	53.3	65%	0.65	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.8	4.1	-172	-51	-178.8	37.5	0	0	115.7	K47	K47-Q49 PolarHBondContact O-N 2.88Å
50	N	85.1	Confident	84.7	Confident	64 Å²	64	57 Å²	57	34%	0.342	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	141.4	-179.8	-68	-52	0	0	0	111.4	I33 K47 D48 Y52	I33-N50 HydrophobicContact CD1-CB 3.46Å; I33-N50 VanDerWaalsContact CD1-CB 3.46Å; I33-N50 WeakPolarHBondContact CD1-OD1 3.42Å; K47-N50 PolarHBondContact N-O 2.81Å; K47-N50 WeakPolarHBondContact O-CA 3.22Å; K47-N50 VanDerWaalsContact O-CB 3.31Å; K47-N50 WeakPolarHBondContact O-CB 3.42Å; K47-N50 PolarHBondContact O-N 2.94Å; D48-N50 PolarHBondContact O-N 3.12Å; D48-N50 VanDerWaalsContact O-N 3.1Å; D48-N50 PolarHBondContact O-ND2 2.91Å; N50-Y52 HydrophobicContact CB-CD2 4.45Å; N50-Y52 HydrophobicContact CB-CE2 3.58Å; N50-Y52 WeakPolarHBondContact O-CD2 3.37Å
51	F	88.5	Confident	85.3	Confident	4 Å²	4	57.1 Å²	57.1	2%	0.018	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	128.2	-179.7	-61.8	-80	0	0	0	112	V8 I20 V25 F30 C32 I33 L39 F44 V46	V8-F51 HydrophobicContact CG2-CD2 3.98Å; V8-F51 HydrophobicContact CG2-CE2 3.56Å; I20-F51 HydrophobicContact CD1-CE1 3.73Å; I20-F51 HydrophobicContact CD1-CZ 4.18Å; V25-F51 HydrophobicContact CG2-CE2 4.12Å; V25-F51 HydrophobicContact CG2-CZ 3.83Å; F30-F51 HydrophobicContact CD2-CD1 4.05Å; F30-F51 HydrophobicContact CD2-CE1 4.29Å; F30-F51 HydrophobicContact CD2-CG 4.29Å; F30-F51 AromaticContact CE2-CD1 3.78Å; F30-F51 HydrophobicContact CE2-CD1 3.78Å; F30-F51 HydrophobicContact CE2-CE1 4.11Å; F30-F51 HydrophobicContact CE2-CG 4.37Å; C32-F51 WeakPolarHBondContact CA-O 3.23Å; I33-F51 PolarHBondContact N-O 3.01Å; I33-F51 VanDerWaalsContact N-O 3.14Å; L39-F51 HydrophobicContact CD1-CB 3.65Å; F44-F51 HydrophobicContact CD2-CD1 4.22Å; F44-F51 HydrophobicContact CE2-CE1 4.48Å; V46-F51 HydrophobicContact CG2-CD1 3.91Å; V46-F51 HydrophobicContact CG2-CE1 3.77Å
52	Y	90.4	Very high	86.1	Confident	16 Å²	16	49 Å²	49	6%	0.063	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	142.1	-179.5	-62.3	-91.4	0	0	0	112.2	K34 F45 K47 N50 Y57 F61	K34-Y52 HydrophobicContact CG-CD1 4.3Å; K34-Y52 HydrophobicContact CG-CE1 4.13Å; F45-Y52 PolarHBondContact N-O 3.14Å; F45-Y52 PolarHBondContact O-N 3.12Å; K47-Y52 HydrophobicContact CB-CE2 4.29Å; N50-Y52 HydrophobicContact CB-CD2 4.45Å; N50-Y52 HydrophobicContact CB-CE2 3.58Å; N50-Y52 WeakPolarHBondContact O-CD2 3.37Å; Y52-Y57 HydrophobicContact CD2-CD2 4.28Å; Y52-Y57 HydrophobicContact CG-CD2 4.24Å; Y52-F61 HydrophobicContact CD1-CE2 4.32Å; Y52-F61 HydrophobicContact CD2-CE2 4.34Å; Y52-F61 AromaticContact CE1-CE2 3.92Å; Y52-F61 HydrophobicContact CE1-CE2 3.92Å; Y52-F61 HydrophobicContact CE1-CZ 4.48Å; Y52-F61 AromaticContact CE2-CE2 3.94Å; Y52-F61 HydrophobicContact CE2-CE2 3.94Å; Y52-F61 HydrophobicContact CE2-CZ 4.46Å; Y52-F61 AromaticContact CZ-CE2 3.72Å
53	C	90.9	Very high	87	Confident	11 Å²	11	49.4 Å²	49.4	7%	0.074	26%	0.264	C	S	.	.			trans	-77.1	159.8	164.4	88.1	0	0	0	0	109.8	C32 L39 N55 D56 Y57	C32-C53 HydrophobicContact CB-CB 4.1Å; C32-C53 PolarHBondContact SG-N 3.1Å; L39-C53 HydrophobicContact CD2-CB 3.64Å; C53-N55 VanDerWaalsContact C-N 3.32Å; C53-N55 PolarHBondContact O-N 3Å; C53-D56 PolarHBondContact O-N 2.87Å; C53-D56 PolarHBondContact SG-OD2 3Å; C53-Y57 WeakPolarHBondContact O-CB 3.44Å; C53-Y57 PolarHBondContact O-N 3.27Å
54	P	88	Confident	87.4	Confident	48 Å²	48	56 Å²	56	31%	0.312	29%	0.286	S	S	.	.	H	α-helix	trans	-56.1	-43.6	-174.5	-27.9	37.3	0	0	0	113.6	G43 F45 Y57 Q58	G43-P54 VanDerWaalsContact O-CD 3.28Å; G43-P54 WeakPolarHBondContact O-CD 3.36Å; G43-P54 VanDerWaalsContact O-CG 3.24Å; G43-P54 WeakPolarHBondContact O-CG 3.43Å; F45-P54 HydrophobicContact CE2-CB 4.1Å; F45-P54 HydrophobicContact CE2-CG 4.4Å; P54-Y57 PolarHBondContact O-N 3.18Å; P54-Q58 VanDerWaalsContact O-CB 3.24Å; P54-Q58 WeakPolarHBondContact O-CB 3.47Å; P54-Q58 PolarHBondContact O-N 3.16Å
55	N	88.9	Confident	87.6	Confident	107 Å²	107	55.7 Å²	55.7	57%	0.572	29%	0.285	S	S	*	.	H	α-helix	trans	-65.5	-42.2	-179.5	-54.7	38.1	0	0	0	111.9	C53 T59	C53-N55 VanDerWaalsContact C-N 3.32Å; C53-N55 PolarHBondContact O-N 3Å; N55-T59 WeakPolarHBondContact O-CB 3.24Å; N55-T59 WeakPolarHBondContact O-CG2 3.39Å; N55-T59 PolarHBondContact O-N 3.17Å; N55-T59 PolarHBondContact O-OG1 3.47Å
56	D	91.1	Very high	87.6	Confident	27 Å²	27	59.2 Å²	59.2	14%	0.144	30%	0.302	C	S	.	.	H	α-helix	trans	-72.6	-37.1	179.3	-62.3	-26.7	0	0	0	110.9	C32 K34 C35 C53 T59 Q60	C32-D56 PolarHBondContact SG-OD2 3.15Å; K34-D56 HydrophobicContact CB-CB 3.89Å; K34-D56 HydrophobicContact CG-CB 4.33Å; C35-D56 VanDerWaalsContact CB-OD2 3.25Å; C35-D56 WeakPolarHBondContact CB-OD2 3.49Å; C35-D56 PolarHBondContact N-OD2 3.28Å; C35-D56 PolarHBondContact SG-OD2 3.24Å; C53-D56 PolarHBondContact O-N 2.87Å; C53-D56 PolarHBondContact SG-OD2 3Å; D56-T59 WeakPolarHBondContact CA-OG1 3.47Å; D56-T59 PolarHBondContact O-OG1 3.24Å; D56-Q60 WeakPolarHBondContact O-CB 3.49Å; D56-Q60 VanDerWaalsContact O-CG 3.29Å; D56-Q60 WeakPolarHBondContact O-CG 3.34Å; D56-Q60 PolarHBondContact O-N 3.14Å
57	Y	90.2	Very high	87.6	Confident	11 Å²	11	61.3 Å²	61.3	4%	0.043	32%	0.315	C	S	.	.	H	α-helix	trans	-62.5	-47.9	173.7	-171.2	-95.8	0	0	0	111.2	F45 K47 Y52 C53 P54 Q60 F61 S247	F45-Y57 HydrophobicContact CB-CD1 4.11Å; F45-Y57 HydrophobicContact CB-CD2 3.4Å; F45-Y57 VanDerWaalsContact CB-CD2 3.4Å; F45-Y57 HydrophobicContact CB-CE2 3.97Å; F45-Y57 HydrophobicContact CB-CG 3.52Å; F45-Y57 AromaticContact CD1-CD1 3.68Å; F45-Y57 HydrophobicContact CD1-CD1 3.68Å; F45-Y57 HydrophobicContact CD1-CD2 4.41Å; F45-Y57 AromaticContact CD1-CE1 3.85Å; F45-Y57 HydrophobicContact CD1-CE1 3.85Å; F45-Y57 HydrophobicContact CD1-CG 4.02Å; F45-Y57 AromaticContact CD2-CD1 3.83Å; F45-Y57 HydrophobicContact CD2-CD1 3.83Å; F45-Y57 HydrophobicContact CD2-CD2 4.46Å; F45-Y57 AromaticContact CD2-CG 3.68Å; F45-Y57 HydrophobicContact CD2-CG 3.68Å; F45-Y57 AromaticContact CE1-CD1 3.94Å; F45-Y57 HydrophobicContact CE1-CD1 3.94Å; F45-Y57 HydrophobicContact CE1-CE1 4.12Å; F45-Y57 HydrophobicContact CE2-CD1 4.09Å; F45-Y57 HydrophobicContact CE2-CG 4.35Å; F45-Y57 AromaticContact CG-CD1 3.61Å; F45-Y57 HydrophobicContact CG-CD1 3.61Å; F45-Y57 AromaticContact CG-CD2 3.89Å; F45-Y57 HydrophobicContact CG-CD2 3.89Å; F45-Y57 HydrophobicContact CG-CE1 4.19Å; F45-Y57 HydrophobicContact CG-CE2 4.43Å; F45-Y57 AromaticContact CG-CG 3.48Å; F45-Y57 HydrophobicContact CG-CG 3.48Å; F45-Y57 VanDerWaalsContact CG-CG 3.48Å; F45-Y57 HydrophobicContact CZ-CD1 4.12Å; K47-Y57 HydrophobicContact CB-CE2 4.09Å; K47-Y57 HydrophobicContact CD-CE2 3.94Å; Y52-Y57 HydrophobicContact CD2-CD2 4.28Å; Y52-Y57 HydrophobicContact CG-CD2 4.24Å; C53-Y57 WeakPolarHBondContact O-CB 3.44Å; C53-Y57 PolarHBondContact O-N 3.27Å; P54-Y57 PolarHBondContact O-N 3.18Å; Y57-Q60 PolarHBondContact O-N 3.49Å; Y57-F61 AromaticContact CD2-CD2 3.51Å; Y57-F61 HydrophobicContact CD2-CD2 3.51Å; Y57-F61 HydrophobicContact CD2-CE2 4.1Å; Y57-F61 HydrophobicContact CD2-CG 4.5Å; Y57-F61 HydrophobicContact CE1-CB 4.23Å; Y57-F61 HydrophobicContact CE2-CB 4.15Å; Y57-F61 AromaticContact CE2-CD2 3.38Å; Y57-F61 HydrophobicContact CE2-CD2 3.38Å; Y57-F61 HydrophobicContact CE2-CE2 4.05Å; Y57-F61 HydrophobicContact CE2-CG 4.06Å; Y57-F61 HydrophobicContact CG-CD2 4.24Å; Y57-F61 WeakPolarHBondContact O-CA 3.43Å; Y57-F61 WeakPolarHBondContact O-CB 3.47Å; Y57-F61 PolarHBondContact O-N 3.29Å; Y57-S247 VanDerWaalsContact OH-CB 3.27Å; Y57-S247 WeakPolarHBondContact OH-CB 3.47Å
58	Q	89.4	Confident	87.9	Confident	52 Å²	52	62 Å²	62	24%	0.243	33%	0.326	C	S	.	.	H	α-helix	trans	-65.6	-38.8	178.6	-178.5	171.5	71.2	0	0	112.5	P54 G62 Y71 E73	P54-Q58 VanDerWaalsContact O-CB 3.24Å; P54-Q58 WeakPolarHBondContact O-CB 3.47Å; P54-Q58 PolarHBondContact O-N 3.16Å; Q58-G62 WeakPolarHBondContact O-CA 3.33Å; Q58-G62 PolarHBondContact O-N 3.46Å; Q58-Y71 HydrophobicContact CG-CD1 3.77Å; Q58-Y71 HydrophobicContact CG-CD2 3.54Å; Q58-Y71 HydrophobicContact CG-CE1 4.27Å; Q58-Y71 HydrophobicContact CG-CE2 4.08Å; Q58-Y71 HydrophobicContact CG-CG 3.38Å; Q58-Y71 WeakPolarHBondContact O-CE1 3.34Å; Q58-E73 PolarHBondContact NE2-OE1 3.3Å
59	T	88	Confident	88.1	Confident	86 Å²	86	63.1 Å²	63.1	53%	0.528	33%	0.327	S	S	.	.	H	α-helix	trans	-74.9	-26.4	177.4	48.5	0	0	0	0	114	N55 D56	N55-T59 WeakPolarHBondContact O-CB 3.24Å; N55-T59 WeakPolarHBondContact O-CG2 3.39Å; N55-T59 PolarHBondContact O-N 3.17Å; N55-T59 PolarHBondContact O-OG1 3.47Å; D56-T59 WeakPolarHBondContact CA-OG1 3.47Å; D56-T59 PolarHBondContact O-OG1 3.24Å
60	Q	87.1	Confident	88.5	Confident	87 Å²	87	58 Å²	58	41%	0.407	31%	0.311	S	S	.	.	H	α-helix	trans	-90.3	-30.9	176.2	-67.4	-129.6	-88.6	0	0	114.2	K34 D56 Y57	K34-Q60 VanDerWaalsContact NZ-OE1 3.16Å; D56-Q60 WeakPolarHBondContact O-CB 3.49Å; D56-Q60 VanDerWaalsContact O-CG 3.29Å; D56-Q60 WeakPolarHBondContact O-CG 3.34Å; D56-Q60 PolarHBondContact O-N 3.14Å; Y57-Q60 PolarHBondContact O-N 3.49Å
61	F	86.9	Confident	88.7	Confident	56 Å²	56	58.5 Å²	58.5	25%	0.246	31%	0.309	C	S	.	.	H	α-helix	trans	-135.8	1.4	-169.2	-51	-66.8	0	0	0	114.4	K47 Y52 Y57	K47-F61 HydrophobicContact CD-CD1 4.2Å; K47-F61 HydrophobicContact CD-CD2 4.13Å; K47-F61 HydrophobicContact CD-CE1 4.09Å; K47-F61 HydrophobicContact CD-CE2 4.02Å; K47-F61 HydrophobicContact CD-CG 4.2Å; K47-F61 HydrophobicContact CD-CZ 3.98Å; K47-F61 VanDerWaalsContact NZ-CD1 3.31Å; Y52-F61 HydrophobicContact CD1-CE2 4.32Å; Y52-F61 HydrophobicContact CD2-CE2 4.34Å; Y52-F61 AromaticContact CE1-CE2 3.92Å; Y52-F61 HydrophobicContact CE1-CE2 3.92Å; Y52-F61 HydrophobicContact CE1-CZ 4.48Å; Y52-F61 AromaticContact CE2-CE2 3.94Å; Y52-F61 HydrophobicContact CE2-CE2 3.94Å; Y52-F61 HydrophobicContact CE2-CZ 4.46Å; Y52-F61 AromaticContact CZ-CE2 3.72Å; Y57-F61 AromaticContact CD2-CD2 3.51Å; Y57-F61 HydrophobicContact CD2-CD2 3.51Å; Y57-F61 HydrophobicContact CD2-CE2 4.1Å; Y57-F61 HydrophobicContact CD2-CG 4.5Å; Y57-F61 HydrophobicContact CE1-CB 4.23Å; Y57-F61 HydrophobicContact CE2-CB 4.15Å; Y57-F61 AromaticContact CE2-CD2 3.38Å; Y57-F61 HydrophobicContact CE2-CD2 3.38Å; Y57-F61 HydrophobicContact CE2-CE2 4.05Å; Y57-F61 HydrophobicContact CE2-CG 4.06Å; Y57-F61 HydrophobicContact CG-CD2 4.24Å; Y57-F61 WeakPolarHBondContact O-CA 3.43Å; Y57-F61 WeakPolarHBondContact O-CB 3.47Å; Y57-F61 PolarHBondContact O-N 3.29Å
62	G	85.3	Confident	88.6	Confident	26 Å²	26	59.1 Å²	59.1	27%	0.268	31%	0.313	S	S	.	.			trans	-73.2	130.4	-179.6	0	0	0	0	0	112.7	Q58	Q58-G62 WeakPolarHBondContact O-CA 3.33Å; Q58-G62 PolarHBondContact O-N 3.46Å
63	V	89	Confident	88.1	Confident	55 Å²	55	65.4 Å²	65.4	33%	0.333	34%	0.343	S	S	.	.			trans	-68.7	131.4	171.9	176.4	0	0	0	0	109.3	Y71 V72 T83	V63-Y71 CarbonylContact O-C 3.54Å; V63-Y71 VanDerWaalsContact O-CA 3.29Å; V63-Y71 WeakPolarHBondContact O-CA 3.43Å; V63-V72 PolarHBondContact O-N 3.1Å; V63-T83 HydrophobicContact CG1-CG2 3.6Å; V63-T83 WeakPolarHBondContact CG1-OG1 3.48Å
64	R	90.3	Very high	87.6	Confident	147 Å²	147	68.4 Å²	68.4	56%	0.555	38%	0.375	S	S	*	.	B	Isolated β-bridge	trans	-108.9	137.4	-179.1	-69.3	-175.7	-67.6	150.7	-0.1	111.3	Q69 G70 Y71 T83	R64-Q69 WeakPolarHBondContact CD-O 3.43Å; R64-G70 WeakPolarHBondContact CA-O 3.5Å; R64-Y71 HydrophobicContact CG-CD1 3.51Å; R64-Y71 HydrophobicContact CG-CE1 3.48Å; R64-Y71 VanDerWaalsContact CG-CE1 3.48Å; R64-Y71 HydrophobicContact CG-CG 4.37Å; R64-T83 PolarHBondContact O-OG1 2.97Å; R64-T83 VanDerWaalsContact O-OG1 3.13Å
65	C	91.6	Very high	87.2	Confident	1 Å²	1	71.9 Å²	71.9	1%	0.007	39%	0.388	C	S	.	.			trans	-70.5	130.8	176	173.1	0	0	0	0	111.5	T67 C68 Q69 G70 V72 T83 H85 C88	C65-T67 VanDerWaalsContact C-N 3.27Å; C65-T67 PolarHBondContact O-N 2.9Å; C65-T67 PolarHBondContact SG-N 2.99Å; C65-C68 VanDerWaalsContact SG-SG 3.7Å; C65-Q69 WeakPolarHBondContact O-CA 3.38Å; C65-Q69 PolarHBondContact O-N 2.98Å; C65-G70 PolarHBondContact N-O 3.41Å; C65-V72 HydrophobicContact CB-CG2 3.87Å; C65-T83 WeakPolarHBondContact CA-O 3.39Å; C65-H85 VanDerWaalsContact CB-CE1 3.41Å; C65-H85 WeakPolarHBondContact CB-CE1 3.27Å; C65-H85 WeakPolarHBondContact CB-ND1 3.21Å; C65-H85 PolarHBondContact SG-ND1 3.28Å; C65-C88 VanDerWaalsContact SG-CB 3.57Å; C65-C88 VanDerWaalsContact SG-SG 3.63Å
66	E	87.3	Confident	87.1	Confident	107 Å²	107	68.8 Å²	68.8	50%	0.5	37%	0.372	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.3	-36.9	178.7	-173	81.3	150.9	0	0	112.5	K82 T83 F84	E66-K82 HydrophobicContact CG-CD 4.09Å; E66-K82 WeakPolarHBondContact OE1-CD 3.31Å; E66-K82 WeakPolarHBondContact OE1-CE 3.4Å; E66-K82 IonicContact OE1-NZ 3.85Å; E66-K82 PolarHBondContact OE1-NZ 2.85Å; E66-T83 PolarHBondContact N-O 3.31Å; E66-T83 VanDerWaalsContact N-O 3.16Å; E66-F84 HydrophobicContact CB-CD1 4.36Å; E66-F84 HydrophobicContact CB-CE1 3.68Å; E66-F84 HydrophobicContact CB-CZ 4.02Å; E66-F84 HydrophobicContact CG-CE1 4.38Å
67	T	86.6	Confident	86.8	Confident	73 Å²	73	68.2 Å²	68.2	45%	0.448	37%	0.37	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.4	-32.9	-173	-49.2	0	0	0	0	114.4	C65 F84 C88	C65-T67 VanDerWaalsContact C-N 3.27Å; C65-T67 PolarHBondContact O-N 2.9Å; C65-T67 PolarHBondContact SG-N 2.99Å; T67-F84 VanDerWaalsContact OG1-CD1 3.29Å; T67-F84 WeakPolarHBondContact OG1-CD1 3.4Å; T67-F84 WeakPolarHBondContact OG1-CE1 3.22Å; T67-C88 HydrophobicContact CG2-CB 4.48Å
68	C	89.7	Confident	86.6	Confident	65 Å²	65	71.3 Å²	71.3	44%	0.439	39%	0.39	S	S	.	.	T	Hydrogen-bonded Turn	trans	-125.3	-3.9	-174.2	73.8	0	0	0	0	114.3	C65 G70 H85	C65-C68 VanDerWaalsContact SG-SG 3.7Å; C68-G70 PolarHBondContact O-N 2.67Å; C68-H85 PolarHBondContact SG-CE1 3.15Å; C68-H85 PolarHBondContact SG-ND1 3.49Å; C68-H85 VanDerWaalsContact SG-ND1 3.42Å
69	Q	87.2	Confident	86.3	Confident	143 Å²	143	69 Å²	69	67%	0.668	38%	0.379	S	S	*	.			trans	59.9	-5.1	-178.7	-55	-176.3	6.2	0	0	116.3	R64 C65	R64-Q69 WeakPolarHBondContact CD-O 3.43Å; C65-Q69 WeakPolarHBondContact O-CA 3.38Å; C65-Q69 PolarHBondContact O-N 2.98Å
70	G	87.2	Confident	86.1	Confident	31 Å²	31	71.1 Å²	71.1	32%	0.32	39%	0.387	S	S	.	.	S	Bend	trans	-69.1	154.8	170.7	0	0	0	0	0	112.6	R64 C65 C68 H85	R64-G70 WeakPolarHBondContact CA-O 3.5Å; C65-G70 PolarHBondContact N-O 3.41Å; C68-G70 PolarHBondContact O-N 2.67Å; G70-H85 PolarHBondContact O-CE1 3.42Å
71	Y	89	Confident	85.9	Confident	76 Å²	76	70.7 Å²	70.7	30%	0.298	41%	0.406	S	S	.	.	B	Isolated β-bridge	trans	-68.3	142.6	177	-57.8	-75	0	0	0	111.5	Q58 V63 R64 H85	Q58-Y71 HydrophobicContact CG-CD1 3.77Å; Q58-Y71 HydrophobicContact CG-CD2 3.54Å; Q58-Y71 HydrophobicContact CG-CE1 4.27Å; Q58-Y71 HydrophobicContact CG-CE2 4.08Å; Q58-Y71 HydrophobicContact CG-CG 3.38Å; Q58-Y71 WeakPolarHBondContact O-CE1 3.34Å; V63-Y71 CarbonylContact O-C 3.54Å; V63-Y71 VanDerWaalsContact O-CA 3.29Å; V63-Y71 WeakPolarHBondContact O-CA 3.43Å; R64-Y71 HydrophobicContact CG-CD1 3.51Å; R64-Y71 HydrophobicContact CG-CE1 3.48Å; R64-Y71 VanDerWaalsContact CG-CE1 3.48Å; R64-Y71 HydrophobicContact CG-CG 4.37Å; Y71-H85 PolarHBondContact O-CE1 2.93Å; Y71-H85 PolarHBondContact O-NE2 3.34Å
72	V	85.8	Confident	85.9	Confident	17 Å²	17	72.1 Å²	72.1	10%	0.103	41%	0.412	C	S	.	.	P	Polyproline II helix	trans	-96	126	177.7	-157.8	0	0	0	0	109.7	V63 C65 V76	V63-V72 PolarHBondContact O-N 3.1Å; C65-V72 HydrophobicContact CB-CG2 3.87Å; V72-V76 HydrophobicContact CB-CG2 4.25Å; V72-V76 HydrophobicContact CG1-CB 4.27Å; V72-V76 HydrophobicContact CG1-CG1 4.16Å; V72-V76 HydrophobicContact CG1-CG2 3.74Å
73	E	79.7	Confident	86.1	Confident	147 Å²	147	72.3 Å²	72.3	69%	0.687	41%	0.408	S	S	*	.			trans	-121.9	139.8	176.2	-65.5	-177.1	-168.9	0	0	109.4	Q58	Q58-E73 PolarHBondContact NE2-OE1 3.3Å
74	G	80.8	Confident	86.1	Confident	74 Å²	74	69.8 Å²	69.8	76%	0.763	39%	0.393	S	S	*	.	S	Bend	trans	77.3	-124.2	-179.7	0	0	0	0	0	113.1	V76	G74-V76 PolarHBondContact O-N 2.91Å
75	E	80.4	Confident	86.1	Confident	122 Å²	122	64 Å²	64	57%	0.57	37%	0.372	S	S	*	.	S	Bend	trans	-74.6	121.6	-176.5	-70.6	160	-154.3	0	0	111.4	T86	E75-T86 HydrophobicContact CB-CG2 3.88Å
76	V	85.5	Confident	85.9	Confident	41 Å²	41	67.1 Å²	67.1	25%	0.248	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	130.6	-178.7	-169.9	0	0	0	0	109.1	V72 G74 T78 T83	V72-V76 HydrophobicContact CB-CG2 4.25Å; V72-V76 HydrophobicContact CG1-CB 4.27Å; V72-V76 HydrophobicContact CG1-CG1 4.16Å; V72-V76 HydrophobicContact CG1-CG2 3.74Å; G74-V76 PolarHBondContact O-N 2.91Å; V76-T78 HydrophobicContact CG1-CG2 4.04Å; V76-T83 HydrophobicContact CG1-CG2 4.14Å
77	V	85.7	Confident	85.9	Confident	16 Å²	16	67.1 Å²	67.1	10%	0.097	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	121.5	167.4	-169	0	0	0	0	108.3	V79 F84 T86 F89 I237	V77-V79 HydrophobicContact CG1-CG2 4.01Å; V77-F84 HydrophobicContact CB-CB 4.47Å; V77-F84 PolarHBondContact N-O 3.37Å; V77-F84 PolarHBondContact O-N 2.85Å; V77-T86 HydrophobicContact CG2-CG2 4.17Å; V77-F89 HydrophobicContact CB-CB 4.23Å; V77-F89 HydrophobicContact CB-CD1 4.47Å; V77-F89 HydrophobicContact CB-CG 4.35Å; V77-F89 HydrophobicContact CG1-CB 4.35Å; V77-F89 HydrophobicContact CG1-CD1 3.7Å; V77-F89 HydrophobicContact CG1-CE1 4.17Å; V77-F89 HydrophobicContact CG1-CG 3.94Å; V77-F89 HydrophobicContact CG2-CB 4.28Å; V77-I237 HydrophobicContact CG1-CG1 4.4Å; V77-I237 HydrophobicContact CG1-CG2 4.49Å
78	T	87	Confident	86	Confident	76 Å²	76	64.2 Å²	64.2	47%	0.466	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	124	179.6	48.9	0	0	0	0	110.7	V76 K82 T83	V76-T78 HydrophobicContact CG1-CG2 4.04Å; T78-K82 WeakPolarHBondContact CA-O 3.46Å; T78-T83 HydrophobicContact CG2-CG2 3.89Å
79	V	82.3	Confident	85.9	Confident	3 Å²	3	61.3 Å²	61.3	2%	0.018	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	119.6	-175.9	-174	0	0	0	0	109.8	V77 G81 K82 F84 F89 I106 Y111 V235	V77-V79 HydrophobicContact CG1-CG2 4.01Å; V79-G81 PolarHBondContact O-N 3.29Å; V79-K82 PolarHBondContact N-O 3.3Å; V79-K82 WeakPolarHBondContact O-CB 3.44Å; V79-K82 PolarHBondContact O-N 2.94Å; V79-F84 HydrophobicContact CB-CE2 4.37Å; V79-F89 HydrophobicContact CB-CE2 4.38Å; V79-F89 HydrophobicContact CG2-CD2 4.33Å; V79-F89 HydrophobicContact CG2-CE1 4.32Å; V79-F89 HydrophobicContact CG2-CE2 3.7Å; V79-F89 HydrophobicContact CG2-CZ 3.71Å; V79-I106 HydrophobicContact CG1-CD1 3.71Å; V79-Y111 HydrophobicContact CB-CE1 4.38Å; V79-Y111 HydrophobicContact CG1-CE1 3.84Å; V79-V235 HydrophobicContact CG1-CG1 4.29Å; V79-V235 HydrophobicContact CG1-CG2 4.3Å; V79-V235 HydrophobicContact CG2-CG1 4.23Å
80	L	82.9	Confident	86.1	Confident	131 Å²	131	60.1 Å²	60.1	69%	0.686	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.9	41.3	-175.6	-57	-177.5	0	0	0	113.2	K82 I106	L80-K82 PolarHBondContact O-N 3.42Å; L80-I106 HydrophobicContact CD1-CD1 3.58Å; L80-I106 HydrophobicContact CG-CD1 3.97Å
81	G	83.2	Confident	86.3	Confident	78 Å²	78	58.6 Å²	58.6	80%	0.804	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.4	-10.4	-178.1	0	0	0	0	0	115.5	V79	V79-G81 PolarHBondContact O-N 3.29Å
82	K	87.3	Confident	86.2	Confident	85 Å²	85	58.4 Å²	58.4	37%	0.37	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	150.1	172.3	-60.9	-167.7	177.8	-165	0	110.9	E66 T78 V79 L80 F84	E66-K82 HydrophobicContact CG-CD 4.09Å; E66-K82 WeakPolarHBondContact OE1-CD 3.31Å; E66-K82 WeakPolarHBondContact OE1-CE 3.4Å; E66-K82 IonicContact OE1-NZ 3.85Å; E66-K82 PolarHBondContact OE1-NZ 2.85Å; T78-K82 WeakPolarHBondContact CA-O 3.46Å; V79-K82 PolarHBondContact N-O 3.3Å; V79-K82 WeakPolarHBondContact O-CB 3.44Å; V79-K82 PolarHBondContact O-N 2.94Å; L80-K82 PolarHBondContact O-N 3.42Å; K82-F84 HydrophobicContact CB-CE2 3.67Å; K82-F84 HydrophobicContact CB-CZ 3.91Å
83	T	89.6	Confident	86.3	Confident	31 Å²	31	61.9 Å²	61.9	19%	0.19	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	142	-176.5	56.2	0	0	0	0	110.7	V63 R64 C65 E66 V76 T78	V63-T83 HydrophobicContact CG1-CG2 3.6Å; V63-T83 WeakPolarHBondContact CG1-OG1 3.48Å; R64-T83 PolarHBondContact O-OG1 2.97Å; R64-T83 VanDerWaalsContact O-OG1 3.13Å; C65-T83 WeakPolarHBondContact CA-O 3.39Å; E66-T83 PolarHBondContact N-O 3.31Å; E66-T83 VanDerWaalsContact N-O 3.16Å; V76-T83 HydrophobicContact CG1-CG2 4.14Å; T78-T83 HydrophobicContact CG2-CG2 3.89Å
84	F	89.1	Confident	86.7	Confident	2 Å²	2	57.7 Å²	57.7	1%	0.009	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	145.9	-176.9	-57.8	-87.7	0	0	0	110.5	E66 T67 V77 V79 K82 F89 Y111	E66-F84 HydrophobicContact CB-CD1 4.36Å; E66-F84 HydrophobicContact CB-CE1 3.68Å; E66-F84 HydrophobicContact CB-CZ 4.02Å; E66-F84 HydrophobicContact CG-CE1 4.38Å; T67-F84 VanDerWaalsContact OG1-CD1 3.29Å; T67-F84 WeakPolarHBondContact OG1-CD1 3.4Å; T67-F84 WeakPolarHBondContact OG1-CE1 3.22Å; V77-F84 HydrophobicContact CB-CB 4.47Å; V77-F84 PolarHBondContact N-O 3.37Å; V77-F84 PolarHBondContact O-N 2.85Å; V79-F84 HydrophobicContact CB-CE2 4.37Å; K82-F84 HydrophobicContact CB-CE2 3.67Å; K82-F84 HydrophobicContact CB-CZ 3.91Å; F84-F89 HydrophobicContact CB-CB 4.09Å; F84-F89 HydrophobicContact CD2-CD2 4.09Å; F84-F89 HydrophobicContact CE2-CD2 4.5Å; F84-F89 HydrophobicContact CG-CD2 4.2Å; F84-Y111 HydrophobicContact CE1-CE2 4.09Å; F84-Y111 HydrophobicContact CE2-CE2 4.33Å; F84-Y111 AromaticContact CZ-CE2 3.61Å; F84-Y111 HydrophobicContact CZ-CE2 3.61Å; F84-Y111 AromaticContact CZ-CZ 3.66Å; F84-Y111 VanDerWaalsContact CZ-OH 3.28Å; F84-Y111 WeakPolarHBondContact CZ-OH 3.3Å
85	H	91	Very high	87	Confident	26 Å²	26	63.2 Å²	63.2	12%	0.12	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.3	149.1	158.5	-54.7	87.6	0	0	0	109.8	C65 C68 G70 Y71 H87 C88 F89	C65-H85 VanDerWaalsContact CB-CE1 3.41Å; C65-H85 WeakPolarHBondContact CB-CE1 3.27Å; C65-H85 WeakPolarHBondContact CB-ND1 3.21Å; C65-H85 PolarHBondContact SG-ND1 3.28Å; C68-H85 PolarHBondContact SG-CE1 3.15Å; C68-H85 PolarHBondContact SG-ND1 3.49Å; C68-H85 VanDerWaalsContact SG-ND1 3.42Å; G70-H85 PolarHBondContact O-CE1 3.42Å; Y71-H85 PolarHBondContact O-CE1 2.93Å; Y71-H85 PolarHBondContact O-NE2 3.34Å; H85-H87 VanDerWaalsContact CB-CE1 3.4Å; H85-H87 WeakPolarHBondContact CB-CE1 3.21Å; H85-H87 AromaticContact CD2-CE1 3.84Å; H85-H87 AromaticContact CG-CE1 3.59Å; H85-H87 PolarHBondContact O-N 3.37Å; H85-H87 VanDerWaalsContact O-N 3.14Å; H85-C88 HydrophobicContact CB-CB 4.12Å; H85-C88 WeakPolarHBondContact O-CA 3.47Å; H85-C88 WeakPolarHBondContact O-CB 3.09Å; H85-C88 PolarHBondContact O-N 3.32Å; H85-F89 PolarHBondContact O-N 2.95Å; H85-F89 VanDerWaalsContact O-N 3.08Å
86	T	87.1	Confident	87.3	Confident	66 Å²	66	61.6 Å²	61.6	41%	0.405	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	-49.5	-37.7	172.5	52.9	0	0	0	0	113.3	E75 V77	E75-T86 HydrophobicContact CB-CG2 3.88Å; V77-T86 HydrophobicContact CG2-CG2 4.17Å
87	H	87	Confident	87.3	Confident	107 Å²	107	63.2 Å²	63.2	50%	0.495	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.5	-13.3	177.7	67.7	-97.5	0	0	0	114.8	H85	H85-H87 VanDerWaalsContact CB-CE1 3.4Å; H85-H87 WeakPolarHBondContact CB-CE1 3.21Å; H85-H87 AromaticContact CD2-CE1 3.84Å; H85-H87 AromaticContact CG-CE1 3.59Å; H85-H87 PolarHBondContact O-N 3.37Å; H85-H87 VanDerWaalsContact O-N 3.14Å
88	C	88.4	Confident	87.3	Confident	11 Å²	11	63.3 Å²	63.3	7%	0.074	33%	0.334	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.8	-30.8	174.4	-73.2	0	0	0	0	112.1	C65 T67 H85 R90	C65-C88 VanDerWaalsContact SG-CB 3.57Å; C65-C88 VanDerWaalsContact SG-SG 3.63Å; T67-C88 HydrophobicContact CG2-CB 4.48Å; H85-C88 HydrophobicContact CB-CB 4.12Å; H85-C88 WeakPolarHBondContact O-CA 3.47Å; H85-C88 WeakPolarHBondContact O-CB 3.09Å; H85-C88 PolarHBondContact O-N 3.32Å; C88-R90 PolarHBondContact O-N 2.82Å
89	F	88.2	Confident	87	Confident	4 Å²	4	64.6 Å²	64.6	2%	0.018	34%	0.338	C	S	.	.			trans	-73.9	88.5	177.2	-164.1	-117.5	0	0	0	110.7	V77 V79 F84 H85 F98 T104 Y111 I237	V77-F89 HydrophobicContact CB-CB 4.23Å; V77-F89 HydrophobicContact CB-CD1 4.47Å; V77-F89 HydrophobicContact CB-CG 4.35Å; V77-F89 HydrophobicContact CG1-CB 4.35Å; V77-F89 HydrophobicContact CG1-CD1 3.7Å; V77-F89 HydrophobicContact CG1-CE1 4.17Å; V77-F89 HydrophobicContact CG1-CG 3.94Å; V77-F89 HydrophobicContact CG2-CB 4.28Å; V79-F89 HydrophobicContact CB-CE2 4.38Å; V79-F89 HydrophobicContact CG2-CD2 4.33Å; V79-F89 HydrophobicContact CG2-CE1 4.32Å; V79-F89 HydrophobicContact CG2-CE2 3.7Å; V79-F89 HydrophobicContact CG2-CZ 3.71Å; F84-F89 HydrophobicContact CB-CB 4.09Å; F84-F89 HydrophobicContact CD2-CD2 4.09Å; F84-F89 HydrophobicContact CE2-CD2 4.5Å; F84-F89 HydrophobicContact CG-CD2 4.2Å; H85-F89 PolarHBondContact O-N 2.95Å; H85-F89 VanDerWaalsContact O-N 3.08Å; F89-F98 HydrophobicContact CD1-CB 3.98Å; F89-F98 AromaticContact CD1-CD2 3.3Å; F89-F98 HydrophobicContact CD1-CD2 3.3Å; F89-F98 HydrophobicContact CD1-CE2 4.09Å; F89-F98 HydrophobicContact CD1-CG 4.02Å; F89-F98 HydrophobicContact CD2-CD2 4.37Å; F89-F98 HydrophobicContact CD2-CE2 4.4Å; F89-F98 HydrophobicContact CE1-CB 3.89Å; F89-F98 AromaticContact CE1-CD2 3.25Å; F89-F98 HydrophobicContact CE1-CD2 3.25Å; F89-F98 AromaticContact CE1-CE2 3.86Å; F89-F98 HydrophobicContact CE1-CE2 3.86Å; F89-F98 AromaticContact CE1-CG 3.75Å; F89-F98 HydrophobicContact CE1-CG 3.75Å; F89-F98 HydrophobicContact CE2-CD2 4.32Å; F89-F98 HydrophobicContact CE2-CE2 4.18Å; F89-F98 AromaticContact CG-CD2 3.88Å; F89-F98 HydrophobicContact CG-CD2 3.88Å; F89-F98 HydrophobicContact CG-CE2 4.33Å; F89-F98 AromaticContact CZ-CD2 3.78Å; F89-F98 HydrophobicContact CZ-CD2 3.78Å; F89-F98 AromaticContact CZ-CE2 3.89Å; F89-F98 HydrophobicContact CZ-CE2 3.89Å; F89-F98 HydrophobicContact CZ-CG 4.47Å; F89-F98 WeakPolarHBondContact O-CD2 3.41Å; F89-T104 HydrophobicContact CE1-CG2 4.1Å; F89-T104 HydrophobicContact CZ-CG2 4.14Å; F89-Y111 AromaticContact CE2-CD1 3.56Å; F89-Y111 HydrophobicContact CE2-CD1 3.56Å; F89-Y111 HydrophobicContact CE2-CD2 4.33Å; F89-Y111 AromaticContact CE2-CE1 3.91Å; F89-Y111 HydrophobicContact CE2-CE1 3.91Å; F89-Y111 AromaticContact CE2-CG 3.81Å; F89-Y111 HydrophobicContact CE2-CG 3.81Å; F89-Y111 HydrophobicContact CZ-CD1 4.12Å; F89-I237 HydrophobicContact CD1-CD1 4.12Å; F89-I237 HydrophobicContact CE1-CD1 4Å; F89-I237 HydrophobicContact CE1-CG1 4.44Å
90	R	90.7	Very high	86.6	Confident	118 Å²	118	67.9 Å²	67.9	45%	0.445	36%	0.361	S	S	.	.	B	Isolated β-bridge	trans	-138.8	152.3	-176.2	72	-170.4	175	-171.1	-4.7	111.3	C88 R96 L97	C88-R90 PolarHBondContact O-N 2.82Å; R90-R96 WeakPolarHBondContact CA-O 3.37Å; R90-L97 HydrophobicContact CB-CD2 4.09Å
91	C	91	Very high	86.1	Confident	0 Å²	0	63.5 Å²	63.5	0%	0	35%	0.348	C	S	.	.			trans	-64	136.4	176	172.9	0	0	0	0	111.6	T93 C94 R95 R96 F98 Y111 C113 C116	C91-T93 PolarHBondContact SG-N 3.23Å; C91-C94 VanDerWaalsContact CB-SG 3.53Å; C91-C94 VanDerWaalsContact SG-SG 3.63Å; C91-R95 WeakPolarHBondContact O-CA 3.27Å; C91-R95 PolarHBondContact O-N 3.48Å; C91-R96 PolarHBondContact N-O 2.85Å; C91-F98 HydrophobicContact CB-CE1 4.16Å; C91-F98 HydrophobicContact CB-CZ 3.87Å; C91-Y111 CarbonylContact C-O 3.52Å; C91-Y111 VanDerWaalsContact CA-O 3.3Å; C91-Y111 WeakPolarHBondContact CA-O 3.45Å; C91-C113 HydrophobicContact CB-CB 4.08Å; C91-C113 PolarHBondContact SG-N 3.28Å; C91-C113 VanDerWaalsContact SG-N 3.4Å; C91-C116 PolarHBondContact SG-SG 2.92Å
92	T	87	Confident	85.9	Confident	71 Å²	71	61.8 Å²	61.8	44%	0.436	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-42.5	178.6	52.1	0	0	0	0	112.9	Y111 Y112	T92-Y111 PolarHBondContact N-O 2.88Å; T92-Y111 PolarHBondContact OG1-O 2.95Å; T92-Y112 VanDerWaalsContact OG1-CE1 3.28Å; T92-Y112 WeakPolarHBondContact OG1-CE1 3.5Å
93	T	87.3	Confident	85.6	Confident	90 Å²	90	63 Å²	63	55%	0.552	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.9	-54.2	-178.3	-41.4	0	0	0	0	112.7	C91 Y112	C91-T93 PolarHBondContact SG-N 3.23Å; T93-Y112 WeakPolarHBondContact OG1-CD1 3.48Å; T93-Y112 WeakPolarHBondContact OG1-CE1 3.48Å
94	C	89.3	Confident	85.3	Confident	60 Å²	60	61.6 Å²	61.6	41%	0.405	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.2	-6.7	-170.7	73.4	0	0	0	0	114.6	C91 R96 C116	C91-C94 VanDerWaalsContact CB-SG 3.53Å; C91-C94 VanDerWaalsContact SG-SG 3.63Å; C94-R96 PolarHBondContact O-N 2.97Å; C94-C116 PolarHBondContact SG-SG 2.67Å
95	R	87.1	Confident	85.1	Confident	189 Å²	189	63.6 Å²	63.6	71%	0.713	33%	0.325	S	S	*	.			trans	58.1	4.8	-178.6	-56.4	-177.7	-179	-176.9	0.6	116.3	C91	C91-R95 WeakPolarHBondContact O-CA 3.27Å; C91-R95 PolarHBondContact O-N 3.48Å
96	R	86.1	Confident	84.8	Confident	89 Å²	89	65 Å²	65	34%	0.336	33%	0.332	S	S	.	.	P	Polyproline II helix	trans	-65	138.7	172.6	-164.7	-178.2	57.6	81.9	10.7	110	R90 C91 C94 N99 E102	R90-R96 WeakPolarHBondContact CA-O 3.37Å; C91-R96 PolarHBondContact N-O 2.85Å; C94-R96 PolarHBondContact O-N 2.97Å; R96-N99 PolarHBondContact NH1-OD1 2.68Å; R96-E102 IonicContact CZ-OE1 2.82Å; R96-E102 IonicContact CZ-OE2 2.66Å; R96-E102 IonicContact NH1-OE1 3.82Å; R96-E102 IonicContact NH1-OE2 3.22Å; R96-E102 PolarHBondContact NH1-OE2 3.4Å; R96-E102 IonicContact NH2-OE1 3.05Å; R96-E102 PolarHBondContact NH2-OE1 3.05Å; R96-E102 IonicContact NH2-OE2 3.72Å; R96-E102 PolarHBondContact NH2-OE2 2.99Å
97	L	86.9	Confident	84.8	Confident	75 Å²	75	64.7 Å²	64.7	39%	0.393	33%	0.33	S	S	.	.	B	Isolated β-bridge	trans	-66.1	147.4	168.7	-59	177.9	0	0	0	109.8	R90	R90-L97 HydrophobicContact CB-CD2 4.09Å
98	F	85.4	Confident	84.4	Confident	18 Å²	18	67.5 Å²	67.5	8%	0.079	35%	0.349	C	S	.	.	P	Polyproline II helix	trans	-82.9	133.3	175.1	-59.4	-77.8	0	0	0	110.3	F89 C91 T104 C113 I237	F89-F98 HydrophobicContact CD1-CB 3.98Å; F89-F98 AromaticContact CD1-CD2 3.3Å; F89-F98 HydrophobicContact CD1-CD2 3.3Å; F89-F98 HydrophobicContact CD1-CE2 4.09Å; F89-F98 HydrophobicContact CD1-CG 4.02Å; F89-F98 HydrophobicContact CD2-CD2 4.37Å; F89-F98 HydrophobicContact CD2-CE2 4.4Å; F89-F98 HydrophobicContact CE1-CB 3.89Å; F89-F98 AromaticContact CE1-CD2 3.25Å; F89-F98 HydrophobicContact CE1-CD2 3.25Å; F89-F98 AromaticContact CE1-CE2 3.86Å; F89-F98 HydrophobicContact CE1-CE2 3.86Å; F89-F98 AromaticContact CE1-CG 3.75Å; F89-F98 HydrophobicContact CE1-CG 3.75Å; F89-F98 HydrophobicContact CE2-CD2 4.32Å; F89-F98 HydrophobicContact CE2-CE2 4.18Å; F89-F98 AromaticContact CG-CD2 3.88Å; F89-F98 HydrophobicContact CG-CD2 3.88Å; F89-F98 HydrophobicContact CG-CE2 4.33Å; F89-F98 AromaticContact CZ-CD2 3.78Å; F89-F98 HydrophobicContact CZ-CD2 3.78Å; F89-F98 AromaticContact CZ-CE2 3.89Å; F89-F98 HydrophobicContact CZ-CE2 3.89Å; F89-F98 HydrophobicContact CZ-CG 4.47Å; F89-F98 WeakPolarHBondContact O-CD2 3.41Å; C91-F98 HydrophobicContact CB-CE1 4.16Å; C91-F98 HydrophobicContact CB-CZ 3.87Å; F98-T104 HydrophobicContact CB-CG2 4.18Å; F98-T104 HydrophobicContact CD1-CG2 3.27Å; F98-T104 HydrophobicContact CD2-CG2 4.22Å; F98-T104 HydrophobicContact CE1-CG2 3.46Å; F98-T104 VanDerWaalsContact CE1-CG2 3.46Å; F98-T104 HydrophobicContact CE2-CG2 4.38Å; F98-T104 HydrophobicContact CG-CG2 3.65Å; F98-T104 HydrophobicContact CZ-CG2 4.02Å; F98-C113 HydrophobicContact CE1-CB 4.28Å; F98-I237 HydrophobicContact CB-CD1 3.86Å
99	N	80.5	Confident	84	Confident	103 Å²	103	69.2 Å²	69.2	55%	0.551	37%	0.369	S	S	*	.	P	Polyproline II helix	trans	-79.6	152.3	178	-71.9	83.8	0	0	0	111.1	R96 G101 E102	R96-N99 PolarHBondContact NH1-OD1 2.68Å; N99-G101 PolarHBondContact O-N 2.88Å; N99-E102 HydrophobicContact CB-CB 4.24Å; N99-E102 PolarHBondContact N-OE2 3.47Å; N99-E102 VanDerWaalsContact O-CB 3.28Å; N99-E102 WeakPolarHBondContact O-CB 3.32Å; N99-E102 PolarHBondContact O-N 3.49Å
100	S	73.2	Confident	83.9	Confident	72 Å²	72	70.4 Å²	70.4	50%	0.503	38%	0.378	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.2	122.6	173.2	-48.9	0	0	0	0	110.8	E239	S100-E239 WeakPolarHBondContact CB-OE1 3.33Å; S100-E239 PolarHBondContact OG-OE1 2.72Å
101	G	73.5	Confident	83.8	Confident	39 Å²	39	65.9 Å²	65.9	40%	0.402	36%	0.361	S	S	.	.	T	Hydrogen-bonded Turn	trans	77.6	3	-174.8	0	0	0	0	0	117.2	N99	N99-G101 PolarHBondContact O-N 2.88Å
102	E	78.4	Confident	83.7	Confident	42 Å²	42	67.5 Å²	67.5	20%	0.196	37%	0.367	C	S	.	.			trans	-74.7	131.2	176	-173.6	177	-162.4	0	0	112.5	R96 N99 T104	R96-E102 IonicContact CZ-OE1 2.82Å; R96-E102 IonicContact CZ-OE2 2.66Å; R96-E102 IonicContact NH1-OE1 3.82Å; R96-E102 IonicContact NH1-OE2 3.22Å; R96-E102 PolarHBondContact NH1-OE2 3.4Å; R96-E102 IonicContact NH2-OE1 3.05Å; R96-E102 PolarHBondContact NH2-OE1 3.05Å; R96-E102 IonicContact NH2-OE2 3.72Å; R96-E102 PolarHBondContact NH2-OE2 2.99Å; N99-E102 HydrophobicContact CB-CB 4.24Å; N99-E102 PolarHBondContact N-OE2 3.47Å; N99-E102 VanDerWaalsContact O-CB 3.28Å; N99-E102 WeakPolarHBondContact O-CB 3.32Å; N99-E102 PolarHBondContact O-N 3.49Å; E102-T104 PolarHBondContact O-N 3.44Å
103	R	81.2	Confident	83.8	Confident	110 Å²	110	64.3 Å²	64.3	42%	0.415	35%	0.348	S	S	.	.			trans	-69.3	118.8	176.8	-62	-167.9	-61.5	148.8	3.2	111.7	M114	R103-M114 HydrophobicContact CB-CE 3.68Å
104	T	82.7	Confident	83.7	Confident	2 Å²	2	63 Å²	63	1%	0.012	34%	0.336	C	S	.	.			trans	-107	138.8	174.9	71.4	0	0	0	0	111	F89 F98 E102 Y112	F89-T104 HydrophobicContact CE1-CG2 4.1Å; F89-T104 HydrophobicContact CZ-CG2 4.14Å; F98-T104 HydrophobicContact CB-CG2 4.18Å; F98-T104 HydrophobicContact CD1-CG2 3.27Å; F98-T104 HydrophobicContact CD2-CG2 4.22Å; F98-T104 HydrophobicContact CE1-CG2 3.46Å; F98-T104 VanDerWaalsContact CE1-CG2 3.46Å; F98-T104 HydrophobicContact CE2-CG2 4.38Å; F98-T104 HydrophobicContact CG-CG2 3.65Å; F98-T104 HydrophobicContact CZ-CG2 4.02Å; E102-T104 PolarHBondContact O-N 3.44Å; T104-Y112 WeakPolarHBondContact CA-O 3.4Å
105	T	84.4	Confident	83.5	Confident	44 Å²	44	64 Å²	64	27%	0.27	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	151	166.7	73.7	0	0	0	0	110.8	Y112 S117	T105-Y112 PolarHBondContact N-O 2.84Å; T105-Y112 VanDerWaalsContact N-O 3.08Å; T105-Y112 PolarHBondContact O-N 2.93Å; T105-S117 WeakPolarHBondContact OG1-CB 3.26Å
106	I	86	Confident	83.5	Confident	54 Å²	54	55.3 Å²	55.3	28%	0.277	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	123.4	-178.3	-53.8	175.3	0	0	0	107.5	V79 L80 S110 Y111 V235	V79-I106 HydrophobicContact CG1-CD1 3.71Å; L80-I106 HydrophobicContact CD1-CD1 3.58Å; L80-I106 HydrophobicContact CG-CD1 3.97Å; I106-S110 WeakPolarHBondContact CA-O 3.45Å; I106-Y111 HydrophobicContact CD1-CD1 4.18Å; I106-Y111 HydrophobicContact CD1-CE1 3.85Å; I106-Y111 HydrophobicContact CG1-CD1 3.82Å; I106-Y111 HydrophobicContact CG1-CE1 3.95Å; I106-Y111 HydrophobicContact CG2-CE1 4.28Å; I106-V235 HydrophobicContact CD1-CG2 4.48Å
107	V	85.9	Confident	83.4	Confident	60 Å²	60	51.6 Å²	51.6	36%	0.364	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	125.6	175.9	-168.4	0	0	0	0	107.4	G109 S110 Y112 L120	V107-G109 PolarHBondContact O-N 3.04Å; V107-G109 VanDerWaalsContact O-N 3.12Å; V107-S110 PolarHBondContact N-O 3.31Å; V107-S110 WeakPolarHBondContact O-CA 3.41Å; V107-S110 WeakPolarHBondContact O-CB 3.41Å; V107-S110 PolarHBondContact O-N 3.44Å; V107-S110 PolarHBondContact O-OG 3.28Å; V107-Y112 HydrophobicContact CB-CD2 4.37Å; V107-Y112 HydrophobicContact CB-CE2 3.88Å; V107-Y112 HydrophobicContact CG2-CD2 4.15Å; V107-Y112 HydrophobicContact CG2-CE2 4.1Å; V107-L120 HydrophobicContact CG2-CD2 4.49Å
108	D	79.9	Confident	83	Confident	167 Å²	167	50.3 Å²	50.3	89%	0.893	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	49	40	179.3	-54	-30.8	0	0	0	114.7	S110	D108-S110 PolarHBondContact O-N 3.44Å
109	G	79.9	Confident	82.6	Confident	47 Å²	47	54.9 Å²	54.9	49%	0.485	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	74.6	8.2	-178.7	0	0	0	0	0	114.9	V107 Y111	V107-G109 PolarHBondContact O-N 3.04Å; V107-G109 VanDerWaalsContact O-N 3.12Å; G109-Y111 WeakPolarHBondContact O-CE2 3.35Å
110	S	85.9	Confident	82	Confident	29 Å²	29	53.6 Å²	53.6	20%	0.203	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	148.6	178	73.3	0	0	0	0	112.1	I106 V107 D108 Y112	I106-S110 WeakPolarHBondContact CA-O 3.45Å; V107-S110 PolarHBondContact N-O 3.31Å; V107-S110 WeakPolarHBondContact O-CA 3.41Å; V107-S110 WeakPolarHBondContact O-CB 3.41Å; V107-S110 PolarHBondContact O-N 3.44Å; V107-S110 PolarHBondContact O-OG 3.28Å; D108-S110 PolarHBondContact O-N 3.44Å; S110-Y112 WeakPolarHBondContact OG-CE2 3.48Å; S110-Y112 PolarHBondContact OG-OH 3.43Å; S110-Y112 VanDerWaalsContact OG-OH 3.12Å
111	Y	87.9	Confident	81.6	Confident	22 Å²	22	55.4 Å²	55.4	9%	0.086	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	132.5	-163.7	-55.5	-83.5	0	0	0	111.8	V79 F84 F89 C91 T92 I106 G109	V79-Y111 HydrophobicContact CB-CE1 4.38Å; V79-Y111 HydrophobicContact CG1-CE1 3.84Å; F84-Y111 HydrophobicContact CE1-CE2 4.09Å; F84-Y111 HydrophobicContact CE2-CE2 4.33Å; F84-Y111 AromaticContact CZ-CE2 3.61Å; F84-Y111 HydrophobicContact CZ-CE2 3.61Å; F84-Y111 AromaticContact CZ-CZ 3.66Å; F84-Y111 VanDerWaalsContact CZ-OH 3.28Å; F84-Y111 WeakPolarHBondContact CZ-OH 3.3Å; F89-Y111 AromaticContact CE2-CD1 3.56Å; F89-Y111 HydrophobicContact CE2-CD1 3.56Å; F89-Y111 HydrophobicContact CE2-CD2 4.33Å; F89-Y111 AromaticContact CE2-CE1 3.91Å; F89-Y111 HydrophobicContact CE2-CE1 3.91Å; F89-Y111 AromaticContact CE2-CG 3.81Å; F89-Y111 HydrophobicContact CE2-CG 3.81Å; F89-Y111 HydrophobicContact CZ-CD1 4.12Å; C91-Y111 CarbonylContact C-O 3.52Å; C91-Y111 VanDerWaalsContact CA-O 3.3Å; C91-Y111 WeakPolarHBondContact CA-O 3.45Å; T92-Y111 PolarHBondContact N-O 2.88Å; T92-Y111 PolarHBondContact OG1-O 2.95Å; I106-Y111 HydrophobicContact CD1-CD1 4.18Å; I106-Y111 HydrophobicContact CD1-CE1 3.85Å; I106-Y111 HydrophobicContact CG1-CD1 3.82Å; I106-Y111 HydrophobicContact CG1-CE1 3.95Å; I106-Y111 HydrophobicContact CG2-CE1 4.28Å; G109-Y111 WeakPolarHBondContact O-CE2 3.35Å
112	Y	89.9	Confident	80.9	Confident	35 Å²	35	60.2 Å²	60.2	14%	0.137	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	141.1	-175	-61.9	-89.5	0	0	0	112.8	T92 T93 T104 T105 V107 S110 C116 L120	T92-Y112 VanDerWaalsContact OG1-CE1 3.28Å; T92-Y112 WeakPolarHBondContact OG1-CE1 3.5Å; T93-Y112 WeakPolarHBondContact OG1-CD1 3.48Å; T93-Y112 WeakPolarHBondContact OG1-CE1 3.48Å; T104-Y112 WeakPolarHBondContact CA-O 3.4Å; T105-Y112 PolarHBondContact N-O 2.84Å; T105-Y112 VanDerWaalsContact N-O 3.08Å; T105-Y112 PolarHBondContact O-N 2.93Å; V107-Y112 HydrophobicContact CB-CD2 4.37Å; V107-Y112 HydrophobicContact CB-CE2 3.88Å; V107-Y112 HydrophobicContact CG2-CD2 4.15Å; V107-Y112 HydrophobicContact CG2-CE2 4.1Å; S110-Y112 WeakPolarHBondContact OG-CE2 3.48Å; S110-Y112 PolarHBondContact OG-OH 3.43Å; S110-Y112 VanDerWaalsContact OG-OH 3.12Å; Y112-C116 HydrophobicContact CD1-CB 4.41Å; Y112-L120 HydrophobicContact CD1-CD1 3.78Å; Y112-L120 HydrophobicContact CD1-CD2 3.97Å; Y112-L120 HydrophobicContact CD2-CD2 4.3Å; Y112-L120 HydrophobicContact CE1-CD1 3.66Å; Y112-L120 HydrophobicContact CE1-CD2 3.54Å; Y112-L120 HydrophobicContact CE1-CG 4.27Å; Y112-L120 HydrophobicContact CE2-CD2 3.9Å; Y112-L120 HydrophobicContact CG-CD2 4.33Å; Y112-L120 VanDerWaalsContact CZ-CD2 3.5Å
113	C	89.3	Confident	79.5	Confident	4 Å²	4	60.2 Å²	60.2	3%	0.027	35%	0.351	C	S	.	.			trans	-71.1	157.5	170.7	88.2	0	0	0	0	111.4	C91 F98 S115 C116 S117	C91-C113 HydrophobicContact CB-CB 4.08Å; C91-C113 PolarHBondContact SG-N 3.28Å; C91-C113 VanDerWaalsContact SG-N 3.4Å; F98-C113 HydrophobicContact CE1-CB 4.28Å; C113-S115 VanDerWaalsContact C-N 3.27Å; C113-S115 PolarHBondContact O-N 3.1Å; C113-C116 HydrophobicContact CB-CB 4.02Å; C113-C116 WeakPolarHBondContact CB-SG 3.43Å; C113-C116 CarbonylContact O-C 3.59Å; C113-C116 WeakPolarHBondContact O-CA 3.39Å; C113-C116 VanDerWaalsContact O-CB 3.22Å; C113-C116 WeakPolarHBondContact O-CB 3.42Å; C113-C116 PolarHBondContact O-N 3.16Å; C113-C116 WeakPolarHBondContact SG-CB 3.3Å; C113-C116 PolarHBondContact SG-N 3.39Å; C113-C116 CovalentContact SG-SG 2.05Å; C113-C116 PolarHBondContact SG-SG 3.47Å; C113-S117 PolarHBondContact O-N 3.48Å; C113-S117 PolarHBondContact O-OG 3Å
114	M	84.5	Confident	77.8	Confident	61 Å²	61	63.5 Å²	63.5	30%	0.3	38%	0.377	S	S	.	.	H	α-helix	trans	-55.1	-40.5	178.5	-177.4	54.2	47.1	0	0	113.2	R103 C116 S117 S118	R103-M114 HydrophobicContact CB-CE 3.68Å; M114-C116 PolarHBondContact O-N 2.98Å; M114-S117 WeakPolarHBondContact CA-OG 3.31Å; M114-S117 PolarHBondContact O-OG 2.87Å; M114-S118 PolarHBondContact O-N 2.93Å; M114-S118 PolarHBondContact O-OG 2.9Å
115	S	84.9	Confident	76.1	Confident	81 Å²	81	69.3 Å²	69.3	57%	0.566	41%	0.412	S	S	*	.	H	α-helix	trans	-75.7	-7	175.4	-33.4	0	0	0	0	114.2	C113 S118 N119	C113-S115 VanDerWaalsContact C-N 3.27Å; C113-S115 PolarHBondContact O-N 3.1Å; S115-S118 VanDerWaalsContact C-OG 3.27Å; S115-S118 WeakPolarHBondContact CA-OG 3.44Å; S115-S118 PolarHBondContact O-OG 3.16Å; S115-N119 PolarHBondContact O-ND2 3.26Å; S115-N119 PolarHBondContact O-OD1 3.11Å
116	C	86.8	Confident	74.1	Confident	8 Å²	8	74.6 Å²	74.6	5%	0.054	44%	0.438	C	S	.	.	H	α-helix	trans	-102.1	-43.4	-178	-52.9	0	0	0	0	109.4	C91 C94 Y112 C113 M114 S118 N119 L120	C91-C116 PolarHBondContact SG-SG 2.92Å; C94-C116 PolarHBondContact SG-SG 2.67Å; Y112-C116 HydrophobicContact CD1-CB 4.41Å; C113-C116 HydrophobicContact CB-CB 4.02Å; C113-C116 WeakPolarHBondContact CB-SG 3.43Å; C113-C116 CarbonylContact O-C 3.59Å; C113-C116 WeakPolarHBondContact O-CA 3.39Å; C113-C116 VanDerWaalsContact O-CB 3.22Å; C113-C116 WeakPolarHBondContact O-CB 3.42Å; C113-C116 PolarHBondContact O-N 3.16Å; C113-C116 WeakPolarHBondContact SG-CB 3.3Å; C113-C116 PolarHBondContact SG-N 3.39Å; C113-C116 CovalentContact SG-SG 2.05Å; C113-C116 PolarHBondContact SG-SG 3.47Å; M114-C116 PolarHBondContact O-N 2.98Å; C116-S118 VanDerWaalsContact C-N 3.3Å; C116-S118 PolarHBondContact O-N 2.88Å; C116-N119 WeakPolarHBondContact O-CB 3.46Å; C116-N119 PolarHBondContact O-N 2.8Å; C116-L120 WeakPolarHBondContact O-CD1 3.43Å; C116-L120 PolarHBondContact O-N 2.99Å; C116-L120 VanDerWaalsContact O-N 3.14Å
117	S	85.2	Confident	72	Confident	11 Å²	11	79.2 Å²	79.2	8%	0.077	46%	0.458	C	S	.	.	H	α-helix	trans	-60.8	-39.3	173	58.8	0	0	0	0	111.6	T105 C113 M114 N119 L120 T121	T105-S117 WeakPolarHBondContact OG1-CB 3.26Å; C113-S117 PolarHBondContact O-N 3.48Å; C113-S117 PolarHBondContact O-OG 3Å; M114-S117 WeakPolarHBondContact CA-OG 3.31Å; M114-S117 PolarHBondContact O-OG 2.87Å; S117-N119 PolarHBondContact O-N 3.13Å; S117-N119 VanDerWaalsContact O-N 3.16Å; S117-L120 PolarHBondContact O-N 2.99Å; S117-L120 VanDerWaalsContact O-N 3.17Å; S117-T121 WeakPolarHBondContact O-CG2 3.48Å; S117-T121 PolarHBondContact O-N 3.06Å; S117-T121 PolarHBondContact O-OG1 2.9Å
118	S	78.5	Confident	69.8	Low	48 Å²	48	86.6 Å²	86.6	34%	0.336	49%	0.485	S	S	.	.	H	α-helix	trans	-60.2	-22	172.7	59.6	0	0	0	0	113.9	M114 S115 C116 T121 N122	M114-S118 PolarHBondContact O-N 2.93Å; M114-S118 PolarHBondContact O-OG 2.9Å; S115-S118 VanDerWaalsContact C-OG 3.27Å; S115-S118 WeakPolarHBondContact CA-OG 3.44Å; S115-S118 PolarHBondContact O-OG 3.16Å; C116-S118 VanDerWaalsContact C-N 3.3Å; C116-S118 PolarHBondContact O-N 2.88Å; S118-T121 PolarHBondContact O-OG1 3.37Å; S118-N122 PolarHBondContact O-ND2 2.98Å
119	N	75.6	Confident	67.8	Low	114 Å²	114	83.5 Å²	83.5	61%	0.61	47%	0.472	S	S	*	.	H	α-helix	trans	-91.1	-31.3	178.2	-61.2	-4.4	0	0	0	111.1	S115 C116 S117	S115-N119 PolarHBondContact O-ND2 3.26Å; S115-N119 PolarHBondContact O-OD1 3.11Å; C116-N119 WeakPolarHBondContact O-CB 3.46Å; C116-N119 PolarHBondContact O-N 2.8Å; S117-N119 PolarHBondContact O-N 3.13Å; S117-N119 VanDerWaalsContact O-N 3.16Å
120	L	69	Low	65.7	Low	75 Å²	75	88.7 Å²	88.7	39%	0.393	49%	0.494	S	S	.	.	H	α-helix	trans	-65.4	-39.2	170.1	-90.7	73.7	0	0	0	111.9	V107 Y112 C116 S117 N122	V107-L120 HydrophobicContact CG2-CD2 4.49Å; Y112-L120 HydrophobicContact CD1-CD1 3.78Å; Y112-L120 HydrophobicContact CD1-CD2 3.97Å; Y112-L120 HydrophobicContact CD2-CD2 4.3Å; Y112-L120 HydrophobicContact CE1-CD1 3.66Å; Y112-L120 HydrophobicContact CE1-CD2 3.54Å; Y112-L120 HydrophobicContact CE1-CG 4.27Å; Y112-L120 HydrophobicContact CE2-CD2 3.9Å; Y112-L120 HydrophobicContact CG-CD2 4.33Å; Y112-L120 VanDerWaalsContact CZ-CD2 3.5Å; C116-L120 WeakPolarHBondContact O-CD1 3.43Å; C116-L120 PolarHBondContact O-N 2.99Å; C116-L120 VanDerWaalsContact O-N 3.14Å; S117-L120 PolarHBondContact O-N 2.99Å; S117-L120 VanDerWaalsContact O-N 3.17Å; L120-N122 PolarHBondContact O-N 2.91Å
121	T	64.6	Low	63.2	Low	111 Å²	111	90.5 Å²	90.5	68%	0.681	52%	0.518	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73	-2.8	-178.5	55.9	0	0	0	0	114.9	S117 S118	S117-T121 WeakPolarHBondContact O-CG2 3.48Å; S117-T121 PolarHBondContact O-N 3.06Å; S117-T121 PolarHBondContact O-OG1 2.9Å; S118-T121 PolarHBondContact O-OG1 3.37Å
122	N	58.8	Low	60.8	Low	139 Å²	139	94.4 Å²	94.4	74%	0.743	55%	0.548	S	S	*	.	T	Hydrogen-bonded Turn	trans	-125.6	14.4	-170.8	-78.2	-64.9	0	0	0	114.1	S118 L120	S118-N122 PolarHBondContact O-ND2 2.98Å; L120-N122 PolarHBondContact O-N 2.91Å
123	G	47.9	Very low	58.1	Low	42 Å²	42	99.4 Å²	99.4	43%	0.433	58%	0.577	S	S	.	*			trans	-168.4	94.9	-179.8	0	0	0	0	0	116.3	V125	G123-V125 PolarHBondContact O-N 2.83Å
124	D	45.6	Very low	55.6	Low	180 Å²	180	105.9 Å²	105.9	96%	0.963	61%	0.611	S	S	*	*			trans	-67.3	66.8	155.2	-74.8	-56.1	0	0	0	110.5
125	V	47.3	Very low	53.6	Low	124 Å²	124	112.9 Å²	112.9	75%	0.752	64%	0.635	S	S	*	*			trans	-125.6	89.2	-178.5	-171.8	0	0	0	0	111.6	G123	G123-V125 PolarHBondContact O-N 2.83Å
126	L	42.4	Very low	51.4	Low	155 Å²	155	116.5 Å²	116.5	81%	0.812	65%	0.648	S	S	*	*			trans	72.5	103.5	141.8	-158.8	70.4	0	0	0	118.8	K128	L126-K128 PolarHBondContact O-N 2.7Å
127	H	41.5	Very low	49.1	Very low	151 Å²	151	119.8 Å²	119.8	70%	0.699	68%	0.683	S	S	*	*			trans	-8.7	118.1	140.5	-77	-123.5	0	0	0	116.2	T129	H127-T129 WeakPolarHBondContact ND1-CG2 3.41Å
128	K	40.2	Very low	46.8	Very low	215 Å²	215	125.4 Å²	125.4	94%	0.935	72%	0.722	S	S	*	*			trans	-120	76.5	140.6	-101.2	-177.6	174.5	176.8	0	110.2	L126	L126-K128 PolarHBondContact O-N 2.7Å
129	T	39.2	Very low	44.8	Very low	102 Å²	102	127.8 Å²	127.8	63%	0.626	74%	0.744	S	S	*	*			trans	-58	152.6	169.1	39.2	0	0	0	0	111.9	H127 G131	H127-T129 WeakPolarHBondContact ND1-CG2 3.41Å; T129-G131 PolarHBondContact O-N 3.34Å
130	V	35.7	Very low	42.9	Very low	155 Å²	155	127.3 Å²	127.3	94%	0.939	76%	0.756	S	S	*	*			trans	-50.4	125.5	165	177.8	0	0	0	0	109.3
131	G	32.6	Very low	41.3	Very low	68 Å²	68	128 Å²	128	70%	0.701	77%	0.773	S	S	*	*			trans	-174.5	82	-171	0	0	0	0	0	114.8	T129	T129-G131 PolarHBondContact O-N 3.34Å
132	S	36.9	Very low	40.1	Very low	103 Å²	103	127.2 Å²	127.2	72%	0.72	78%	0.778	S	S	*	*			trans	8.7	135.6	150.6	-48.8	0	0	0	0	122
133	N	34.7	Very low	39.1	Very low	140 Å²	140	126.5 Å²	126.5	75%	0.749	78%	0.778	S	S	*	*			trans	86.6	112.8	142.3	-55.9	-18.1	0	0	0	121.8
134	N	35.6	Very low	38.8	Very low	140 Å²	140	129.6 Å²	129.6	75%	0.749	79%	0.789	S	S	*	*				74.9	139.2	128.2	-75.2	-22.3	0	0	0	123.5
135	R	41.9	Very low	38.6	Very low	209 Å²	209	127.4 Å²	127.4	79%	0.789	78%	0.782	S	S	*	*			trans	83.9	96.5	151.6	-69.8	163.4	-173.2	-177.1	1.7	120
136	D	38.7	Very low	38.1	Very low	157 Å²	157	128.6 Å²	128.6	84%	0.84	78%	0.784	S	S	*	*				55.5	135.1	112.2	-43.6	-29.2	0	0	0	121.5
137	G	38.7	Very low	37.9	Very low	77 Å²	77	124.4 Å²	124.4	79%	0.794	78%	0.779	S	S	*	*			trans	110.7	105.4	151.5	0	0	0	0	0	116
138	S	38	Very low	38.2	Very low	128 Å²	128	122.2 Å²	122.2	90%	0.895	78%	0.78	S	S	*	*			trans	-136.8	108.6	163.6	-71.4	0	0	0	0	110
139	A	36.2	Very low	38.3	Very low	98 Å²	98	119.5 Å²	119.5	81%	0.81	78%	0.776	S	S	*	*			trans	-161.3	139.6	169.5	0	0	0	0	0	111
140	A	35.4	Very low	38.2	Very low	104 Å²	104	118 Å²	118	86%	0.86	78%	0.78	S	S	*	*			trans	63.5	148.8	165.6	0	0	0	0	0	118.5
141	A	35.5	Very low	38.4	Very low	91 Å²	91	117.1 Å²	117.1	75%	0.752	78%	0.775	S	S	*	*			cis	-167.9	173	-20.7	0	0	0	0	0	110.1
142	A	38.9	Very low	38.4	Very low	94 Å²	94	119.4 Å²	119.4	78%	0.777	78%	0.779	S	S	*	*			trans	72.4	150.7	153.8	0	0	0	0	0	118.8
143	T	38.1	Very low	38.4	Very low	123 Å²	123	119 Å²	119	76%	0.755	78%	0.776	S	S	*	*			cis	-162.4	130.5	-17.2	-101.1	0	0	0	0	111.9
144	V	42	Very low	38.6	Very low	107 Å²	107	118.5 Å²	118.5	65%	0.648	78%	0.778	S	S	*	*			trans	34.5	124.8	143.9	-165.4	0	0	0	0	121.3
145	T	41.6	Very low	38.6	Very low	134 Å²	134	116.8 Å²	116.8	82%	0.822	78%	0.777	S	S	*	*				164.6	152.5	118.4	36.3	0	0	0	0	112.1
146	N	36.9	Very low	38.4	Very low	150 Å²	150	111.3 Å²	111.3	80%	0.802	77%	0.771	S	S	*	*			cis	-161.9	152.4	-39.7	-141.3	-1.3	0	0	0	111.9
147	G	37.1	Very low	38.2	Very low	67 Å²	67	109.4 Å²	109.4	69%	0.691	77%	0.77	S	S	*	*			trans	90.5	151.9	163	0	0	0	0	0	118.1
148	S	48.8	Very low	38.2	Very low	104 Å²	104	111.9 Å²	111.9	73%	0.727	77%	0.772	S	S	*	*			cis	-164.8	170.3	-11.2	51.6	0	0	0	0	111.6
149	N	41.5	Very low	38.1	Very low	159 Å²	159	111.3 Å²	111.3	85%	0.85	77%	0.768	S	S	*	*			trans	75.6	126	-179.6	-45.4	-26.1	0	0	0	115
150	G	38.1	Very low	37.9	Very low	69 Å²	69	111.5 Å²	111.5	71%	0.711	76%	0.764	S	S	*	*			cis	109.5	136.9	1.4	0	0	0	0	0	112.9
151	V	39.2	Very low	38	Very low	138 Å²	138	114.4 Å²	114.4	84%	0.836	77%	0.765	S	S	*	*			cis	-157.2	166.3	2.7	-158.1	0	0	0	0	110
152	C	31.7	Very low	37.9	Very low	115 Å²	115	115.4 Å²	115.4	78%	0.777	77%	0.766	S	S	*	*			trans	79.9	144.7	151.3	96.4	0	0	0	0	118.3
153	S	38.4	Very low	37.9	Very low	94 Å²	94	116.3 Å²	116.3	66%	0.657	76%	0.764	S	S	*	*			cis	-147.6	146.5	5.6	-69.7	0	0	0	0	113.5
154	T	37.3	Very low	37.8	Very low	131 Å²	131	116 Å²	116	80%	0.804	77%	0.766	S	S	*	*			trans	36.3	145.2	141.6	60.5	0	0	0	0	122.4
155	S	37.3	Very low	37.6	Very low	103 Å²	103	115.5 Å²	115.5	72%	0.72	77%	0.768	S	S	*	*			cis	-177.4	-172.7	-11.8	64.8	0	0	0	0	107
156	S	37.7	Very low	37.4	Very low	95 Å²	95	118 Å²	118	66%	0.664	77%	0.767	S	S	*	*			cis	-165	143.7	-2.4	17.2	0	0	0	0	110.6
157	S	34.8	Very low	37.4	Very low	117 Å²	117	115.3 Å²	115.3	82%	0.818	76%	0.76	S	S	*	*			trans	59.3	127.3	143.8	-50.2	0	0	0	0	123.4
158	P	37.5	Very low	37.4	Very low	128 Å²	128	118 Å²	118	83%	0.831	76%	0.759	S	S	*	*			trans	-111	153.6	161.6	38.7	-29.7	0	0	0	113.8
159	S	35.3	Very low	36.8	Very low	116 Å²	116	120 Å²	120	81%	0.811	76%	0.757	S	S	*	*			trans	-164	138.1	161.8	58.4	0	0	0	0	115
160	S	33.5	Very low	36.4	Very low	103 Å²	103	120.3 Å²	120.3	72%	0.72	75%	0.751	S	S	*	*			trans	-18.2	146.4	163.8	54.5	0	0	0	0	121.4
161	N	36.5	Very low	36.2	Very low	165 Å²	165	124.1 Å²	124.1	88%	0.882	76%	0.755	S	S	*	*				-162.8	141.2	129.2	-98.3	-28.2	0	0	0	112.6
162	S	33	Very low	36	Very low	111 Å²	111	122.2 Å²	122.2	78%	0.776	75%	0.746	S	S	*	*			trans	-117.7	161.6	167.3	-55.4	0	0	0	0	108.6
163	P	40.1	Very low	35.8	Very low	114 Å²	114	124.2 Å²	124.2	74%	0.74	75%	0.748	S	S	*	*				-157.3	164	97.4	40.3	-22.1	0	0	0	117.4
164	S	36.4	Very low	35.3	Very low	115 Å²	115	124.6 Å²	124.6	80%	0.804	75%	0.751	S	S	*	*			trans	52.6	148.9	138.4	-65	0	0	0	0	123.2
165	S	37.8	Very low	34.9	Very low	98 Å²	98	125.7 Å²	125.7	69%	0.685	75%	0.751	S	S	*	*			cis	-171.6	178.2	-11.9	54.6	0	0	0	0	111.3
166	K	37.3	Very low	34.5	Very low	185 Å²	185	125.8 Å²	125.8	80%	0.804	75%	0.751	S	S	*	*			trans	80.7	119	178.9	-52.2	178.5	-177.6	-178.7	0	114.3
167	S	35.2	Very low	34.3	Very low	94 Å²	94	127 Å²	127	66%	0.657	76%	0.755	S	S	*	*			cis	75.7	135.6	38.7	94.9	0	0	0	0	111.7
168	D	37.6	Very low	34.4	Very low	124 Å²	124	126.4 Å²	126.4	66%	0.663	75%	0.751	S	S	*	*			cis	-152.8	168.3	19.3	-76.6	-70.6	0	0	0	109.5
169	Q	37.7	Very low	34.4	Very low	145 Å²	145	123.2 Å²	123.2	68%	0.678	74%	0.741	S	S	*	*			cis	-163.5	-162.9	-4.9	-116.5	170.4	49.8	0	0	111.8
170	F	33	Very low	34.7	Very low	166 Å²	166	125.8 Å²	125.8	73%	0.728	74%	0.74	S	S	*	*			trans	-20.5	156.3	164.2	-55.4	-71	0	0	0	120
171	N	33.6	Very low	34.9	Very low	150 Å²	150	128.4 Å²	128.4	80%	0.802	74%	0.74	S	S	*	*			cis	-168.1	163.9	44.8	-120	-23.2	0	0	0	113.8
172	P	34.1	Very low	35	Very low	98 Å²	98	124.5 Å²	124.5	64%	0.636	73%	0.726	S	S	*	*			trans	-112.1	179.8	171	41.1	-32.1	0	0	0	115.1
173	L	28.2	Very low	35.4	Very low	156 Å²	156	127.1 Å²	127.1	82%	0.817	73%	0.726	S	S	*	*			trans	85	124.9	161.2	-59.9	171.3	0	0	0	121.8
174	S	27.9	Very low	35.2	Very low	103 Å²	103	127.1 Å²	127.1	72%	0.72	72%	0.724	S	S	*	*			trans	83	135.4	130.8	65.9	0	0	0	0	125
175	L	29.3	Very low	35.1	Very low	154 Å²	154	129.4 Å²	129.4	81%	0.806	73%	0.727	S	S	*	*			trans	80.2	113.2	142.6	-105.4	70	0	0	0	123.6
176	S	28.5	Very low	35	Very low	104 Å²	104	129.8 Å²	129.8	73%	0.727	73%	0.727	S	S	*	*			trans	64.6	154.2	140.8	62	0	0	0	0	119.5
177	T	33.6	Very low	34.7	Very low	120 Å²	120	127.3 Å²	127.3	74%	0.736	73%	0.728	S	S	*	*			cis	-152.1	161.2	9.1	-24.6	0	0	0	0	111.2
178	S	36.9	Very low	34.7	Very low	106 Å²	106	130.7 Å²	130.7	74%	0.741	74%	0.737	S	S	*	*			trans	25.8	137.4	151.1	58.5	0	0	0	0	122.4
179	G	37.7	Very low	34.2	Very low	60 Å²	60	134.9 Å²	134.9	62%	0.619	74%	0.743	S	S	*	*			cis	160.7	-176.8	-0.9	0	0	0	0	0	114.6
180	H	40.3	Very low	33.9	Very low	170 Å²	170	133.9 Å²	133.9	79%	0.787	75%	0.747	S	S	*	*			trans	78.3	138.7	172.5	-47.6	-61.8	0	0	0	117.7
181	Q	39.3	Very low	33.9	Very low	158 Å²	158	131.2 Å²	131.2	74%	0.738	75%	0.749	S	S	*	*			cis	-163.4	149.4	-10.1	-120.1	-175.1	77.6	0	0	112.2
182	S	38.3	Very low	34.2	Very low	84 Å²	84	129.6 Å²	129.6	59%	0.587	75%	0.747	S	S	*	*			trans	68.1	130.5	136.8	-64.5	0	0	0	0	120.8
183	Q	41.2	Very low	34.2	Very low	166 Å²	166	131.9 Å²	131.9	78%	0.776	76%	0.759	S	S	*	*			cis	-151.2	153.3	-2.5	-53.1	-167.9	-14.8	0	0	113.3
184	T	36.2	Very low	34.6	Very low	114 Å²	114	130 Å²	130	70%	0.699	76%	0.756	S	S	*	*			trans	43.2	124.8	149.2	54.2	0	0	0	0	122.2
185	L	33.2	Very low	34.9	Very low	162 Å²	162	133.4 Å²	133.4	85%	0.848	76%	0.764	S	S	*	*			cis	82.6	152.9	36.7	-64.8	170.4	0	0	0	116
186	P	37.1	Very low	35	Very low	107 Å²	107	133.6 Å²	133.6	70%	0.695	76%	0.761	S	S	*	*			cis	-129.8	173.9	-4.7	30.6	-9.9	0	0	0	116.3
187	T	29.8	Very low	35.2	Very low	133 Å²	133	136.2 Å²	136.2	82%	0.816	76%	0.761	S	S	*	*			trans	-127.9	142.8	158.4	-72.2	0	0	0	0	108.4
188	I	34.7	Very low	35.4	Very low	165 Å²	165	136.4 Å²	136.4	85%	0.846	77%	0.765	S	S	*	*			trans	-132.1	148.6	169.1	-61.9	-176.2	0	0	0	109.7
189	R	28.4	Very low	35.1	Very low	212 Å²	212	137 Å²	137	80%	0.8	76%	0.763	S	S	*	*			trans	-151.3	153.5	-166.7	-171.4	-175.4	-179.5	-124.7	4.2	109.5
190	T	31.5	Very low	35	Very low	124 Å²	124	142 Å²	142	76%	0.761	78%	0.776	S	S	*	*			trans	69	159.5	-179.5	77.5	0	0	0	0	114.1
191	S	32	Very low	34.5	Very low	109 Å²	109	140.3 Å²	140.3	76%	0.762	77%	0.768	S	S	*	*			cis	-146	176.4	8.7	59.7	0	0	0	0	111.6
192	P	39.8	Very low	34.4	Very low	117 Å²	117	141 Å²	141	76%	0.76	78%	0.775	S	S	*	*			trans	-115.2	149.9	-170.1	39.3	-29.9	0	0	0	116.9
193	T	35	Very low	34	Very low	146 Å²	146	142.2 Å²	142.2	90%	0.896	78%	0.775	S	S	*	*			trans	-160.5	153.3	155.8	28.9	0	0	0	0	111.9
194	P	37.2	Very low	33.9	Very low	116 Å²	116	142.3 Å²	142.3	75%	0.753	78%	0.781	S	S	*	*			trans	-106.2	163.7	178.6	39.8	-34.1	0	0	0	114.5
195	I	33.2	Very low	33.7	Very low	175 Å²	175	141.3 Å²	141.3	90%	0.897	78%	0.778	S	S	*	*			trans	-163.7	165.2	160.1	-104.7	148.7	0	0	0	111.5
196	H	31.1	Very low	33.5	Very low	157 Å²	157	140.4 Å²	140.4	73%	0.727	77%	0.774	S	S	*	*			trans	-70.2	154.6	-170.5	-88.7	-159.5	0	0	0	118
197	H	33.8	Very low	33.5	Very low	160 Å²	160	140.2 Å²	140.2	74%	0.741	77%	0.771	S	S	*	*				27.9	151	128.8	-53.4	-40.5	0	0	0	121.4
198	P	37	Very low	33.8	Very low	124 Å²	124	141.9 Å²	141.9	81%	0.805	77%	0.77	S	S	*	*			cis	-145.8	-172.4	39	43.7	-23	0	0	0	119.2
199	V	30.9	Very low	33.7	Very low	117 Å²	117	141.3 Å²	141.3	71%	0.709	77%	0.768	S	S	*	*			trans	-55.9	151	-179.7	179.4	0	0	0	0	114.6
200	N	34.5	Very low	33.9	Very low	167 Å²	167	138.7 Å²	138.7	89%	0.893	77%	0.765	S	S	*	*			trans	-149.7	137.1	137.8	-104.9	-25.4	0	0	0	112
201	H	29.8	Very low	34	Very low	134 Å²	134	140.8 Å²	140.8	62%	0.62	77%	0.771	S	S	*	*			trans	-78	145.7	170.3	-106.8	-114.9	0	0	0	110.4	D203	H201-D203 IonicContact CE1-OD1 2.65Å; H201-D203 PolarHBondContact CE1-OD1 3.5Å; H201-D203 IonicContact CE1-OD2 2.69Å; H201-D203 IonicContact CG-OD2 3.63Å; H201-D203 VanDerWaalsContact ND1-CG 3.25Å; H201-D203 IonicContact ND1-OD1 2.64Å; H201-D203 PolarHBondContact ND1-OD1 3.42Å; H201-D203 IonicContact ND1-OD2 2.74Å; H201-D203 PolarHBondContact ND1-OD2 2.92Å
202	I	37.3	Very low	34.1	Very low	171 Å²	171	142.7 Å²	142.7	88%	0.877	77%	0.768	S	S	*	*				-139.2	128.2	128.7	-59.8	-172.9	0	0	0	106.5
203	D	31.6	Very low	33.5	Very low	111 Å²	111	146.3 Å²	146.3	59%	0.594	77%	0.768	S	S	*	*			trans	-86.8	148.5	178.7	-54.4	-95.3	0	0	0	111.3	H201	H201-D203 IonicContact CE1-OD1 2.65Å; H201-D203 PolarHBondContact CE1-OD1 3.5Å; H201-D203 IonicContact CE1-OD2 2.69Å; H201-D203 IonicContact CG-OD2 3.63Å; H201-D203 VanDerWaalsContact ND1-CG 3.25Å; H201-D203 IonicContact ND1-OD1 2.64Å; H201-D203 PolarHBondContact ND1-OD1 3.42Å; H201-D203 IonicContact ND1-OD2 2.74Å; H201-D203 PolarHBondContact ND1-OD2 2.92Å
204	D	38	Very low	33.5	Very low	168 Å²	168	148 Å²	148	90%	0.898	77%	0.765	S	S	*	*			trans	-154.1	155.7	144.1	-126.2	-32.2	0	0	0	111.3
205	S	31.6	Very low	33.2	Very low	92 Å²	92	149.1 Å²	149.1	64%	0.643	76%	0.761	S	S	*	*			trans	-131.5	167.8	-157.7	66.1	0	0	0	0	115.2
206	N	30.3	Very low	33	Very low	144 Å²	144	148.1 Å²	148.1	77%	0.77	76%	0.757	S	S	*	*			trans	71.4	145.8	177.8	-69.1	-47.4	0	0	0	116.5
207	T	36.6	Very low	32.8	Very low	103 Å²	103	147.6 Å²	147.6	63%	0.632	76%	0.759	S	S	*	*			cis	-151.1	146	-0.5	0.1	0	0	0	0	112.2
208	Q	35.4	Very low	32.7	Very low	167 Å²	167	147.9 Å²	147.9	78%	0.78	76%	0.764	S	S	*	*			trans	43.3	107	144.5	-64.3	169.3	4.1	0	0	120.3
209	N	33.5	Very low	32.4	Very low	153 Å²	153	146 Å²	146	82%	0.818	75%	0.754	S	S	*	*				-173.5	122.8	98.8	-103.4	-76.4	0	0	0	112
210	H	31.1	Very low	32.4	Very low	158 Å²	158	147.2 Å²	147.2	73%	0.731	76%	0.757	S	S	*	*			trans	-102.4	143.1	169.2	-94.7	-90.8	0	0	0	110.3
211	N	35.5	Very low	32.3	Very low	167 Å²	167	143.5 Å²	143.5	89%	0.893	75%	0.749	S	S	*	*			trans	-138.8	124.4	147.3	-102.6	-58.9	0	0	0	108
212	H	32.1	Very low	32.4	Very low	149 Å²	149	145 Å²	145	69%	0.69	76%	0.762	S	S	*	*			trans	-96.5	133.1	-157.9	-144	-72.2	0	0	0	112.6	Q214	H212-Q214 PolarHBondContact O-N 3.25Å
213	Y	29.1	Very low	32.1	Very low	194 Å²	194	144.3 Å²	144.3	76%	0.761	76%	0.759	S	S	*	*			trans	-67.3	122.1	165.7	-160.7	-93.7	0	0	0	108.1	Q215	Y213-Q215 HydrophobicContact CD1-CG 4.12Å; Y213-Q215 PolarHBondContact O-N 2.89Å; Y213-Q215 VanDerWaalsContact O-N 3.16Å
214	Q	33.8	Very low	32.2	Very low	180 Å²	180	148.4 Å²	148.4	84%	0.841	77%	0.771	S	S	*	*			trans	-77.4	101.3	178.8	-81.9	-173.9	-27	0	0	110.5	H212	H212-Q214 PolarHBondContact O-N 3.25Å
215	Q	30.7	Very low	31.9	Very low	140 Å²	140	145.6 Å²	145.6	65%	0.654	77%	0.765	S	S	*	*			trans	-93.8	115.9	162.1	-70.2	175.3	-30.1	0	0	108.2	Y213 L217	Y213-Q215 HydrophobicContact CD1-CG 4.12Å; Y213-Q215 PolarHBondContact O-N 2.89Å; Y213-Q215 VanDerWaalsContact O-N 3.16Å; Q215-L217 PolarHBondContact O-N 3.49Å
216	N	28.4	Very low	31.7	Very low	154 Å²	154	150.9 Å²	150.9	82%	0.824	78%	0.777	S	S	*	*			trans	-77.4	75	170.8	-77.4	-16.6	0	0	0	110.2
217	L	28.3	Very low	31.6	Very low	146 Å²	146	149.2 Å²	149.2	76%	0.764	77%	0.774	S	S	*	*			trans	-89.3	118.9	157	-77.9	163.9	0	0	0	107.6	Q215	Q215-L217 PolarHBondContact O-N 3.49Å
218	I	31.4	Very low	31.1	Very low	166 Å²	166	150 Å²	150	85%	0.851	78%	0.784	S	S	*	*			trans	-112.1	107.1	166.5	-64.1	166.9	0	0	0	106.8
219	S	30	Very low	31	Very low	85 Å²	85	148.1 Å²	148.1	59%	0.594	78%	0.778	S	S	*	*			trans	-103.6	173.1	165.4	56.5	0	0	0	0	110.3
220	D	30.6	Very low	30.7	Very low	143 Å²	143	148.6 Å²	148.6	77%	0.765	78%	0.781	S	S	*	*			trans	74.9	88.2	158.2	-50.5	-50.6	0	0	0	119
221	A	32.9	Very low	30.9	Very low	88 Å²	88	146.3 Å²	146.3	73%	0.727	77%	0.774	S	S	*	*				60.8	103.8	125.2	0	0	0	0	0	119.7
222	N	31.3	Very low	30.9	Very low	166 Å²	166	145.4 Å²	145.4	89%	0.888	76%	0.764	S	S	*	*				-147.6	146.7	122.3	-119.4	-85.8	0	0	0	112.5
223	L	31.4	Very low	31.3	Very low	156 Å²	156	144.5 Å²	144.5	82%	0.817	76%	0.764	S	S	*	*			trans	-96.3	133.4	-176.5	-72.7	161.6	0	0	0	111.2
224	K	33.2	Very low	31.7	Very low	197 Å²	197	138.5 Å²	138.5	86%	0.857	75%	0.751	S	S	*	*			trans	-172	141.9	140.3	-102.1	143.3	-165.9	171.8	0	114.4
225	S	31.9	Very low	32.3	Very low	110 Å²	110	131.5 Å²	131.5	77%	0.769	72%	0.72	S	S	*	*			trans	49.9	100.7	158.8	53.1	0	0	0	0	119.2
226	F	27.4	Very low	32.7	Very low	203 Å²	203	131.3 Å²	131.3	89%	0.89	72%	0.719	S	S	*	*	P	Polyproline II helix	trans	-70.7	151.5	155.5	-60.6	-92.9	0	0	0	111.8
227	P	29.5	Very low	33.5	Very low	108 Å²	108	125.5 Å²	125.5	70%	0.701	69%	0.688	S	S	*	*	P	Polyproline II helix	trans	-98.3	141.2	136.3	34	-27.3	0	0	0	110.3	L229	P227-L229 PolarHBondContact O-N 3.01Å
228	S	25.7	Very low	33.9	Very low	121 Å²	121	124.5 Å²	124.5	85%	0.846	68%	0.679	S	S	*	*	P	Polyproline II helix	trans	-72.7	123.1	176.6	-55.7	0	0	0	0	111.7
229	L	33.5	Very low	34.1	Very low	127 Å²	127	124.1 Å²	124.1	67%	0.665	67%	0.673	S	S	*	*			trans	-133.6	121.4	166	-81.8	175	0	0	0	110.6	P227 D231	P227-L229 PolarHBondContact O-N 3.01Å; L229-D231 PolarHBondContact O-N 3.2Å
230	N	27.9	Very low	34.5	Very low	163 Å²	163	125.6 Å²	125.6	87%	0.872	68%	0.675	S	S	*	*			trans	-83.6	56.7	175.5	-72.6	-23.7	0	0	0	110.3	Q232	N230-Q232 PolarHBondContact O-N 3.21Å
231	D	33.9	Very low	34.6	Very low	109 Å²	109	122 Å²	122	58%	0.583	67%	0.671	S	S	*	*			trans	-76.3	110.2	-169.6	-76.3	-13.3	0	0	0	112.2	L229 L233	L229-D231 PolarHBondContact O-N 3.2Å; D231-L233 VanDerWaalsContact C-N 3.26Å; D231-L233 PolarHBondContact O-N 2.96Å
232	Q	35.1	Very low	34.6	Very low	148 Å²	148	121.7 Å²	121.7	69%	0.692	66%	0.663	S	S	*	*			trans	-72.9	76.1	175.9	-64.8	179.6	38.6	0	0	110.7	N230 S234	N230-Q232 PolarHBondContact O-N 3.21Å; Q232-S234 PolarHBondContact O-N 3.33Å
233	L	41.4	Very low	34.6	Very low	130 Å²	130	119.3 Å²	119.3	68%	0.681	66%	0.659	S	S	*	*			trans	-60.6	94.5	177.1	-76	170.4	0	0	0	111.7	D231 V235	D231-L233 VanDerWaalsContact C-N 3.26Å; D231-L233 PolarHBondContact O-N 2.96Å; L233-V235 PolarHBondContact O-N 2.96Å; L233-V235 VanDerWaalsContact O-N 3.08Å
234	S	37.5	Very low	34.8	Very low	69 Å²	69	115.7 Å²	115.7	48%	0.483	64%	0.64	S	S	.	*			trans	-76.4	90.4	175.5	54.8	0	0	0	0	111	Q232 Q236	Q232-S234 PolarHBondContact O-N 3.33Å; S234-Q236 PolarHBondContact O-N 3.49Å
235	V	45.9	Very low	34.6	Very low	33 Å²	33	112.2 Å²	112.2	20%	0.2	64%	0.637	C	S	.	*			trans	-68.2	98	170	-177.3	0	0	0	0	109.2	V79 I106 L233 I237	V79-V235 HydrophobicContact CG1-CG1 4.29Å; V79-V235 HydrophobicContact CG1-CG2 4.3Å; V79-V235 HydrophobicContact CG2-CG1 4.23Å; I106-V235 HydrophobicContact CD1-CG2 4.48Å; L233-V235 PolarHBondContact O-N 2.96Å; L233-V235 VanDerWaalsContact O-N 3.08Å; V235-I237 PolarHBondContact O-N 3.21Å
236	Q	38.8	Very low	34.8	Very low	135 Å²	135	109.4 Å²	109.4	63%	0.631	63%	0.626	S	S	*	*			trans	-76.3	113	166.2	-81.7	-179.2	-84.7	0	0	109.3	S234 H238	S234-Q236 PolarHBondContact O-N 3.49Å; Q236-H238 PolarHBondContact O-N 2.83Å; Q236-H238 VanDerWaalsContact O-N 3.1Å
237	I	45.8	Very low	35.3	Very low	32 Å²	32	101.4 Å²	101.4	16%	0.164	60%	0.595	C	S	.	*			trans	-64.6	109.3	167.4	-58.3	170.2	0	0	0	107.7	V77 F89 F98 V235	V77-I237 HydrophobicContact CG1-CG1 4.4Å; V77-I237 HydrophobicContact CG1-CG2 4.49Å; F89-I237 HydrophobicContact CD1-CD1 4.12Å; F89-I237 HydrophobicContact CE1-CD1 4Å; F89-I237 HydrophobicContact CE1-CG1 4.44Å; F98-I237 HydrophobicContact CB-CD1 3.86Å; V235-I237 PolarHBondContact O-N 3.21Å
238	H	37.1	Very low	35.8	Very low	126 Å²	126	102 Å²	102	58%	0.583	59%	0.588	S	S	*	*			trans	-86.8	132	172.4	-96.6	-93.7	0	0	0	110.6	Q236 N240	Q236-H238 PolarHBondContact O-N 2.83Å; Q236-H238 VanDerWaalsContact O-N 3.1Å; H238-N240 HydrophobicContact CB-CB 4.28Å; H238-N240 PolarHBondContact ND1-OD1 2.84Å; H238-N240 PolarHBondContact O-N 2.73Å
239	E	36.3	Very low	36.5	Very low	157 Å²	157	102 Å²	102	73%	0.734	57%	0.571	S	S	*	*			trans	-79.4	42.5	172.5	-66.1	176.9	-167.8	0	0	111.4	S100	S100-E239 WeakPolarHBondContact CB-OE1 3.33Å; S100-E239 PolarHBondContact OG-OE1 2.72Å
240	N	37.1	Very low	37.2	Very low	117 Å²	117	98.3 Å²	98.3	63%	0.626	55%	0.55	S	S	*	*			trans	-99	103	179.7	-67.8	28.3	0	0	0	108.5	H238 C242	H238-N240 HydrophobicContact CB-CB 4.28Å; H238-N240 PolarHBondContact ND1-OD1 2.84Å; H238-N240 PolarHBondContact O-N 2.73Å; N240-C242 PolarHBondContact O-N 2.91Å; N240-C242 VanDerWaalsContact O-N 3.12Å
241	G	33.9	Very low	38	Very low	66 Å²	66	98.1 Å²	98.1	68%	0.68	54%	0.542	S	S	*	.			trans	-57.9	116.1	-179.9	0	0	0	0	0	112.3	S243	G241-S243 PolarHBondContact O-N 2.67Å
242	C	31.5	Very low	38.6	Very low	82 Å²	82	97.1 Å²	97.1	55%	0.554	53%	0.533	S	S	*	.			trans	-67.4	89.4	175	-95.8	0	0	0	0	111	N240 I244	N240-C242 PolarHBondContact O-N 2.91Å; N240-C242 VanDerWaalsContact O-N 3.12Å; C242-I244 PolarHBondContact O-N 2.95Å
243	S	31.2	Very low	38.9	Very low	116 Å²	116	97.7 Å²	97.7	81%	0.811	53%	0.534	S	S	*	.			trans	-58	109.5	162.8	-58.9	0	0	0	0	109	G241 P245	G241-S243 PolarHBondContact O-N 2.67Å; S243-P245 WeakPolarHBondContact O-CD 3.21Å
244	I	35.9	Very low	38.9	Very low	81 Å²	81	95 Å²	95	42%	0.415	52%	0.519	S	S	.	.			trans	-60.5	122.7	176.6	-61.2	173.3	0	0	0	107.8	C242 G246	C242-I244 PolarHBondContact O-N 2.95Å; I244-G246 PolarHBondContact O-N 3.48Å; I244-G246 VanDerWaalsContact O-N 3.09Å
245	P	30	Very low	38.9	Very low	123 Å²	123	97.9 Å²	97.9	80%	0.799	53%	0.525	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.4	115.1	179.6	25.2	-32.6	0	0	0	109.9	S243	S243-P245 WeakPolarHBondContact O-CD 3.21Å
246	G	35.2	Very low	38.6	Very low	52 Å²	52	104.4 Å²	104.4	54%	0.536	55%	0.553	S	S	.	*	T	Hydrogen-bonded Turn	trans	91.5	39.7	176.7	0	0	0	0	0	116.2	I244	I244-G246 PolarHBondContact O-N 3.48Å; I244-G246 VanDerWaalsContact O-N 3.09Å
247	S	37.9	Very low	38.6	Very low	34 Å²	34	107 Å²	107	24%	0.238	57%	0.565	C	S	.	*			trans	-141	90.9	168.1	72.9	0	0	0	0	114.1	Y57 Y249	Y57-S247 VanDerWaalsContact OH-CB 3.27Å; Y57-S247 WeakPolarHBondContact OH-CB 3.47Å; S247-Y249 PolarHBondContact O-N 3.35Å
248	E	41.3	Very low	38	Very low	121 Å²	121	108.8 Å²	108.8	57%	0.565	59%	0.591	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-77.9	115.6	168.1	-73.2	173.4	108.3	0	0	109.8	H250	E248-H250 PolarHBondContact O-N 3.07Å; E248-H250 VanDerWaalsContact O-N 3.09Å
249	Y	38.7	Very low	37.8	Very low	121 Å²	121	112.3 Å²	112.3	48%	0.475	61%	0.611	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-81.6	83.9	176.4	179.8	-111.2	0	0	0	110.3	F45 S247 K251	F45-Y249 HydrophobicContact CD1-CD2 4.3Å; F45-Y249 AromaticContact CE1-CD2 3.67Å; F45-Y249 HydrophobicContact CE1-CD2 3.67Å; F45-Y249 HydrophobicContact CE1-CG 4.36Å; F45-Y249 AromaticContact CE2-CD2 3.88Å; F45-Y249 HydrophobicContact CE2-CD2 3.88Å; F45-Y249 HydrophobicContact CE2-CE2 4.09Å; F45-Y249 AromaticContact CZ-CD2 3.43Å; F45-Y249 HydrophobicContact CZ-CD2 3.43Å; F45-Y249 VanDerWaalsContact CZ-CD2 3.43Å; F45-Y249 AromaticContact CZ-CE2 3.96Å; F45-Y249 HydrophobicContact CZ-CE2 3.96Å; F45-Y249 HydrophobicContact CZ-CG 4.43Å; S247-Y249 PolarHBondContact O-N 3.35Å; Y249-K251 HydrophobicContact CE1-CB 4.06Å; Y249-K251 HydrophobicContact CE1-CD 4.02Å; Y249-K251 PolarHBondContact O-N 2.93Å; Y249-K251 VanDerWaalsContact O-N 3.14Å
250	H	49.4	Very low	37.7	Very low	50 Å²	50	108 Å²	108	23%	0.231	61%	0.609	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-82.9	98.5	-173.7	-116.1	59.9	0	0	0	112.4	E21 F44 E248 Q252	E21-H250 WeakPolarHBondContact CG-NE2 3.48Å; E21-H250 IonicContact OE1-CD2 3.38Å; E21-H250 IonicContact OE1-CE1 2.77Å; E21-H250 IonicContact OE1-CG 3.55Å; E21-H250 IonicContact OE1-ND1 3.56Å; E21-H250 IonicContact OE1-NE2 3.53Å; F44-H250 VanDerWaalsContact CD1-O 3.25Å; F44-H250 WeakPolarHBondContact CD1-O 3.31Å; F44-H250 HydrophobicContact CD2-CB 4.42Å; F44-H250 HydrophobicContact CE1-CB 4.35Å; F44-H250 WeakPolarHBondContact CE1-O 3.46Å; F44-H250 HydrophobicContact CE2-CB 3.77Å; F44-H250 HydrophobicContact CZ-CB 3.74Å; F44-H250 PolarHBondContact O-N 3.47Å; E248-H250 PolarHBondContact O-N 3.07Å; E248-H250 VanDerWaalsContact O-N 3.09Å; H250-Q252 VanDerWaalsContact C-N 3.34Å; H250-Q252 PolarHBondContact NE2-NE2 3.48Å; H250-Q252 PolarHBondContact O-N 2.97Å
251	K	44.5	Very low	37.4	Very low	159 Å²	159	108.9 Å²	108.9	69%	0.691	62%	0.621	S	S	*	*			trans	-97.8	48	174.2	-160.1	171.6	-179.6	172.9	0	111.9	Y249 K253	Y249-K251 HydrophobicContact CE1-CB 4.06Å; Y249-K251 HydrophobicContact CE1-CD 4.02Å; Y249-K251 PolarHBondContact O-N 2.93Å; Y249-K251 VanDerWaalsContact O-N 3.14Å; K251-K253 PolarHBondContact O-N 3.26Å
252	Q	45.5	Very low	37.6	Very low	87 Å²	87	111.8 Å²	111.8	41%	0.407	63%	0.625	S	S	.	*	P	Polyproline II helix	trans	-70.1	121.7	174	-80.4	-178.5	-11.6	0	0	110.5	H250	H250-Q252 VanDerWaalsContact C-N 3.34Å; H250-Q252 PolarHBondContact NE2-NE2 3.48Å; H250-Q252 PolarHBondContact O-N 2.97Å
253	K	41.7	Very low	37.6	Very low	161 Å²	161	114.3 Å²	114.3	70%	0.7	64%	0.638	S	S	*	*	P	Polyproline II helix	trans	-68.4	127.8	171.3	-179.5	-170.3	170.2	-146.5	0	108.5	K251 E255	K251-K253 PolarHBondContact O-N 3.26Å; K253-E255 HydrophobicContact CD-CG 4.36Å; K253-E255 HydrophobicContact CG-CG 4.39Å; K253-E255 IonicContact NZ-OE1 2.64Å; K253-E255 PolarHBondContact NZ-OE1 3.35Å; K253-E255 PolarHBondContact O-N 2.81Å
254	L	42.6	Very low	37.9	Very low	72 Å²	72	115.6 Å²	115.6	38%	0.377	63%	0.634	S	S	.	*	P	Polyproline II helix	trans	-65.1	123.4	171.1	-86	74	0	0	0	109.1	L18 Y27 K40	L18-L254 HydrophobicContact CD1-CD2 4.4Å; L18-L254 HydrophobicContact CD2-CD2 3.54Å; L18-L254 HydrophobicContact CD2-CG 4.07Å; Y27-L254 HydrophobicContact CE2-CD2 4.23Å; K40-L254 HydrophobicContact CB-CD2 4.18Å; K40-L254 HydrophobicContact CD-CD2 4.14Å; K40-L254 HydrophobicContact CG-CD2 3.99Å
255	E	37.5	Very low	37.6	Very low	131 Å²	131	119.4 Å²	119.4	61%	0.612	66%	0.656	S	S	*	*			trans	-121.4	117.4	171	-61.8	-164	148.2	0	0	108.8	K253	K253-E255 HydrophobicContact CD-CG 4.36Å; K253-E255 HydrophobicContact CG-CG 4.39Å; K253-E255 IonicContact NZ-OE1 2.64Å; K253-E255 PolarHBondContact NZ-OE1 3.35Å; K253-E255 PolarHBondContact O-N 2.81Å
256	E	39.4	Very low	37.8	Very low	169 Å²	169	119.1 Å²	119.1	79%	0.79	65%	0.652	S	S	*	*			trans	-76.5	132.9	177.8	-63.7	-178.9	149.9	0	0	109.4	G258	E256-G258 PolarHBondContact O-N 3.38Å
257	H	38.8	Very low	37.7	Very low	189 Å²	189	124 Å²	124	88%	0.875	67%	0.665	S	S	*	*			trans	-80.9	112.9	-167.7	-75.6	-33.1	0	0	0	113.6
258	G	33.4	Very low	37.4	Very low	70 Å²	70	130.8 Å²	130.8	72%	0.722	70%	0.698	S	S	*	*			trans	-142.6	102.4	169.1	0	0	0	0	0	113.2	E256	E256-G258 PolarHBondContact O-N 3.38Å
259	M	32.6	Very low	37	Very low	200 Å²	200	130.7 Å²	130.7	99%	0.985	71%	0.71	S	S	*	*	S	Bend	trans	36.6	109.7	160.6	-74.8	-69.2	-160.8	0	0	119.8
260	G	32.8	Very low	37	Very low	68 Å²	68	131.4 Å²	131.4	70%	0.701	73%	0.727	S	S	*	*			trans	133.9	134	152.9	0	0	0	0	0	115.1
261	P	32.7	Very low	36.4	Very low	135 Å²	135	135.3 Å²	135.3	88%	0.877	76%	0.755	S	S	*	*			trans	-86.8	121.7	176.2	33	-31.3	0	0	0	111.6
262	V	37.6	Very low	35.8	Very low	127 Å²	127	132.6 Å²	132.6	77%	0.77	75%	0.753	S	S	*	*			trans	-132.9	117.8	167.7	-178.4	0	0	0	0	109.3	I264	V262-I264 HydrophobicContact CG1-CD1 4.16Å
263	T	31	Very low	35.1	Very low	134 Å²	134	131.8 Å²	131.8	82%	0.822	77%	0.769	S	S	*	*			trans	-90.9	124.2	172.6	51	0	0	0	0	110.5
264	I	38.1	Very low	34.6	Very low	143 Å²	143	133.3 Å²	133.3	73%	0.733	78%	0.778	S	S	*	*			trans	-153.8	131.3	157.2	-89.4	122.7	0	0	0	108.4	V262	V262-I264 HydrophobicContact CG1-CD1 4.16Å
265	D	29.8	Very low	34.1	Very low	161 Å²	161	136.6 Å²	136.6	86%	0.861	80%	0.802	S	S	*	*			trans	-82.7	125.2	174.9	-48.1	-87.1	0	0	0	111.4
266	T	33.1	Very low	34	Very low	117 Å²	117	137.5 Å²	137.5	72%	0.718	81%	0.809	S	S	*	*			trans	-160.9	155.6	159.4	-38	0	0	0	0	111.5
267	L	33.6	Very low	33.6	Very low	154 Å²	154	134.4 Å²	134.4	81%	0.806	81%	0.806	S	S	*	*			trans	85.6	73	162.8	-52.8	177.9	0	0	0	119.3
268	L	32.1	Very low	33.5	Very low	178 Å²	178	131 Å²	131	93%	0.932	80%	0.801	S	S	*	*				-126.4	123.2	130	-82.2	96.4	0	0	0	109.5
269	S	32.3	Very low	33.4	Very low	119 Å²	119	135.7 Å²	135.7	83%	0.832	81%	0.809	S	S	*	*			trans	-166.8	61.5	171.2	-180	0	0	0	0	110.3
270	T	38.3	Very low	33.4	Very low	135 Å²	135	130.8 Å²	130.8	83%	0.828	79%	0.794	S	S	*	*			trans	-74.7	134.3	166.8	31.8	0	0	0	0	110.5
271	T	37	Very low	33.4	Very low	133 Å²	133	137.2 Å²	137.2	82%	0.816	80%	0.803	S	S	*	*			trans	-73.8	142.3	-179.5	49.2	0	0	0	0	112.9
272	P	30.9	Very low	33.5	Very low	101 Å²	101	136.6 Å²	136.6	66%	0.656	80%	0.798	S	S	*	*				-116.1	162.4	124.8	35.4	-31.7	0	0	0	110.5
273	G	32.2	Very low	33.4	Very low	71 Å²	71	137 Å²	137	73%	0.732	80%	0.802	S	S	*	*			trans	153.6	51.4	179.9	0	0	0	0	0	116.8
274	Q	31.6	Very low	33.6	Very low	193 Å²	193	135.9 Å²	135.9	90%	0.902	80%	0.801	S	S	*	*			trans	-96.7	99.8	156.5	-72.4	-169.6	11.3	0	0	108.8
275	T	32.1	Very low	33.5	Very low	141 Å²	141	133.3 Å²	133.3	87%	0.865	80%	0.8	S	S	*	*			trans	-124.1	128.9	164.8	32	0	0	0	0	109.8
276	I	35.4	Very low	33.6	Very low	149 Å²	149	131 Å²	131	76%	0.764	80%	0.795	S	S	*	*			trans	-88.2	145.4	-171.1	-66	164	0	0	0	109.5
277	S	30.4	Very low	33.7	Very low	104 Å²	104	132.8 Å²	132.8	73%	0.727	80%	0.796	S	S	*	*			trans	-72.8	140.2	-178.7	45	0	0	0	0	113.5
278	P	35.8	Very low	33.6	Very low	118 Å²	118	135.2 Å²	135.2	77%	0.766	79%	0.794	S	S	*	*			trans	-122.7	87.4	160.6	34.6	-20	0	0	0	110.4
279	N	32.7	Very low	33.7	Very low	169 Å²	169	138.6 Å²	138.6	90%	0.904	79%	0.794	S	S	*	*			trans	-109.3	50.1	178.1	-118.8	19.2	0	0	0	112.3
280	S	31.4	Very low	33.9	Very low	96 Å²	96	139.7 Å²	139.7	67%	0.671	79%	0.79	S	S	*	*			trans	-167.1	116.9	164	44.8	0	0	0	0	110.8
281	F	33.3	Very low	33.8	Very low	203 Å²	203	138.8 Å²	138.8	89%	0.89	79%	0.787	S	S	*	*				170.9	140.5	127.4	-100.1	-72.1	0	0	0	110.2
282	T	35.7	Very low	34	Very low	123 Å²	123	137.6 Å²	137.6	76%	0.755	78%	0.782	S	S	*	*			trans	-79.8	133.9	-178.9	43	0	0	0	0	111.3
283	P	35.1	Very low	34.3	Very low	134 Å²	134	139 Å²	139	87%	0.87	79%	0.791	S	S	*	*			trans	-76.3	127.5	171.6	30.7	-32.3	0	0	0	110.2
284	S	35.8	Very low	34.4	Very low	112 Å²	112	139 Å²	139	78%	0.783	79%	0.791	S	S	*	*			trans	-138.8	123.8	173.3	-171.1	0	0	0	0	111.1
285	A	34.7	Very low	34.8	Very low	88 Å²	88	134.3 Å²	134.3	73%	0.727	78%	0.776	S	S	*	*			trans	61.1	142.1	166.5	0	0	0	0	0	120
286	C	32	Very low	35	Very low	112 Å²	112	134 Å²	134	76%	0.757	77%	0.769	S	S	*	*			trans	63.6	146.1	163.2	-65.4	0	0	0	0	118.2
287	E	34.7	Very low	34.8	Very low	156 Å²	156	137.4 Å²	137.4	73%	0.729	77%	0.773	S	S	*	*			cis	-136	150.1	-1.4	-163.6	53.8	-105.9	0	0	110.6
288	R	31.3	Very low	34.9	Very low	205 Å²	205	135.8 Å²	135.8	77%	0.774	77%	0.773	S	S	*	*			trans	-80.3	138.1	-172.7	-63.3	173.4	177	136.7	-5	112.6	I290	R288-I290 HydrophobicContact CB-CG1 4.3Å
289	R	34.6	Very low	35	Very low	248 Å²	248	136.9 Å²	136.9	94%	0.936	76%	0.762	S	S	*	*			trans	-122.8	118.4	147.1	-73.6	-165.5	176.8	-160.5	-0.6	109.4
290	I	36.6	Very low	35.3	Very low	142 Å²	142	136.8 Å²	136.8	73%	0.728	76%	0.756	S	S	*	*			trans	-96.8	115.6	-172	-59	172.7	0	0	0	108.4	R288	R288-I290 HydrophobicContact CB-CG1 4.3Å
291	C	37.6	Very low	35.3	Very low	116 Å²	116	142 Å²	142	78%	0.784	76%	0.763	S	S	*	*	P	Polyproline II helix	trans	-84.8	146.1	158.3	-69.6	0	0	0	0	108.9
292	P	41.1	Very low	35.5	Very low	108 Å²	108	136.1 Å²	136.1	70%	0.701	75%	0.745	S	S	*	*	P	Polyproline II helix	trans	-71.2	146.7	-170.9	28.8	-35.6	0	0	0	112.5
293	P	35.6	Very low	35.9	Very low	130 Å²	130	136.9 Å²	136.9	84%	0.844	74%	0.743	S	S	*	*	S	Bend	trans	-72	149.9	171.3	31.7	-34.8	0	0	0	111.4
294	G	35.9	Very low	36.7	Very low	72 Å²	72	133.6 Å²	133.6	74%	0.742	72%	0.723	S	S	*	*			trans	108.2	34.7	164.1	0	0	0	0	0	117.7
295	V	39.2	Very low	37.2	Very low	95 Å²	95	134.6 Å²	134.6	58%	0.576	71%	0.711	S	S	*	*			trans	-131.1	81.2	169.5	-159	0	0	0	0	111.5	Y297	V295-Y297 VanDerWaalsContact C-N 3.34Å; V295-Y297 HydrophobicContact CB-CD2 4.48Å; V295-Y297 HydrophobicContact CB-CE2 4.25Å; V295-Y297 HydrophobicContact CG1-CD2 3.75Å; V295-Y297 HydrophobicContact CG1-CE1 4.22Å; V295-Y297 HydrophobicContact CG1-CE2 3.29Å; V295-Y297 HydrophobicContact CG1-CG 4.39Å; V295-Y297 PolarHBondContact O-N 2.7Å
296	D	36.1	Very low	38	Very low	133 Å²	133	136.6 Å²	136.6	71%	0.711	71%	0.708	S	S	*	*			trans	-75.7	75.2	179.6	-75.7	-52.4	0	0	0	112.8	G298	D296-G298 PolarHBondContact O-N 2.96Å
297	Y	31.4	Very low	39.3	Very low	221 Å²	221	136.5 Å²	136.5	87%	0.867	70%	0.697	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.2	78.3	169.9	-71	-63.2	0	0	0	111.7	V295	V295-Y297 VanDerWaalsContact C-N 3.34Å; V295-Y297 HydrophobicContact CB-CD2 4.48Å; V295-Y297 HydrophobicContact CB-CE2 4.25Å; V295-Y297 HydrophobicContact CG1-CD2 3.75Å; V295-Y297 HydrophobicContact CG1-CE1 4.22Å; V295-Y297 HydrophobicContact CG1-CE2 3.29Å; V295-Y297 HydrophobicContact CG1-CG 4.39Å; V295-Y297 PolarHBondContact O-N 2.7Å
298	G	33.2	Very low	40.4	Very low	70 Å²	70	133 Å²	133	72%	0.722	68%	0.682	S	S	*	*	T	Hydrogen-bonded Turn	trans	165.1	-14.6	167.9	0	0	0	0	0	118.2	D296	D296-G298 PolarHBondContact O-N 2.96Å
299	R	36.5	Very low	41.5	Very low	141 Å²	141	126.3 Å²	126.3	53%	0.532	67%	0.672	S	S	.	*	S	Bend	trans	-138.4	53.3	-170.9	-67.9	-167.1	176.1	-127.7	-6.4	115.9	S512 F513	R299-S512 PolarHBondContact NH2-OG 3.25Å; R299-F513 VanDerWaalsContact NH1-CZ 3.34Å
300	Q	39.3	Very low	42.6	Very low	168 Å²	168	122.7 Å²	122.7	79%	0.785	67%	0.665	S	S	*	*			trans	-153	68.6	167.5	-112.8	152.8	77.7	0	0	113.9
301	Y	32.6	Very low	43.6	Very low	206 Å²	206	121.9 Å²	121.9	81%	0.808	66%	0.658	S	S	*	*			trans	-81	123.9	154.6	-84.3	-82.9	0	0	0	108.7
302	P	36.7	Very low	43.8	Very low	78 Å²	78	119.2 Å²	119.2	51%	0.506	65%	0.651	S	S	.	*			trans	-68.5	145.5	177.1	29.3	-34.6	0	0	0	110.7	S304 Y305	P302-S304 PolarHBondContact O-N 3.4Å; P302-Y305 PolarHBondContact O-N 3.38Å
303	I	43.5	Very low	43.9	Very low	139 Å²	139	121.1 Å²	121.1	71%	0.713	65%	0.648	S	S	*	*	H	α-helix	trans	-58.2	-27	-175.5	-65.6	170.7	0	0	0	112	Y305 L306 Q307	I303-Y305 PolarHBondContact O-N 3.42Å; I303-L306 PolarHBondContact O-N 3.5Å; I303-Q307 PolarHBondContact O-N 2.87Å
304	S	53.3	Low	44.3	Very low	66 Å²	66	119.7 Å²	119.7	46%	0.462	64%	0.637	S	S	.	*	H	α-helix	trans	-52	-35.2	173.3	50.1	0	0	0	0	113.9	P302 L306 Q307 L308	P302-S304 PolarHBondContact O-N 3.4Å; S304-L306 PolarHBondContact O-N 2.67Å; S304-Q307 PolarHBondContact O-N 3.12Å; S304-L308 WeakPolarHBondContact O-CB 3.13Å; S304-L308 WeakPolarHBondContact O-CG 3.28Å; S304-L308 PolarHBondContact O-N 3.06Å
305	Y	44.8	Very low	44.3	Very low	132 Å²	132	120 Å²	120	52%	0.518	63%	0.633	S	S	.	*	H	α-helix	trans	-71.1	-32.2	-177.1	-145.8	-86.3	0	0	0	112.8	P302 I303 A309 A315	P302-Y305 PolarHBondContact O-N 3.38Å; I303-Y305 PolarHBondContact O-N 3.42Å; Y305-A309 PolarHBondContact O-N 3.27Å; Y305-A315 VanDerWaalsContact OH-CB 3.25Å; Y305-A315 WeakPolarHBondContact OH-CB 3.32Å
306	L	53.2	Low	44.3	Very low	130 Å²	130	121.6 Å²	121.6	68%	0.681	64%	0.637	S	S	*	*	H	α-helix	trans	-71.7	-39.6	170.7	-79.3	167.7	0	0	0	111.2	I303 S304 L308 A309 E310	I303-L306 PolarHBondContact O-N 3.5Å; S304-L306 PolarHBondContact O-N 2.67Å; L306-L308 PolarHBondContact O-N 2.85Å; L306-A309 WeakPolarHBondContact O-CB 3.46Å; L306-A309 PolarHBondContact O-N 3.35Å; L306-E310 PolarHBondContact O-N 2.65Å
307	Q	57.8	Low	44	Very low	111 Å²	111	123.3 Å²	123.3	52%	0.519	64%	0.643	S	S	.	*	H	α-helix	trans	-70.8	-30.4	-178.7	-161.1	164.5	-1.9	0	0	112.9	I303 S304 E310 Q311	I303-Q307 PolarHBondContact O-N 2.87Å; S304-Q307 PolarHBondContact O-N 3.12Å; Q307-E310 PolarHBondContact O-N 3.21Å; Q307-Q311 WeakPolarHBondContact O-CG 3.28Å; Q307-Q311 PolarHBondContact O-N 2.84Å; Q307-Q311 VanDerWaalsContact O-N 3.14Å
308	L	57.7	Low	44	Very low	81 Å²	81	117.6 Å²	117.6	42%	0.424	64%	0.635	S	S	.	*	H	α-helix	trans	-67.5	-39.3	169.1	-73.8	167.5	0	0	0	112.2	S304 L306 Q311 G312 F313	S304-L308 WeakPolarHBondContact O-CB 3.13Å; S304-L308 WeakPolarHBondContact O-CG 3.28Å; S304-L308 PolarHBondContact O-N 3.06Å; L306-L308 PolarHBondContact O-N 2.85Å; L308-Q311 CarbonylContact O-C 3.53Å; L308-Q311 PolarHBondContact O-N 2.77Å; L308-Q311 VanDerWaalsContact O-N 3.17Å; L308-G312 PolarHBondContact O-N 3.17Å; L308-F313 PolarHBondContact O-N 3.46Å
309	A	54.4	Low	44.2	Very low	66 Å²	66	119.7 Å²	119.7	55%	0.545	64%	0.638	S	S	.	*	H	α-helix	trans	-66.4	-36.2	174.6	0	0	0	0	0	112.3	Y305 L306 Q311 G312	Y305-A309 PolarHBondContact O-N 3.27Å; L306-A309 WeakPolarHBondContact O-CB 3.46Å; L306-A309 PolarHBondContact O-N 3.35Å; A309-Q311 VanDerWaalsContact C-N 3.28Å; A309-Q311 PolarHBondContact O-N 3.38Å; A309-G312 PolarHBondContact O-N 2.9Å
310	E	57.3	Low	44.2	Very low	171 Å²	171	118.5 Å²	118.5	80%	0.799	64%	0.639	S	S	*	*	H	α-helix	trans	-68.2	-24.7	171.8	-72.2	-176.4	163.1	0	0	113.1	L306 Q307 G312	L306-E310 PolarHBondContact O-N 2.65Å; Q307-E310 PolarHBondContact O-N 3.21Å; E310-G312 VanDerWaalsContact C-N 3.31Å
311	Q	59.1	Low	44	Very low	125 Å²	125	120.1 Å²	120.1	58%	0.584	65%	0.646	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.8	1.3	172	-71.8	-180	-4.7	0	0	113.9	Q307 L308 A309 F313	Q307-Q311 WeakPolarHBondContact O-CG 3.28Å; Q307-Q311 PolarHBondContact O-N 2.84Å; Q307-Q311 VanDerWaalsContact O-N 3.14Å; L308-Q311 CarbonylContact O-C 3.53Å; L308-Q311 PolarHBondContact O-N 2.77Å; L308-Q311 VanDerWaalsContact O-N 3.17Å; A309-Q311 VanDerWaalsContact C-N 3.28Å; A309-Q311 PolarHBondContact O-N 3.38Å; Q311-F313 VanDerWaalsContact C-N 3.35Å; Q311-F313 HydrophobicContact CB-CD2 3.98Å; Q311-F313 HydrophobicContact CB-CE2 4.32Å; Q311-F313 PolarHBondContact O-N 3.29Å
312	G	40.5	Very low	44.2	Very low	61 Å²	61	116.2 Å²	116.2	63%	0.629	64%	0.639	S	S	*	*	T	Hydrogen-bonded Turn	trans	80.9	7.2	174.4	0	0	0	0	0	115.5	L308 A309 E310 T314	L308-G312 PolarHBondContact O-N 3.17Å; A309-G312 PolarHBondContact O-N 2.9Å; E310-G312 VanDerWaalsContact C-N 3.31Å; G312-T314 PolarHBondContact O-N 2.82Å
313	F	43.4	Very low	44	Very low	147 Å²	147	120.3 Å²	120.3	65%	0.645	66%	0.656	S	S	*	*			trans	-76.8	110.5	174.4	-72.7	-80.6	0	0	0	110.6	L308 Q311	L308-F313 PolarHBondContact O-N 3.46Å; Q311-F313 VanDerWaalsContact C-N 3.35Å; Q311-F313 HydrophobicContact CB-CD2 3.98Å; Q311-F313 HydrophobicContact CB-CE2 4.32Å; Q311-F313 PolarHBondContact O-N 3.29Å
314	T	44.3	Very low	43.5	Very low	100 Å²	100	118.8 Å²	118.8	61%	0.613	66%	0.656	S	S	*	*			trans	-75.6	119.4	164.6	50.7	0	0	0	0	109.2	G312 I316	G312-T314 PolarHBondContact O-N 2.82Å; T314-I316 PolarHBondContact O-N 2.9Å; T314-I316 WeakPolarHBondContact OG1-CD1 3.25Å
315	A	35.7	Very low	42.5	Very low	79 Å²	79	122.7 Å²	122.7	65%	0.653	67%	0.671	S	S	*	*			trans	-62.7	106.8	166.9	0	0	0	0	0	108.8	Y305	Y305-A315 VanDerWaalsContact OH-CB 3.25Å; Y305-A315 WeakPolarHBondContact OH-CB 3.32Å
316	I	40.6	Very low	41.9	Very low	128 Å²	128	125.6 Å²	125.6	66%	0.656	69%	0.692	S	S	*	*			trans	-127.3	137.1	176.5	-69.9	177.6	0	0	0	106.2	T314	T314-I316 PolarHBondContact O-N 2.9Å; T314-I316 WeakPolarHBondContact OG1-CD1 3.25Å
317	M	29.3	Very low	41	Very low	170 Å²	170	124.3 Å²	124.3	84%	0.837	69%	0.694	S	S	*	*	S	Bend	trans	67.8	141.4	-179.5	-69.3	163.2	65.1	0	0	116
318	S	30.1	Very low	39.7	Very low	100 Å²	100	126.7 Å²	126.7	70%	0.699	71%	0.71	S	S	*	*			trans	-45.7	145.7	162.1	-37.1	0	0	0	0	111.2	E320	S318-E320 VanDerWaalsContact C-N 3.32Å; S318-E320 PolarHBondContact O-N 3.09Å
319	S	37.5	Very low	38.6	Very low	114 Å²	114	130.5 Å²	130.5	80%	0.797	73%	0.726	S	S	*	*			trans	-73.4	96	143	-56.3	0	0	0	0	105.7
320	E	37.1	Very low	37.5	Very low	117 Å²	117	133 Å²	133	55%	0.547	73%	0.73	S	S	.	*				63.1	111.1	86.1	-69.7	168.7	151.1	0	0	109.1	S318 L322	S318-E320 VanDerWaalsContact C-N 3.32Å; S318-E320 PolarHBondContact O-N 3.09Å; E320-L322 HydrophobicContact CB-CB 4.29Å; E320-L322 HydrophobicContact CB-CD1 4.14Å; E320-L322 HydrophobicContact CB-CG 3.95Å; E320-L322 PolarHBondContact O-N 3.28Å; E320-L322 WeakPolarHBondContact OE2-CD1 3.38Å
321	E	36.1	Very low	36.2	Very low	201 Å²	201	132.8 Å²	132.8	94%	0.939	73%	0.733	S	S	*	*				46.8	19.2	50	-60	-147.5	133.9	0	0	114.2
322	L	36.7	Very low	35	Very low	125 Å²	125	129.9 Å²	129.9	65%	0.654	74%	0.737	S	S	*	*			trans	-98.2	95.5	160.1	-83.5	167.2	0	0	0	109.1	E320 P324	E320-L322 HydrophobicContact CB-CB 4.29Å; E320-L322 HydrophobicContact CB-CD1 4.14Å; E320-L322 HydrophobicContact CB-CG 3.95Å; E320-L322 PolarHBondContact O-N 3.28Å; E320-L322 WeakPolarHBondContact OE2-CD1 3.38Å; L322-P324 VanDerWaalsContact O-CD 3.31Å; L322-P324 WeakPolarHBondContact O-CD 3.46Å
323	N	32.2	Very low	34.6	Very low	163 Å²	163	134.8 Å²	134.8	87%	0.872	74%	0.743	S	S	*	*			trans	-86.6	117.9	157	-83.5	-60.5	0	0	0	109.1
324	P	32.5	Very low	33.9	Very low	107 Å²	107	138 Å²	138	70%	0.695	75%	0.751	S	S	*	*			trans	-126.8	81.2	162.7	36.8	-22.7	0	0	0	110.9	L322	L322-P324 VanDerWaalsContact O-CD 3.31Å; L322-P324 WeakPolarHBondContact O-CD 3.46Å
325	N	32.1	Very low	33.3	Very low	148 Å²	148	138.6 Å²	138.6	79%	0.791	76%	0.759	S	S	*	*			trans	-161.5	68.3	163.2	-102.3	-33.8	0	0	0	112.3
326	M	33.1	Very low	32.9	Very low	194 Å²	194	146.2 Å²	146.2	96%	0.956	77%	0.77	S	S	*	*			trans	-138.3	81.5	163.1	-84.1	-65.3	145.4	0	0	108.9
327	S	33.3	Very low	32.5	Very low	102 Å²	102	145.4 Å²	145.4	71%	0.713	78%	0.776	S	S	*	*			trans	-156.8	64.2	176.6	66.1	0	0	0	0	113
328	N	31.7	Very low	32.4	Very low	162 Å²	162	145.3 Å²	145.3	87%	0.866	78%	0.778	S	S	*	*			trans	-154	125.1	140.8	-91.5	-20.7	0	0	0	104.2
329	E	33.2	Very low	32.5	Very low	160 Å²	160	145 Å²	145	75%	0.748	78%	0.782	S	S	*	*	S	Bend	cis	-129.6	180	22.8	-52.2	-175.4	126.2	0	0	113.8
330	N	32.4	Very low	31.9	Very low	119 Å²	119	150.6 Å²	150.6	64%	0.636	79%	0.786	S	S	*	*			trans	63.7	94	153.6	-55.3	-34.6	0	0	0	117.5
331	I	30.2	Very low	31.5	Very low	166 Å²	166	149.4 Å²	149.4	85%	0.851	79%	0.79	S	S	*	*				89.6	133.3	83.3	-78.7	163.9	0	0	0	112.5
332	G	32.5	Very low	31.2	Very low	65 Å²	65	146.8 Å²	146.8	67%	0.67	78%	0.783	S	S	*	*			trans	107.2	62	175.3	0	0	0	0	0	114.6
333	H	31.8	Very low	30.8	Very low	164 Å²	164	146.5 Å²	146.5	76%	0.759	78%	0.781	S	S	*	*				52.5	116.7	91.7	-77.6	-32.5	0	0	0	117.8
334	R	30.5	Very low	30.7	Very low	215 Å²	215	147.7 Å²	147.7	81%	0.811	78%	0.779	S	S	*	*			trans	68.6	115.3	145.1	-56.1	171.7	-174.3	-151.1	-0.1	116.2
335	S	29.9	Very low	30.5	Very low	111 Å²	111	146.8 Å²	146.8	78%	0.776	78%	0.775	S	S	*	*				76.1	127.4	54.3	-54.1	0	0	0	0	115.8
336	R	28.3	Very low	30.4	Very low	239 Å²	239	144.9 Å²	144.9	90%	0.902	77%	0.774	S	S	*	*			trans	103	156.5	163.5	-62.5	-179.9	169.1	-174.2	-3.7	118
337	S	32.1	Very low	30.3	Very low	111 Å²	111	140.2 Å²	140.2	78%	0.776	76%	0.76	S	S	*	*			trans	74.9	138.6	170.3	-48.3	0	0	0	0	114.7
338	L	27.2	Very low	30.3	Very low	168 Å²	168	142.6 Å²	142.6	88%	0.88	76%	0.76	S	S	*	*			cis	69	141.4	29.5	-61.2	178.7	0	0	0	115.2
339	A	31.4	Very low	30.5	Very low	94 Å²	94	144.3 Å²	144.3	78%	0.777	76%	0.755	S	S	*	*			trans	64.3	133	-161	0	0	0	0	0	112.9
340	R	25	Very low	30.4	Very low	232 Å²	232	142 Å²	142	88%	0.875	75%	0.753	S	S	*	*			cis	79.4	129	35.1	-160.5	-173.8	-159.2	-160.7	6.7	112.5
341	S	28.8	Very low	30.5	Very low	92 Å²	92	141.6 Å²	141.6	64%	0.643	76%	0.757	S	S	*	*			trans	53.6	104.7	168.2	52	0	0	0	0	117.9
342	N	30.8	Very low	30.7	Very low	146 Å²	146	139.4 Å²	139.4	78%	0.781	76%	0.756	S	S	*	*				-165.6	127.4	113.4	-91.2	-24	0	0	0	108.1
343	N	28.7	Very low	30.6	Very low	118 Å²	118	143.7 Å²	143.7	63%	0.631	76%	0.758	S	S	*	*				94.4	123.9	52	-94.2	-34.8	0	0	0	111.6
344	F	28.8	Very low	30.7	Very low	189 Å²	189	144.7 Å²	144.7	83%	0.829	76%	0.763	S	S	*	*			trans	67	150.6	160.5	-73	-129.1	0	0	0	115.9
345	S	29.1	Very low	30.6	Very low	87 Å²	87	142.3 Å²	142.3	61%	0.608	76%	0.761	S	S	*	*			cis	-166.9	168.1	-22.9	-101.6	0	0	0	0	108
346	S	29.4	Very low	30.9	Very low	109 Å²	109	142.6 Å²	142.6	76%	0.762	76%	0.758	S	S	*	*			trans	39.4	106.2	150.9	-57.6	0	0	0	0	116.7
347	S	31.6	Very low	30.9	Very low	96 Å²	96	135.2 Å²	135.2	67%	0.671	74%	0.742	S	S	*	*				155.5	179.9	62.2	59	0	0	0	0	108.4
348	H	32	Very low	30.8	Very low	152 Å²	152	140 Å²	140	70%	0.704	74%	0.743	S	S	*	*			cis	-154.2	150.6	8.9	-118.3	-41.7	0	0	0	108.8
349	Y	37.1	Very low	30.9	Very low	197 Å²	197	141.6 Å²	141.6	77%	0.773	74%	0.738	S	S	*	*			trans	51.8	137.6	159.3	-73.5	-99.7	0	0	0	121.3
350	T	30.6	Very low	31	Very low	112 Å²	112	144.4 Å²	144.4	69%	0.687	74%	0.74	S	S	*	*			cis	-175	145.6	-40.1	25.2	0	0	0	0	107.2
351	P	35.5	Very low	31.3	Very low	111 Å²	111	139.1 Å²	139.1	72%	0.721	73%	0.733	S	S	*	*			trans	-94.1	155.6	174.7	37	-34.1	0	0	0	113.9
352	S	32.8	Very low	31.5	Very low	119 Å²	119	140.6 Å²	140.6	83%	0.832	74%	0.738	S	S	*	*			trans	-141.5	102.9	165.4	-65.2	0	0	0	0	108.9
353	H	30.7	Very low	31.5	Very low	156 Å²	156	144 Å²	144	72%	0.722	74%	0.74	S	S	*	*				61.1	84.5	76.1	-93.5	-90.7	0	0	0	116.9	H355	H353-H355 AromaticContact ND1-CD2 3.93Å
354	Q	35.4	Very low	31.6	Very low	185 Å²	185	143.9 Å²	143.9	86%	0.864	75%	0.748	S	S	*	*			trans	-146.8	122.4	143.9	-63.8	-173.6	-1	0	0	106.3
355	H	28.4	Very low	31.7	Very low	165 Å²	165	138.8 Å²	138.8	76%	0.764	74%	0.741	S	S	*	*			cis	85.5	36.4	2	-122.4	-68.3	0	0	0	119	H353	H353-H355 AromaticContact ND1-CD2 3.93Å
356	V	36.2	Very low	31.8	Very low	117 Å²	117	140.7 Å²	140.7	71%	0.709	75%	0.749	S	S	*	*			trans	-134.2	115.1	159.4	-171.6	0	0	0	0	104.8
357	S	27.8	Very low	31.9	Very low	83 Å²	83	139.7 Å²	139.7	58%	0.58	74%	0.742	S	S	*	*			cis	79.8	136.5	41.8	105	0	0	0	0	114.5
358	R	29.3	Very low	31.9	Very low	211 Å²	211	142.2 Å²	142.2	80%	0.796	75%	0.748	S	S	*	*			trans	71.5	119.9	165.3	-64.8	174.3	178.7	-170.1	-0.2	114.7
359	R	30.2	Very low	32.1	Very low	202 Å²	202	140.4 Å²	140.4	76%	0.762	75%	0.753	S	S	*	*				64.4	107.6	87.8	-67.3	177.5	178.9	168.6	-2.2	112.8	V361	R359-V361 HydrophobicContact CB-CG2 4.49Å
360	D	33.5	Very low	31.7	Very low	153 Å²	153	139.2 Å²	139.2	82%	0.818	76%	0.756	S	S	*	*				-148	142	102.8	-78.3	-36.5	0	0	0	107
361	V	30.7	Very low	32.2	Very low	122 Å²	122	138.3 Å²	138.3	74%	0.739	75%	0.752	S	S	*	*			cis	76.6	45.3	12.7	-155.2	0	0	0	0	115.7	R359	R359-V361 HydrophobicContact CB-CG2 4.49Å
362	V	33.8	Very low	31.8	Very low	123 Å²	123	141.5 Å²	141.5	75%	0.745	76%	0.755	S	S	*	*			trans	-125.3	98.9	146.8	179.9	0	0	0	0	105.7
363	R	29.8	Very low	31.6	Very low	218 Å²	218	145.5 Å²	145.5	82%	0.823	75%	0.752	S	S	*	*				61.3	119.5	106.8	-72.4	179.1	172.9	174.6	-2.6	113.1
364	S	30.4	Very low	31.5	Very low	115 Å²	115	147.2 Å²	147.2	80%	0.804	75%	0.752	S	S	*	*				64.9	131.2	88.8	-43.4	0	0	0	0	111.9
365	A	32.8	Very low	31.3	Very low	81 Å²	81	144.4 Å²	144.4	67%	0.669	74%	0.742	S	S	*	*			cis	-158.5	-175.5	19.3	0	0	0	0	0	113
366	T	30.4	Very low	31.3	Very low	128 Å²	128	142 Å²	142	79%	0.785	74%	0.735	S	S	*	*			trans	6	134.4	138.4	57.9	0	0	0	0	116.5
367	S	31.8	Very low	31.1	Very low	88 Å²	88	142.7 Å²	142.7	62%	0.615	74%	0.735	S	S	*	*			cis	179.3	-162.8	25.4	45.3	0	0	0	0	109.3
368	N	31.8	Very low	31.5	Very low	149 Å²	149	144.5 Å²	144.5	80%	0.797	74%	0.743	S	S	*	*			trans	40	130.9	139.2	-59.7	-11	0	0	0	119.7
369	S	35	Very low	31.8	Very low	114 Å²	114	142.7 Å²	142.7	80%	0.797	74%	0.743	S	S	*	*			cis	-169.5	168.8	7	49	0	0	0	0	112.5
370	M	29.9	Very low	32.2	Very low	171 Å²	171	138.9 Å²	138.9	84%	0.842	74%	0.737	S	S	*	*			trans	-59.7	170.9	158.9	-65.8	-81.1	174.4	0	0	111.8
371	P	40.1	Very low	32.4	Very low	94 Å²	94	137.6 Å²	137.6	61%	0.61	73%	0.726	S	S	*	*				-138.5	-137.2	-59.1	41.8	-22.8	0	0	0	109.5
372	F	28.1	Very low	32.8	Very low	177 Å²	177	138.7 Å²	138.7	78%	0.776	72%	0.721	S	S	*	*			trans	76.2	132.8	156.7	-84.5	-54.1	0	0	0	121.2
373	R	28.8	Very low	32.9	Very low	203 Å²	203	140.2 Å²	140.2	77%	0.766	72%	0.72	S	S	*	*			trans	70.8	154.2	152.3	-63.1	172.4	-177.2	-152.7	2.8	115.8
374	R	28.3	Very low	33	Very low	192 Å²	192	135.2 Å²	135.2	73%	0.725	71%	0.714	S	S	*	*			cis	-164.3	158.8	-13.6	-115.2	175.8	173	-150.3	0.9	109.3
375	L	30	Very low	33.2	Very low	126 Å²	126	137.6 Å²	137.6	66%	0.66	72%	0.717	S	S	*	*			trans	54.7	124.2	151	-87.9	80.5	0	0	0	120.9
376	N	29.5	Very low	33.2	Very low	114 Å²	114	137.2 Å²	137.2	61%	0.61	72%	0.721	S	S	*	*				78.7	120.4	124.5	-69.9	45.9	0	0	0	123.6
377	D	31.7	Very low	33.1	Very low	132 Å²	132	136.9 Å²	136.9	71%	0.706	72%	0.723	S	S	*	*				73.8	162.4	121.9	-50.9	-13.4	0	0	0	122.3
378	T	36.9	Very low	33.1	Very low	122 Å²	122	138.1 Å²	138.1	75%	0.748	73%	0.731	S	S	*	*			trans	71.5	97.8	-179.5	-4.4	0	0	0	0	113.5
379	E	34.8	Very low	33.5	Very low	172 Å²	172	136 Å²	136	80%	0.804	73%	0.726	S	S	*	*				77.9	160.2	50.7	-152.2	-165.2	125.7	0	0	113.4
380	L	39	Very low	33.3	Very low	122 Å²	122	135.4 Å²	135.4	64%	0.639	72%	0.721	S	S	*	*			trans	84.2	133.2	-179.8	-47.4	171.5	0	0	0	114.3
381	Q	37	Very low	33.5	Very low	127 Å²	127	137.4 Å²	137.4	59%	0.593	73%	0.725	S	S	*	*			cis	-161.8	176.9	-16.6	-122.5	174.6	23.2	0	0	106
382	K	39	Very low	33.2	Very low	145 Å²	145	140.5 Å²	140.5	63%	0.63	74%	0.736	S	S	*	*			cis	-165.7	131.4	26.2	-146.1	152.9	-177.2	139.2	0	112.3
383	Q	36.2	Very low	33.6	Very low	155 Å²	155	138.1 Å²	138.1	72%	0.724	74%	0.738	S	S	*	*			trans	59.4	159.2	137.2	-68.7	175.2	-13.1	0	0	122.8
384	V	32.7	Very low	33.8	Very low	113 Å²	113	133.3 Å²	133.3	69%	0.685	74%	0.736	S	S	*	*			cis	173.9	158.6	-40.7	132.8	0	0	0	0	109.8
385	N	33.9	Very low	34.2	Very low	165 Å²	165	134.5 Å²	134.5	88%	0.882	74%	0.742	S	S	*	*			trans	73.6	153.9	175.1	-60.7	-29.9	0	0	0	117.5
386	G	32.9	Very low	34.4	Very low	72 Å²	72	133.1 Å²	133.1	74%	0.742	74%	0.742	S	S	*	*			cis	171.1	131.4	-10	0	0	0	0	0	115.9
387	C	28	Very low	34.6	Very low	122 Å²	122	130.9 Å²	130.9	82%	0.824	75%	0.746	S	S	*	*			trans	15.7	115.5	158.5	-60.5	0	0	0	0	124.4
388	S	31	Very low	34.8	Very low	114 Å²	114	132 Å²	132	80%	0.797	76%	0.758	S	S	*	*				58.8	-177.8	127.1	78.7	0	0	0	0	120.2
389	P	40	Very low	34.4	Very low	104 Å²	104	131.3 Å²	131.3	68%	0.675	76%	0.758	S	S	*	*			cis	-133.9	169.2	-13.3	41.2	-24.6	0	0	0	117.2
390	S	30.7	Very low	34.3	Very low	101 Å²	101	131.5 Å²	131.5	71%	0.706	76%	0.763	S	S	*	*			trans	46	125.5	145.7	66.5	0	0	0	0	124
391	K	34.6	Very low	34	Very low	213 Å²	213	130.5 Å²	130.5	93%	0.926	77%	0.766	S	S	*	*				-173.3	164.2	111.8	-102.3	167.5	-177.9	175.9	0	114.8
392	L	33.3	Very low	33.6	Very low	160 Å²	160	130.8 Å²	130.8	84%	0.838	78%	0.776	S	S	*	*			trans	-86.7	170.6	-179.1	-92.1	166.3	0	0	0	111.7
393	P	36.9	Very low	33.4	Very low	126 Å²	126	127.7 Å²	127.7	82%	0.818	79%	0.785	S	S	*	*			cis	-149.4	-164	47.8	43.3	-20.4	0	0	0	118.4
394	S	33	Very low	33.1	Very low	102 Å²	102	126.2 Å²	126.2	71%	0.713	79%	0.787	S	S	*	*			trans	-111.7	165.4	-166.4	53.3	0	0	0	0	114.9
395	Y	36.5	Very low	33.1	Very low	218 Å²	218	126.1 Å²	126.1	86%	0.855	79%	0.791	S	S	*	*				-164.1	172.2	126.3	-142.3	-118.4	0	0	0	114.2
396	S	35.9	Very low	33	Very low	96 Å²	96	125.2 Å²	125.2	67%	0.671	79%	0.786	S	S	*	*			trans	-14.6	153.7	174.2	60.5	0	0	0	0	121.3
397	G	32.5	Very low	33.1	Very low	67 Å²	67	128.3 Å²	128.3	69%	0.691	79%	0.791	S	S	*	*			cis	117.6	117.2	-0.2	0	0	0	0	0	114.9
398	T	35.6	Very low	33.3	Very low	155 Å²	155	128 Å²	128	95%	0.951	79%	0.787	S	S	*	*			trans	-162.4	142.7	158.9	2.6	0	0	0	0	110.2
399	S	28.8	Very low	33.4	Very low	108 Å²	108	130.9 Å²	130.9	76%	0.755	79%	0.792	S	S	*	*			trans	-118	156.3	173.4	52.7	0	0	0	0	110
400	I	32.9	Very low	33.1	Very low	177 Å²	177	130.5 Å²	130.5	91%	0.908	79%	0.792	S	S	*	*			trans	-157.3	151.5	155.1	-104.8	148.8	0	0	0	108.7
401	S	32.6	Very low	33.2	Very low	101 Å²	101	133.8 Å²	133.8	71%	0.706	80%	0.801	S	S	*	*			trans	-108.2	157.1	-163.5	47.6	0	0	0	0	114.4
402	V	29.2	Very low	33.1	Very low	133 Å²	133	130.8 Å²	130.8	81%	0.806	80%	0.8	S	S	*	*			trans	28.6	110.5	143.3	-174.6	0	0	0	0	117.4	V404	V402-V404 HydrophobicContact CG1-CG2 4.31Å
403	G	33.3	Very low	33.2	Very low	79 Å²	79	126.9 Å²	126.9	81%	0.814	80%	0.799	S	S	*	*			trans	-133.6	92.2	163	0	0	0	0	0	111.3
404	V	29.8	Very low	33.1	Very low	124 Å²	124	132.1 Å²	132.1	75%	0.752	80%	0.802	S	S	*	*			trans	-80.3	125.2	176.2	176.4	0	0	0	0	109.8	V402	V402-V404 HydrophobicContact CG1-CG2 4.31Å
405	S	33.4	Very low	33.3	Very low	112 Å²	112	133.5 Å²	133.5	78%	0.783	81%	0.809	S	S	*	*			trans	-147.4	134.5	159.8	56.9	0	0	0	0	110.6
406	N	31.2	Very low	33.4	Very low	145 Å²	145	132.1 Å²	132.1	78%	0.775	81%	0.807	S	S	*	*			trans	-96.8	133.5	179.4	-63.8	-52	0	0	0	110
407	T	36.3	Very low	33.3	Very low	137 Å²	137	138.7 Å²	138.7	84%	0.84	82%	0.817	S	S	*	*			trans	-170.9	151.8	145.3	11.7	0	0	0	0	110.4
408	P	31.9	Very low	33.4	Very low	115 Å²	115	142.3 Å²	142.3	75%	0.747	82%	0.821	S	S	*	*	P	Polyproline II helix	trans	-92.2	135.9	-168.7	34.6	-33.1	0	0	0	113.4
409	I	32.6	Very low	33.3	Very low	175 Å²	175	142.1 Å²	142.1	90%	0.897	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-94.9	128.3	172.4	-63.6	178.7	0	0	0	109.8
410	S	34.3	Very low	33.5	Very low	96 Å²	96	145.5 Å²	145.5	67%	0.671	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-95.6	145.7	-178.2	-68.6	0	0	0	0	113.4	T412	S410-T412 PolarHBondContact O-N 2.95Å
411	L	32.7	Very low	33.4	Very low	171 Å²	171	142.7 Å²	142.7	90%	0.895	80%	0.799	S	S	*	*			trans	11.1	91.9	149	-62.2	170.8	0	0	0	118.9
412	T	32.5	Very low	33.4	Very low	149 Å²	149	146.5 Å²	146.5	91%	0.914	80%	0.798	S	S	*	*			trans	-152.4	126.6	140.6	36.7	0	0	0	0	110.7	S410	S410-T412 PolarHBondContact O-N 2.95Å
413	G	34.8	Very low	33.4	Very low	79 Å²	79	147.8 Å²	147.8	81%	0.814	80%	0.795	S	S	*	*			trans	176.9	42.7	-176.5	0	0	0	0	0	114.9
414	R	34.6	Very low	33.3	Very low	235 Å²	235	154.5 Å²	154.5	89%	0.887	80%	0.796	S	S	*	*			trans	-107.8	133.7	173.6	-77.7	-172.6	177	-174.1	-0.1	111
415	P	38	Very low	33.3	Very low	131 Å²	131	156.8 Å²	156.8	85%	0.851	80%	0.799	S	S	*	*			trans	-67.2	142.6	158.1	29.8	-32.3	0	0	0	110.1
416	K	38.5	Very low	33.3	Very low	190 Å²	190	159.3 Å²	159.3	83%	0.826	80%	0.803	S	S	*	*			trans	-102.6	137.1	171.4	-75.5	177.9	173.7	177.5	0	110
417	R	34.6	Very low	33	Very low	233 Å²	233	157.7 Å²	157.7	88%	0.879	80%	0.803	S	S	*	*			trans	172.1	143.9	147.5	-98.2	150.9	180	172.4	0.7	109.5
418	D	33.5	Very low	32.9	Very low	144 Å²	144	157.7 Å²	157.7	77%	0.77	81%	0.805	S	S	*	*			cis	-146.8	151.1	-31.5	-119.9	-21.7	0	0	0	110.4
419	M	33.6	Very low	32.9	Very low	150 Å²	150	155 Å²	155	74%	0.739	80%	0.799	S	S	*	*			trans	-79.2	134.1	-177.4	-70.6	-170.7	67.4	0	0	112.2	V421	M419-V421 HydrophobicContact CE-CG2 4.17Å
420	Y	33	Very low	32.9	Very low	179 Å²	179	152 Å²	152	70%	0.702	79%	0.793	S	S	*	*			trans	-136.4	82.1	151.9	-112.3	-85.9	0	0	0	112.5	R422	Y420-R422 HydrophobicContact CD1-CG 4.12Å; Y420-R422 HydrophobicContact CE1-CG 4.13Å; Y420-R422 PolarHBondContact OH-NH1 3.11Å; Y420-R422 PolarHBondContact OH-NH2 2.88Å
421	V	31.2	Very low	32.9	Very low	118 Å²	118	152.8 Å²	152.8	72%	0.715	80%	0.799	S	S	*	*			trans	-85.9	100.3	158.6	176.1	0	0	0	0	107.8	M419	M419-V421 HydrophobicContact CE-CG2 4.17Å
422	R	32.7	Very low	33	Very low	181 Å²	181	149.7 Å²	149.7	68%	0.683	79%	0.791	S	S	*	*			trans	-138.9	114.4	156.2	-64.3	-169.6	-173.3	161	6.1	107.7	Y420	Y420-R422 HydrophobicContact CD1-CG 4.12Å; Y420-R422 HydrophobicContact CE1-CG 4.13Å; Y420-R422 PolarHBondContact OH-NH1 3.11Å; Y420-R422 PolarHBondContact OH-NH2 2.88Å
423	Q	29.5	Very low	32.9	Very low	160 Å²	160	151 Å²	151	75%	0.748	79%	0.792	S	S	*	*				68.3	88.4	54.9	-166.6	-161.7	26.5	0	0	112.5
424	R	30	Very low	32.6	Very low	220 Å²	220	150.7 Å²	150.7	83%	0.83	79%	0.789	S	S	*	*			trans	-168.8	136.8	130	-98.3	148.5	-153	-127	2.3	110.6
425	Q	30.1	Very low	32.4	Very low	172 Å²	172	145.5 Å²	145.5	80%	0.804	79%	0.788	S	S	*	*			trans	25.5	132.6	133.4	-57.2	170.8	-1.9	0	0	116.7
426	L	32.8	Very low	32.1	Very low	166 Å²	166	142.9 Å²	142.9	87%	0.869	79%	0.785	S	S	*	*			cis	-143.5	161.2	48.2	-70.6	153.7	0	0	0	113.5
427	S	26	Very low	31.9	Very low	111 Å²	111	141.6 Å²	141.6	78%	0.776	79%	0.786	S	S	*	*			trans	-69	155.8	164.6	-48.3	0	0	0	0	111.1
428	P	34.8	Very low	31.9	Very low	136 Å²	136	139.5 Å²	139.5	88%	0.883	79%	0.789	S	S	*	*				-120.8	152.4	78.4	1.8	20.4	0	0	0	112.3
429	G	31.5	Very low	31.9	Very low	60 Å²	60	135.5 Å²	135.5	62%	0.619	78%	0.782	S	S	*	*				103.8	66.3	73.5	0	0	0	0	0	109
430	S	32.3	Very low	32	Very low	110 Å²	110	137.8 Å²	137.8	77%	0.769	79%	0.788	S	S	*	*				77.8	91.7	98.1	66.4	0	0	0	0	113.6
431	S	33.2	Very low	32.1	Very low	114 Å²	114	140 Å²	140	80%	0.797	80%	0.795	S	S	*	*	S	Bend	trans	-69.2	150.9	147.8	43.8	0	0	0	0	109.6
432	S	35.1	Very low	32.2	Very low	105 Å²	105	145.5 Å²	145.5	73%	0.734	80%	0.803	S	S	*	*	S	Bend	trans	80.8	128.7	-176.9	81.6	0	0	0	0	117.9
433	L	31.6	Very low	32.3	Very low	177 Å²	177	142.1 Å²	142.1	93%	0.927	81%	0.807	S	S	*	*			trans	68.8	102.4	159.2	-53	-178.6	0	0	0	121
434	G	28.6	Very low	32.7	Very low	73 Å²	73	141 Å²	141	75%	0.753	80%	0.801	S	S	*	*			trans	83.3	168	156.7	0	0	0	0	0	116.9
435	S	30.6	Very low	33.1	Very low	125 Å²	125	139.4 Å²	139.4	87%	0.874	80%	0.796	S	S	*	*			cis	-168.7	145.1	-18.9	-98	0	0	0	0	109.9
436	G	31.2	Very low	33.6	Very low	76 Å²	76	138 Å²	138	78%	0.784	79%	0.791	S	S	*	*			trans	81.9	131	176.4	0	0	0	0	0	114.1
437	L	33.4	Very low	33.8	Very low	163 Å²	163	136.8 Å²	136.8	85%	0.853	79%	0.785	S	S	*	*			cis	83.5	89.7	20.5	-161.5	114	0	0	0	116.3
438	M	35.4	Very low	34.4	Very low	190 Å²	190	136 Å²	136	94%	0.936	78%	0.78	S	S	*	*			trans	-153.4	130.6	154.7	-89.3	-57.7	163	0	0	112.8
439	G	33.7	Very low	34.7	Very low	60 Å²	60	134.8 Å²	134.8	62%	0.619	77%	0.774	S	S	*	*			trans	69.1	134.2	155	0	0	0	0	0	119.2
440	F	35.8	Very low	35	Very low	198 Å²	198	137.8 Å²	137.8	87%	0.868	78%	0.781	S	S	*	*			cis	-147.5	124.9	9	-77.8	-95.1	0	0	0	114.1
441	R	33.5	Very low	35.4	Very low	225 Å²	225	140.4 Å²	140.4	85%	0.849	79%	0.785	S	S	*	*			trans	26	122.5	143.8	-54.6	179.6	-177.7	-106	3.6	122
442	R	34.8	Very low	35.9	Very low	233 Å²	233	140.1 Å²	140.1	88%	0.879	78%	0.781	S	S	*	*				166	111.4	111.8	-87.8	172.9	-167.8	-133.7	2.8	109
443	S	35.3	Very low	36.3	Very low	111 Å²	111	141 Å²	141	78%	0.776	78%	0.784	S	S	*	*				73.2	128.3	94.4	-73.2	0	0	0	0	113.5
444	E	37.1	Very low	36.5	Very low	135 Å²	135	136.3 Å²	136.3	63%	0.631	78%	0.778	S	S	*	*			cis	-152	163.7	17.3	-69.2	-154.5	122.8	0	0	114.9
445	R	37.9	Very low	37	Very low	188 Å²	188	140 Å²	140	71%	0.709	78%	0.78	S	S	*	*			trans	48.3	144.5	141.7	-68.8	174.4	-137.2	-126.5	0.7	121.1
446	M	41.4	Very low	37.3	Very low	143 Å²	143	141.8 Å²	141.8	70%	0.704	77%	0.774	S	S	*	*			cis	-161.6	159.9	-9.5	-86.2	-130.7	-174.8	0	0	109.4
447	N	36.6	Very low	37.4	Very low	139 Å²	139	144.8 Å²	144.8	74%	0.743	77%	0.773	S	S	*	*			trans	37.4	143.3	144.2	-60.4	5.9	0	0	0	122.1
448	S	39.1	Very low	37.6	Very low	95 Å²	95	143.4 Å²	143.4	66%	0.664	77%	0.765	S	S	*	*			cis	-169.9	167.1	-3.7	-94.7	0	0	0	0	112.3
449	S	39.9	Very low	37.6	Very low	110 Å²	110	144.6 Å²	144.6	77%	0.769	76%	0.759	S	S	*	*			trans	74	128.1	149.6	40.1	0	0	0	0	123.7
450	T	38.8	Very low	37.7	Very low	124 Å²	124	149.4 Å²	149.4	76%	0.761	77%	0.765	S	S	*	*			trans	85.3	76.7	144.9	-44.4	0	0	0	0	121.7
451	L	40.3	Very low	37.5	Very low	165 Å²	165	145.3 Å²	145.3	86%	0.864	76%	0.761	S	S	*	*				61.6	157	116.3	-66.2	173.8	0	0	0	122.7
452	P	43	Very low	37.7	Very low	107 Å²	107	141.6 Å²	141.6	70%	0.695	76%	0.763	S	S	*	*			trans	-128.6	-151.9	-146	48.6	-31.9	0	0	0	111.9
453	P	44	Very low	37.8	Very low	125 Å²	125	133.5 Å²	133.5	81%	0.812	75%	0.752	S	S	*	*			cis	-133	169.1	-9	39.7	-21.8	0	0	0	117
454	G	35.6	Very low	37.9	Very low	77 Å²	77	138.9 Å²	138.9	79%	0.794	76%	0.756	S	S	*	*			trans	166.9	75.9	171.5	0	0	0	0	0	113.4
455	L	39.7	Very low	37.8	Very low	151 Å²	151	141.9 Å²	141.9	79%	0.791	76%	0.763	S	S	*	*			trans	-69.2	125.4	-166.7	-69.3	168.2	0	0	0	113.7
456	E	36.5	Very low	37.8	Very low	163 Å²	163	137.9 Å²	137.9	76%	0.762	76%	0.763	S	S	*	*				57.9	117.1	97.2	-63.1	-170.9	161.6	0	0	114.9
457	N	32.8	Very low	37.5	Very low	139 Å²	139	135.1 Å²	135.1	74%	0.743	76%	0.757	S	S	*	*			cis	76.5	117	0.5	-126.8	9.4	0	0	0	118.9
458	I	37.8	Very low	37.5	Very low	134 Å²	134	139.6 Å²	139.6	69%	0.687	76%	0.764	S	S	*	*			trans	63.6	113.9	150.3	-55.9	155.3	0	0	0	120.1
459	R	35.6	Very low	37.4	Very low	215 Å²	215	140.4 Å²	140.4	81%	0.811	77%	0.77	S	S	*	*			trans	-143.4	140.3	133.3	-72.5	-160.9	179.7	-152.8	-1.2	108.5
460	Q	36.7	Very low	37.2	Very low	160 Å²	160	141.5 Å²	141.5	75%	0.748	77%	0.772	S	S	*	*			cis	-152.4	147.3	2.5	-112.9	157.3	-24.4	0	0	109.7
461	S	31.8	Very low	37.4	Very low	113 Å²	113	140.5 Å²	140.5	79%	0.79	77%	0.767	S	S	*	*			trans	-147.9	133.8	164.5	65.8	0	0	0	0	112.4
462	T	38.2	Very low	37.2	Very low	146 Å²	146	139.5 Å²	139.5	90%	0.896	76%	0.763	S	S	*	*			trans	-158.7	133.8	177.1	50.4	0	0	0	0	108.8
463	G	36.4	Very low	37	Very low	63 Å²	63	140.7 Å²	140.7	65%	0.649	77%	0.768	S	S	*	*			cis	155	142	-10.7	0	0	0	0	0	112.7
464	R	37	Very low	37.1	Very low	224 Å²	224	140.5 Å²	140.5	85%	0.845	76%	0.764	S	S	*	*			trans	68.9	155.6	174.4	-48.5	176.2	-177.3	-176.2	-0.4	113.3
465	Y	35.3	Very low	37.5	Very low	199 Å²	199	140.3 Å²	140.3	78%	0.78	76%	0.763	S	S	*	*			cis	-130.6	153.3	10.9	-59.1	-102.3	0	0	0	108.2
466	S	36.9	Very low	38	Very low	103 Å²	103	140.9 Å²	140.9	72%	0.72	76%	0.759	S	S	*	*				62.9	137.9	54.1	-137.3	0	0	0	0	113.6
467	C	34.7	Very low	38.8	Very low	86 Å²	86	143.6 Å²	143.6	58%	0.581	76%	0.762	S	S	*	*			cis	-154.6	158.2	16.7	-19.9	0	0	0	0	113.7
468	R	37.7	Very low	39.9	Very low	232 Å²	232	139.5 Å²	139.5	88%	0.875	75%	0.753	S	S	*	*			trans	68.4	148.7	150	-59.1	158.4	-163.4	-87.8	0.7	116.9
469	S	36.7	Very low	40.5	Very low	113 Å²	113	138 Å²	138	79%	0.79	74%	0.744	S	S	*	*			cis	-132.8	154.2	11	-63.2	0	0	0	0	113.4
470	T	35.8	Very low	41.6	Very low	133 Å²	133	131.4 Å²	131.4	82%	0.816	73%	0.728	S	S	*	*			trans	-116.7	-166.1	173.7	56.5	0	0	0	0	108.7
471	P	42.9	Very low	42.5	Very low	102 Å²	102	130.2 Å²	130.2	66%	0.662	72%	0.723	S	S	*	*			cis	-138.8	178.3	-4.8	43	-25.6	0	0	0	116.8
472	N	35.3	Very low	43.6	Very low	144 Å²	144	130.4 Å²	130.4	77%	0.77	71%	0.714	S	S	*	*			trans	61.7	159.2	154.1	-86	-30.7	0	0	0	118.1
473	V	40.2	Very low	44.5	Very low	132 Å²	132	126.2 Å²	126.2	80%	0.8	69%	0.694	S	S	*	*			cis	-121.9	156.1	23.6	172	0	0	0	0	113.5
474	T	46.4	Very low	45.3	Very low	121 Å²	121	130 Å²	130	74%	0.742	70%	0.695	S	S	*	*			trans	-50.7	139.3	177.5	51	0	0	0	0	115.6
475	G	42.6	Very low	46.2	Very low	74 Å²	74	123.5 Å²	123.5	76%	0.763	68%	0.684	S	S	*	*			trans	178.5	11.2	168.9	0	0	0	0	0	120.5
476	K	50.2	Low	46.8	Very low	162 Å²	162	121 Å²	121	70%	0.704	68%	0.683	S	S	*	*			trans	-159.4	68.1	-175.5	-112.2	156.6	-172.8	172.7	0	115
477	R	55.1	Low	47.5	Very low	220 Å²	220	120.4 Å²	120.4	83%	0.83	68%	0.675	S	S	*	*	H	α-helix	trans	-81.4	-22.8	176.6	-73.9	-168.5	179	-165.5	0.7	115.4	T480	R477-T480 PolarHBondContact O-OG1 3.02Å
478	G	54.2	Low	47.8	Very low	53 Å²	53	123.5 Å²	123.5	55%	0.546	67%	0.674	S	S	.	*	H	α-helix	trans	-73.7	-40.3	-177.8	0	0	0	0	0	114.5
479	M	51.6	Low	47.8	Very low	102 Å²	102	118.1 Å²	118.1	50%	0.502	67%	0.67	S	S	.	*	H	α-helix	trans	-73	-28.2	179	-82.1	175.4	63	0	0	113.3	A483 L853	M479-A483 PolarHBondContact O-N 3.12Å; M479-A483 VanDerWaalsContact O-N 3.09Å; M479-L853 HydrophobicContact CE-CD2 3.68Å; M479-L853 HydrophobicContact SD-CD2 3.99Å
480	T	57.9	Low	48	Very low	78 Å²	78	122.9 Å²	122.9	48%	0.479	67%	0.67	S	S	.	*	H	α-helix	trans	-68.8	-41.7	179.2	47.9	0	0	0	0	111.4	R477 L482 A483 E484	R477-T480 PolarHBondContact O-OG1 3.02Å; T480-L482 VanDerWaalsContact C-N 3.35Å; T480-L482 PolarHBondContact O-N 2.95Å; T480-A483 WeakPolarHBondContact O-CB 3.43Å; T480-A483 PolarHBondContact O-N 2.73Å; T480-A483 VanDerWaalsContact O-N 3.14Å; T480-E484 VanDerWaalsContact O-CB 3.26Å; T480-E484 WeakPolarHBondContact O-CB 3.37Å; T480-E484 PolarHBondContact O-N 3.04Å
481	Q	56	Low	48.5	Very low	135 Å²	135	122.9 Å²	122.9	63%	0.631	67%	0.67	S	S	*	*	H	α-helix	trans	-64.2	-36.8	178.4	-72.3	-179.4	-36.5	0	0	112.8	E484 S485	Q481-E484 PolarHBondContact O-N 3.22Å; Q481-S485 PolarHBondContact O-N 2.98Å; Q481-S485 PolarHBondContact O-OG 2.84Å
482	L	55.4	Low	48.3	Very low	117 Å²	117	123.8 Å²	123.8	61%	0.613	67%	0.669	S	S	*	*	H	α-helix	trans	-70.4	-32.9	172.9	-80.6	170.1	0	0	0	113.3	T480 S485 L486	T480-L482 VanDerWaalsContact C-N 3.35Å; T480-L482 PolarHBondContact O-N 2.95Å; L482-S485 WeakPolarHBondContact CA-OG 3.32Å; L482-S485 PolarHBondContact O-OG 3.09Å; L482-L486 WeakPolarHBondContact O-CB 3.42Å; L482-L486 WeakPolarHBondContact O-CD1 3.45Å; L482-L486 VanDerWaalsContact O-CG 3.28Å; L482-L486 WeakPolarHBondContact O-CG 3.45Å; L482-L486 PolarHBondContact O-N 2.65Å
483	A	55.9	Low	48.8	Very low	58 Å²	58	128.6 Å²	128.6	48%	0.479	68%	0.676	S	S	.	*	H	α-helix	trans	-68.4	-39.2	172.2	0	0	0	0	0	111.2	M479 T480 L486 V487	M479-A483 PolarHBondContact O-N 3.12Å; M479-A483 VanDerWaalsContact O-N 3.09Å; T480-A483 WeakPolarHBondContact O-CB 3.43Å; T480-A483 PolarHBondContact O-N 2.73Å; T480-A483 VanDerWaalsContact O-N 3.14Å; A483-L486 CarbonylContact O-C 3.58Å; A483-L486 PolarHBondContact O-N 2.84Å; A483-V487 PolarHBondContact O-N 3.18Å; A483-V487 VanDerWaalsContact O-N 3.17Å
484	E	53.5	Low	49.3	Very low	143 Å²	143	128 Å²	128	67%	0.668	67%	0.673	S	S	*	*	H	α-helix	trans	-70.8	-38.1	-179.2	-160.5	154.7	-135.8	0	0	111.7	T480 Q481 L486 V487	T480-E484 VanDerWaalsContact O-CB 3.26Å; T480-E484 WeakPolarHBondContact O-CB 3.37Å; T480-E484 PolarHBondContact O-N 3.04Å; Q481-E484 PolarHBondContact O-N 3.22Å; E484-L486 VanDerWaalsContact C-N 3.28Å; E484-L486 PolarHBondContact O-N 2.77Å; E484-V487 PolarHBondContact O-N 2.98Å
485	S	55.5	Low	49.4	Very low	86 Å²	86	124.8 Å²	124.8	60%	0.601	66%	0.659	S	S	*	*	H	α-helix	trans	-70.9	-18.9	170.1	66.4	0	0	0	0	114.1	Q481 L482	Q481-S485 PolarHBondContact O-N 2.98Å; Q481-S485 PolarHBondContact O-OG 2.84Å; L482-S485 WeakPolarHBondContact CA-OG 3.32Å; L482-S485 PolarHBondContact O-OG 3.09Å
486	L	49.3	Very low	49.9	Very low	148 Å²	148	124 Å²	124	78%	0.775	64%	0.642	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.2	-5.3	172.9	-74.9	170.5	0	0	0	113.1	L482 A483 E484 R488	L482-L486 WeakPolarHBondContact O-CB 3.42Å; L482-L486 WeakPolarHBondContact O-CD1 3.45Å; L482-L486 VanDerWaalsContact O-CG 3.28Å; L482-L486 WeakPolarHBondContact O-CG 3.45Å; L482-L486 PolarHBondContact O-N 2.65Å; A483-L486 CarbonylContact O-C 3.58Å; A483-L486 PolarHBondContact O-N 2.84Å; E484-L486 VanDerWaalsContact C-N 3.28Å; E484-L486 PolarHBondContact O-N 2.77Å; L486-R488 VanDerWaalsContact C-N 3.31Å; L486-R488 PolarHBondContact O-N 3.14Å
487	V	50.6	Low	50.1	Low	90 Å²	90	121.3 Å²	121.3	55%	0.545	64%	0.641	S	S	.	*			trans	-75.1	88.8	163.5	179	0	0	0	0	108	A483 E484	A483-V487 PolarHBondContact O-N 3.18Å; A483-V487 VanDerWaalsContact O-N 3.17Å; E484-V487 PolarHBondContact O-N 2.98Å
488	R	41	Very low	50.7	Low	151 Å²	151	114.7 Å²	114.7	57%	0.57	63%	0.626	S	S	*	*			trans	-47.2	131.4	152.8	-80.1	-166.8	179.4	-171.3	6.4	107.2	L486 R490 I899 D900	L486-R488 VanDerWaalsContact C-N 3.31Å; L486-R488 PolarHBondContact O-N 3.14Å; R488-R490 PolarHBondContact O-N 3.01Å; R488-I899 PolarHBondContact NH2-O 2.98Å; R488-D900 IonicContact CZ-OD1 3.83Å; R488-D900 IonicContact CZ-OD2 3.26Å; R488-D900 VanDerWaalsContact CZ-OD2 3.26Å; R488-D900 IonicContact NH1-OD1 3.76Å; R488-D900 IonicContact NH1-OD2 2.7Å; R488-D900 PolarHBondContact NH1-OD2 2.86Å; R488-D900 IonicContact NH2-OD1 2.98Å; R488-D900 PolarHBondContact NH2-OD1 3.33Å; R488-D900 IonicContact NH2-OD2 2.91Å; R488-D900 PolarHBondContact NH2-OD2 3.14Å
489	P	38.4	Very low	51.5	Low	119 Å²	119	114.3 Å²	114.3	77%	0.773	62%	0.615	S	S	*	*			trans	-50.9	109.3	-178.1	-30	35.8	0	0	0	111	V491	P489-V491 PolarHBondContact O-N 3.4Å
490	R	39.8	Very low	52.3	Low	212 Å²	212	110.9 Å²	110.9	80%	0.8	60%	0.603	S	S	*	*			trans	-73	89.6	167.4	-76.4	-175.9	176.6	155.7	2.4	106.1	R488 D492	R488-R490 PolarHBondContact O-N 3.01Å; R490-D492 PolarHBondContact O-N 2.64Å; R490-D492 VanDerWaalsContact O-N 3.14Å
491	V	47.2	Very low	53.3	Low	133 Å²	133	111.3 Å²	111.3	81%	0.806	61%	0.605	S	S	*	*			trans	-40.9	122.7	165.4	179.8	0	0	0	0	107.2	P489 R493	P489-V491 PolarHBondContact O-N 3.4Å; V491-R493 PolarHBondContact O-N 3.17Å
492	D	38.9	Very low	54.4	Low	121 Å²	121	110.3 Å²	110.3	65%	0.647	60%	0.604	S	S	*	*			trans	-54.7	129.9	-157.2	-85	-68.4	0	0	0	112.3	R490 T494 A495	R490-D492 PolarHBondContact O-N 2.64Å; R490-D492 VanDerWaalsContact O-N 3.14Å; D492-T494 WeakPolarHBondContact CB-OG1 3.33Å; D492-T494 PolarHBondContact O-N 3.35Å; D492-A495 PolarHBondContact O-N 3.07Å
493	R	45.7	Very low	55.4	Low	245 Å²	245	112.4 Å²	112.4	93%	0.925	61%	0.605	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.6	11.7	177.3	-93.2	-176	169.5	-170.6	-4	113.5	V491 A495	V491-R493 PolarHBondContact O-N 3.17Å; R493-A495 VanDerWaalsContact C-N 3.33Å
494	T	50.1	Low	56.4	Low	120 Å²	120	117.6 Å²	117.6	74%	0.736	61%	0.612	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92	12.6	165.5	56.7	0	0	0	0	112.7	D492 S496	D492-T494 WeakPolarHBondContact CB-OG1 3.33Å; D492-T494 PolarHBondContact O-N 3.35Å; T494-S496 PolarHBondContact O-N 2.87Å
495	A	47.8	Very low	57.6	Low	53 Å²	53	112.9 Å²	112.9	44%	0.438	60%	0.595	S	S	.	*			trans	-50	102.8	159	0	0	0	0	0	109.8	D492 R493 S499	D492-A495 PolarHBondContact O-N 3.07Å; R493-A495 VanDerWaalsContact C-N 3.33Å; A495-S499 VanDerWaalsContact C-OG 3.24Å; A495-S499 WeakPolarHBondContact CA-OG 3.41Å
496	S	52.9	Low	58.6	Low	58 Å²	58	113.7 Å²	113.7	41%	0.406	59%	0.589	S	S	.	*			trans	-47.3	150	177.3	69.3	0	0	0	0	111.8	T494 P498 S499 A500	T494-S496 PolarHBondContact O-N 2.87Å; S496-P498 VanDerWaalsContact C-CD 3.48Å; S496-P498 VanDerWaalsContact C-N 3.33Å; S496-P498 VanDerWaalsContact O-N 3.14Å; S496-S499 PolarHBondContact N-OG 2.72Å; S496-S499 CarbonylContact O-C 3.59Å; S496-S499 WeakPolarHBondContact O-CA 3.36Å; S496-S499 PolarHBondContact O-N 3.31Å; S496-S499 PolarHBondContact O-OG 3.19Å; S496-S499 PolarHBondContact OG-OG 3.2Å; S496-A500 PolarHBondContact O-N 2.92Å
497	P	56.1	Low	59.9	Low	106 Å²	106	108.6 Å²	108.6	69%	0.688	57%	0.568	S	S	*	*	H	α-helix	trans	-45.9	-44.5	-179.4	10.7	-24.2	0	0	0	115.2	A500 T501	P497-A500 PolarHBondContact O-N 3.49Å; P497-T501 PolarHBondContact O-N 3.24Å; P497-T501 PolarHBondContact O-OG1 3.19Å; P497-T501 VanDerWaalsContact O-OG1 3.13Å
498	P	67.4	Low	61.1	Low	81 Å²	81	112.4 Å²	112.4	53%	0.526	57%	0.573	S	S	.	*	H	α-helix	trans	-65.5	-40.7	174.3	24.8	-33.8	0	0	0	113.3	S496 A500 T501 L502	S496-P498 VanDerWaalsContact C-CD 3.48Å; S496-P498 VanDerWaalsContact C-N 3.33Å; S496-P498 VanDerWaalsContact O-N 3.14Å; P498-A500 PolarHBondContact O-N 3.19Å; P498-T501 WeakPolarHBondContact O-CB 3.18Å; P498-T501 PolarHBondContact O-N 3.03Å; P498-L502 WeakPolarHBondContact O-CG 3.35Å; P498-L502 PolarHBondContact O-N 3.07Å
499	S	69.8	Low	62.8	Low	45 Å²	45	112.1 Å²	112.1	32%	0.315	57%	0.572	S	S	.	*	H	α-helix	trans	-67.6	-32.5	176.3	57.2	0	0	0	0	113.4	A495 S496 L502 Y503	A495-S499 VanDerWaalsContact C-OG 3.24Å; A495-S499 WeakPolarHBondContact CA-OG 3.41Å; S496-S499 PolarHBondContact N-OG 2.72Å; S496-S499 CarbonylContact O-C 3.59Å; S496-S499 WeakPolarHBondContact O-CA 3.36Å; S496-S499 PolarHBondContact O-N 3.31Å; S496-S499 PolarHBondContact O-OG 3.19Å; S496-S499 PolarHBondContact OG-OG 3.2Å; S499-L502 PolarHBondContact O-N 2.95Å; S499-Y503 WeakPolarHBondContact O-CB 3.24Å; S499-Y503 PolarHBondContact O-N 3.07Å
500	A	70.1	Confident	64.7	Low	29 Å²	29	108.6 Å²	108.6	24%	0.24	55%	0.546	C	S	.	.	H	α-helix	trans	-65.5	-45	169.9	0	0	0	0	0	110.7	S496 P497 P498 L502 Y503 W504	S496-A500 PolarHBondContact O-N 2.92Å; P497-A500 PolarHBondContact O-N 3.49Å; P498-A500 PolarHBondContact O-N 3.19Å; A500-L502 VanDerWaalsContact C-N 3.33Å; A500-L502 PolarHBondContact O-N 3.47Å; A500-Y503 PolarHBondContact O-N 3.16Å; A500-W504 PolarHBondContact O-N 3.33Å
501	T	77.3	Confident	66.4	Low	87 Å²	87	102.5 Å²	102.5	53%	0.534	54%	0.541	S	S	.	.	H	α-helix	trans	-60.3	-40	174.2	-64.1	0	0	0	0	112.2	P497 P498 W504 S505	P497-T501 PolarHBondContact O-N 3.24Å; P497-T501 PolarHBondContact O-OG1 3.19Å; P497-T501 VanDerWaalsContact O-OG1 3.13Å; P498-T501 WeakPolarHBondContact O-CB 3.18Å; P498-T501 PolarHBondContact O-N 3.03Å; T501-W504 PolarHBondContact O-N 2.89Å; T501-S505 WeakPolarHBondContact O-CB 3.37Å; T501-S505 PolarHBondContact O-N 3.38Å
502	L	79.5	Confident	67.7	Low	114 Å²	114	99.4 Å²	99.4	60%	0.597	53%	0.525	S	S	*	.	H	α-helix	trans	-61.4	-50.7	173.5	-73.9	172.8	0	0	0	111.1	P498 S499 A500 W504 S505 E506	P498-L502 WeakPolarHBondContact O-CG 3.35Å; P498-L502 PolarHBondContact O-N 3.07Å; S499-L502 PolarHBondContact O-N 2.95Å; A500-L502 VanDerWaalsContact C-N 3.33Å; A500-L502 PolarHBondContact O-N 3.47Å; L502-W504 PolarHBondContact O-N 3.36Å; L502-S505 CarbonylContact O-C 3.48Å; L502-S505 WeakPolarHBondContact O-CA 3.42Å; L502-S505 WeakPolarHBondContact O-CB 3.36Å; L502-S505 PolarHBondContact O-N 2.65Å; L502-S505 PolarHBondContact O-OG 2.77Å; L502-E506 WeakPolarHBondContact O-CB 3.22Å; L502-E506 PolarHBondContact O-N 3.24Å
503	Y	76.8	Confident	69.3	Low	161 Å²	161	95.4 Å²	95.4	63%	0.631	50%	0.502	S	S	*	.	H	α-helix	trans	-57.5	-43.8	175.7	-177.5	-95.5	0	0	0	112.5	S499 A500 S505 E506 A507	S499-Y503 WeakPolarHBondContact O-CB 3.24Å; S499-Y503 PolarHBondContact O-N 3.07Å; A500-Y503 PolarHBondContact O-N 3.16Å; Y503-S505 VanDerWaalsContact C-N 3.29Å; Y503-S505 PolarHBondContact O-N 2.91Å; Y503-E506 PolarHBondContact O-N 2.89Å; Y503-A507 VanDerWaalsContact O-CB 3.31Å; Y503-A507 WeakPolarHBondContact O-CB 3.18Å; Y503-A507 PolarHBondContact O-N 3.02Å
504	W	76.9	Confident	70.5	Confident	168 Å²	168	89.8 Å²	89.8	64%	0.636	50%	0.498	S	S	*	.	H	α-helix	trans	-70	-21.2	174.1	-69.1	119.3	0	0	0	113.7	A500 T501 L502 R508	A500-W504 PolarHBondContact O-N 3.33Å; T501-W504 PolarHBondContact O-N 2.89Å; L502-W504 PolarHBondContact O-N 3.36Å; W504-R508 WeakPolarHBondContact O-CG 3.32Å; W504-R508 PolarHBondContact O-N 2.72Å; W504-R508 PolarHBondContact O-NE 3Å
505	S	78.3	Confident	71.5	Confident	43 Å²	43	90.8 Å²	90.8	30%	0.301	50%	0.498	S	S	.	.	H	α-helix	trans	-80.4	-37.7	172	81.2	0	0	0	0	111.6	T501 L502 Y503 R508 R509	T501-S505 WeakPolarHBondContact O-CB 3.37Å; T501-S505 PolarHBondContact O-N 3.38Å; L502-S505 CarbonylContact O-C 3.48Å; L502-S505 WeakPolarHBondContact O-CA 3.42Å; L502-S505 WeakPolarHBondContact O-CB 3.36Å; L502-S505 PolarHBondContact O-N 2.65Å; L502-S505 PolarHBondContact O-OG 2.77Å; Y503-S505 VanDerWaalsContact C-N 3.29Å; Y503-S505 PolarHBondContact O-N 2.91Å; S505-R508 PolarHBondContact O-N 3.44Å; S505-R509 WeakPolarHBondContact O-CB 3.39Å; S505-R509 PolarHBondContact O-N 2.97Å
506	E	77.3	Confident	72.6	Confident	104 Å²	104	91.1 Å²	91.1	49%	0.486	50%	0.501	S	S	.	.	H	α-helix	trans	-71.1	-45.4	177.4	-176.2	159.7	-137	0	0	110.7	L502 Y503 R508 R509 L510	L502-E506 WeakPolarHBondContact O-CB 3.22Å; L502-E506 PolarHBondContact O-N 3.24Å; Y503-E506 PolarHBondContact O-N 2.89Å; E506-R508 VanDerWaalsContact C-N 3.26Å; E506-R508 PolarHBondContact O-N 3.12Å; E506-R509 CarbonylContact O-C 3.53Å; E506-R509 WeakPolarHBondContact O-CA 3.37Å; E506-R509 WeakPolarHBondContact O-CB 3.34Å; E506-R509 PolarHBondContact O-N 3.2Å; E506-L510 HydrophobicContact CG-CD1 4.15Å; E506-L510 HydrophobicContact CG-CG 4.33Å; E506-L510 WeakPolarHBondContact O-CG 3.42Å; E506-L510 PolarHBondContact O-N 2.88Å
507	A	77	Confident	73.4	Confident	40 Å²	40	97.9 Å²	97.9	33%	0.331	52%	0.518	S	S	.	.	H	α-helix	trans	-56.2	-39.3	171.3	0	0	0	0	0	112.3	Y503 A511	Y503-A507 VanDerWaalsContact O-CB 3.31Å; Y503-A507 WeakPolarHBondContact O-CB 3.18Å; Y503-A507 PolarHBondContact O-N 3.02Å; A507-A511 WeakPolarHBondContact O-CB 3.47Å; A507-A511 PolarHBondContact O-N 2.82Å
508	R	75.7	Confident	74.1	Confident	171 Å²	171	97.3 Å²	97.3	65%	0.645	51%	0.508	S	S	*	.	H	α-helix	trans	-68.1	-37.6	172.7	-82	179.8	-71.4	161.6	-1.5	113	W504 S505 E506	W504-R508 WeakPolarHBondContact O-CG 3.32Å; W504-R508 PolarHBondContact O-N 2.72Å; W504-R508 PolarHBondContact O-NE 3Å; S505-R508 PolarHBondContact O-N 3.44Å; E506-R508 VanDerWaalsContact C-N 3.26Å; E506-R508 PolarHBondContact O-N 3.12Å
509	R	75.3	Confident	74	Confident	144 Å²	144	97.3 Å²	97.3	54%	0.543	51%	0.509	S	S	.	.	H	α-helix	trans	-67.5	-39.7	175.1	175.9	-179.2	-79.1	155.4	-7.3	111.9	S505 E506 S512 F513	S505-R509 WeakPolarHBondContact O-CB 3.39Å; S505-R509 PolarHBondContact O-N 2.97Å; E506-R509 CarbonylContact O-C 3.53Å; E506-R509 WeakPolarHBondContact O-CA 3.37Å; E506-R509 WeakPolarHBondContact O-CB 3.34Å; E506-R509 PolarHBondContact O-N 3.2Å; R509-S512 PolarHBondContact O-N 2.98Å; R509-S512 PolarHBondContact O-OG 3.09Å; R509-F513 WeakPolarHBondContact O-CD2 3.23Å; R509-F513 WeakPolarHBondContact O-CE2 3.5Å
510	L	78.2	Confident	74.1	Confident	46 Å²	46	101.4 Å²	101.4	24%	0.241	53%	0.527	C	S	.	.	H	α-helix	trans	-73.3	-36.8	178	-65.5	179.2	0	0	0	111.6	E506 S512 F513 L518	E506-L510 HydrophobicContact CG-CD1 4.15Å; E506-L510 HydrophobicContact CG-CG 4.33Å; E506-L510 WeakPolarHBondContact O-CG 3.42Å; E506-L510 PolarHBondContact O-N 2.88Å; L510-S512 PolarHBondContact O-N 3.14Å; L510-S512 VanDerWaalsContact O-N 3.12Å; L510-F513 PolarHBondContact O-N 3.34Å; L510-L518 HydrophobicContact CD2-CD1 3.58Å
511	A	76.3	Confident	74.1	Confident	83 Å²	83	105.8 Å²	105.8	69%	0.686	56%	0.556	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.6	-9.9	173.8	0	0	0	0	0	114.4	A507 F513	A507-A511 WeakPolarHBondContact O-CB 3.47Å; A507-A511 PolarHBondContact O-N 2.82Å; A511-F513 VanDerWaalsContact C-N 3.25Å
512	S	74.9	Confident	73.9	Confident	69 Å²	69	109 Å²	109	48%	0.483	57%	0.57	S	S	.	*	T	Hydrogen-bonded Turn	trans	-78.7	-5.7	169.1	81.4	0	0	0	0	113.7	R299 R509 L510	R299-S512 PolarHBondContact NH2-OG 3.25Å; R509-S512 PolarHBondContact O-N 2.98Å; R509-S512 PolarHBondContact O-OG 3.09Å; L510-S512 PolarHBondContact O-N 3.14Å; L510-S512 VanDerWaalsContact O-N 3.12Å
513	F	71.6	Confident	73.4	Confident	37 Å²	37	106.2 Å²	106.2	16%	0.162	56%	0.56	C	S	.	*	S	Bend	trans	-119	135.5	-179	-58.3	-76.6	0	0	0	110.5	R299 R509 L510 A511 N515 A516 R517 L518 P519	R299-F513 VanDerWaalsContact NH1-CZ 3.34Å; R509-F513 WeakPolarHBondContact O-CD2 3.23Å; R509-F513 WeakPolarHBondContact O-CE2 3.5Å; L510-F513 PolarHBondContact O-N 3.34Å; A511-F513 VanDerWaalsContact C-N 3.25Å; F513-N515 PolarHBondContact O-N 3.32Å; F513-N515 VanDerWaalsContact O-N 3.13Å; F513-A516 PolarHBondContact O-N 3.36Å; F513-A516 VanDerWaalsContact O-N 3.07Å; F513-R517 VanDerWaalsContact CB-O 3.26Å; F513-R517 WeakPolarHBondContact CB-O 3.47Å; F513-R517 WeakPolarHBondContact CG-O 3.48Å; F513-L518 HydrophobicContact CE2-CG 3.92Å; F513-L518 HydrophobicContact CZ-CG 4.31Å; F513-P519 HydrophobicContact CE1-CG 4.09Å
514	P	71.6	Confident	72.8	Confident	127 Å²	127	106 Å²	106	83%	0.825	57%	0.569	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.9	-24.8	-171.3	24.5	-34.6	0	0	0	114.2
515	N	71	Confident	72.1	Confident	140 Å²	140	103.4 Å²	103.4	75%	0.749	57%	0.574	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.9	12.6	179.7	-64.9	-14.6	0	0	0	113.3	F513 R517	F513-N515 PolarHBondContact O-N 3.32Å; F513-N515 VanDerWaalsContact O-N 3.13Å; N515-R517 PolarHBondContact O-N 2.85Å
516	A	70.8	Confident	71.2	Confident	61 Å²	61	105.5 Å²	105.5	50%	0.504	59%	0.593	S	S	.	*	S	Bend	trans	52.3	22.2	-177.7	0	0	0	0	0	115.9	F513	F513-A516 PolarHBondContact O-N 3.36Å; F513-A516 VanDerWaalsContact O-N 3.07Å
517	R	70.2	Confident	70.4	Confident	200 Å²	200	108.1 Å²	108.1	76%	0.755	61%	0.609	S	S	*	*	S	Bend	trans	-125.1	152.5	171.8	-67.3	-175.2	-179.7	-178.4	1.3	108.9	F513 N515	F513-R517 VanDerWaalsContact CB-O 3.26Å; F513-R517 WeakPolarHBondContact CB-O 3.47Å; F513-R517 WeakPolarHBondContact CG-O 3.48Å; N515-R517 PolarHBondContact O-N 2.85Å
518	L	71.1	Confident	69.4	Low	93 Å²	93	111.5 Å²	111.5	49%	0.487	62%	0.622	S	S	.	*	P	Polyproline II helix	trans	-67.6	146.2	164.9	-68.6	88.6	0	0	0	108.8	L510 F513 D520	L510-L518 HydrophobicContact CD2-CD1 3.58Å; F513-L518 HydrophobicContact CE2-CG 3.92Å; F513-L518 HydrophobicContact CZ-CG 4.31Å; L518-D520 PolarHBondContact O-N 3.37Å
519	P	65.4	Low	68.6	Low	82 Å²	82	113.3 Å²	113.3	53%	0.532	63%	0.629	S	S	.	*	P	Polyproline II helix	trans	-66.6	124.3	169.2	26.8	-32.4	0	0	0	110.1	F513 S523	F513-P519 HydrophobicContact CE1-CG 4.09Å; P519-S523 WeakPolarHBondContact CA-OG 3.48Å; P519-S523 WeakPolarHBondContact CB-OG 3.43Å
520	D	70	Confident	67.8	Low	130 Å²	130	115.4 Å²	115.4	70%	0.695	64%	0.638	S	S	*	*	P	Polyproline II helix	trans	-64.2	155.1	168.4	-64.5	-48.9	0	0	0	110.2	L518 N522 S523	L518-D520 PolarHBondContact O-N 3.37Å; D520-N522 PolarHBondContact O-N 3.48Å; D520-S523 PolarHBondContact N-OG 2.94Å; D520-S523 WeakPolarHBondContact O-CB 3.26Å; D520-S523 PolarHBondContact O-N 2.85Å; D520-S523 PolarHBondContact O-OG 3.36Å
521	S	71.4	Confident	67	Low	122 Å²	122	119.7 Å²	119.7	85%	0.853	66%	0.661	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.7	-17.2	-176.7	61.5	0	0	0	0	115.2
522	N	72.2	Confident	65.9	Low	155 Å²	155	124.8 Å²	124.8	83%	0.829	67%	0.668	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.6	-2.3	177.7	-64.4	4.2	0	0	0	112.9	D520	D520-N522 PolarHBondContact O-N 3.48Å
523	S	69	Low	65.3	Low	54 Å²	54	126.8 Å²	126.8	38%	0.378	68%	0.679	S	S	.	*	S	Bend	trans	-77.8	138.7	175.6	67.3	0	0	0	0	110.2	P519 D520	P519-S523 WeakPolarHBondContact CA-OG 3.48Å; P519-S523 WeakPolarHBondContact CB-OG 3.43Å; D520-S523 PolarHBondContact N-OG 2.94Å; D520-S523 WeakPolarHBondContact O-CB 3.26Å; D520-S523 PolarHBondContact O-N 2.85Å; D520-S523 PolarHBondContact O-OG 3.36Å
524	L	65	Low	65	Low	158 Å²	158	129.2 Å²	129.2	83%	0.827	71%	0.706	S	S	*	*	P	Polyproline II helix	trans	-61	138.9	178.8	-66.4	173.8	0	0	0	109.8	A526	L524-A526 PolarHBondContact O-N 2.69Å
525	P	61.5	Low	65	Low	113 Å²	113	128.8 Å²	128.8	73%	0.734	70%	0.703	S	S	*	*	P	Polyproline II helix	trans	-56.9	137.1	172.6	25.9	-33.9	0	0	0	109.1	I527	P525-I527 PolarHBondContact O-N 2.79Å
526	A	59.2	Low	65.1	Low	87 Å²	87	125.9 Å²	125.9	72%	0.719	69%	0.692	S	S	*	*	P	Polyproline II helix	trans	-57.3	131.6	174.5	0	0	0	0	0	108.9	L524 D528	L524-A526 PolarHBondContact O-N 2.69Å; A526-D528 VanDerWaalsContact C-N 3.28Å; A526-D528 PolarHBondContact O-N 2.65Å
527	I	61.5	Low	65.3	Low	159 Å²	159	125.8 Å²	125.8	82%	0.815	69%	0.688	S	S	*	*			trans	-70.9	92	176.1	-59.1	174.3	0	0	0	107.1	P525 R529	P525-I527 PolarHBondContact O-N 2.79Å; I527-R529 PolarHBondContact O-N 3.38Å
528	D	56.1	Low	65.7	Low	111 Å²	111	121.3 Å²	121.3	59%	0.594	69%	0.685	S	S	*	*			trans	-74.4	95.2	-176.3	-151.7	2.5	0	0	0	108.8	A526 Y530	A526-D528 VanDerWaalsContact C-N 3.28Å; A526-D528 PolarHBondContact O-N 2.65Å; D528-Y530 HydrophobicContact CB-CD2 4.29Å; D528-Y530 HydrophobicContact CB-CE2 3.8Å; D528-Y530 VanDerWaalsContact O-CD2 3.26Å; D528-Y530 WeakPolarHBondContact O-CD2 3.21Å; D528-Y530 PolarHBondContact O-N 2.74Å; D528-Y530 VanDerWaalsContact O-N 3.07Å; D528-Y530 PolarHBondContact OD2-OH 2.85Å; D528-Y530 VanDerWaalsContact OD2-OH 3.12Å
529	R	58.1	Low	65.7	Low	209 Å²	209	119.8 Å²	119.8	79%	0.789	69%	0.685	S	S	*	*			trans	-83.6	82.8	-174.4	-124.6	-178.9	170.9	169	-4	109.1	I527 D531	I527-R529 PolarHBondContact O-N 3.38Å; R529-D531 PolarHBondContact O-N 3.31Å
530	Y	59.4	Low	66.2	Low	188 Å²	188	119 Å²	119	74%	0.737	68%	0.679	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57.4	-19	-176.3	-81.8	-83.1	0	0	0	114.8	D528 F532	D528-Y530 HydrophobicContact CB-CD2 4.29Å; D528-Y530 HydrophobicContact CB-CE2 3.8Å; D528-Y530 VanDerWaalsContact O-CD2 3.26Å; D528-Y530 WeakPolarHBondContact O-CD2 3.21Å; D528-Y530 PolarHBondContact O-N 2.74Å; D528-Y530 VanDerWaalsContact O-N 3.07Å; D528-Y530 PolarHBondContact OD2-OH 2.85Å; D528-Y530 VanDerWaalsContact OD2-OH 3.12Å; Y530-F532 PolarHBondContact O-N 2.95Å
531	D	60.9	Low	66.6	Low	136 Å²	136	116 Å²	116	73%	0.727	67%	0.665	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.4	-1.7	-171.7	-50.7	-69.8	0	0	0	116.1	R529	R529-D531 PolarHBondContact O-N 3.31Å
532	F	53.1	Low	66.6	Low	190 Å²	190	115.8 Å²	115.8	83%	0.833	65%	0.652	S	S	*	*			trans	-132.5	93.8	175.6	-99.8	-88.1	0	0	0	112.7	Y530 A534	Y530-F532 PolarHBondContact O-N 2.95Å; F532-A534 PolarHBondContact O-N 3.09Å
533	P	62.3	Low	66.7	Low	111 Å²	111	113.3 Å²	113.3	72%	0.721	64%	0.638	S	S	*	*	P	Polyproline II helix	trans	-63	123.4	168.8	26.7	-33.3	0	0	0	109.4
534	A	65.2	Low	67	Low	87 Å²	87	114 Å²	114	72%	0.719	64%	0.637	S	S	*	*	P	Polyproline II helix	trans	-55.3	136	-179.3	0	0	0	0	0	111	F532	F532-A534 PolarHBondContact O-N 3.09Å
535	P	70.8	Confident	67.5	Low	118 Å²	118	112.4 Å²	112.4	77%	0.766	62%	0.623	S	S	*	*	P	Polyproline II helix	trans	-59.4	141	-177.9	24.1	-33.7	0	0	0	110.5	S537	P535-S537 PolarHBondContact O-N 3.33Å
536	P	74.2	Confident	68.1	Low	80 Å²	80	114.9 Å²	114.9	52%	0.519	62%	0.618	S	S	.	*	P	Polyproline II helix	trans	-57	134.2	-179.4	23.9	-33.7	0	0	0	109.9	V540 V541	P536-V540 HydrophobicContact CB-CB 4.34Å; P536-V540 HydrophobicContact CB-CG1 4.09Å; P536-V541 HydrophobicContact CB-CG2 3.97Å; P536-V541 HydrophobicContact CG-CG2 3.73Å
537	S	75.2	Confident	68.8	Low	59 Å²	59	113.6 Å²	113.6	41%	0.413	60%	0.595	S	S	.	*	P	Polyproline II helix	trans	-59.3	149.8	-176.2	74.8	0	0	0	0	110.6	P535 A539 V540 V541	P535-S537 PolarHBondContact O-N 3.33Å; S537-A539 PolarHBondContact O-N 3.39Å; S537-V540 WeakPolarHBondContact O-CA 3.47Å; S537-V540 WeakPolarHBondContact O-CB 3.47Å; S537-V540 PolarHBondContact O-N 2.93Å; S537-V541 PolarHBondContact O-N 3.22Å; S537-V541 VanDerWaalsContact O-N 3.09Å
538	P	77.5	Confident	69.2	Low	106 Å²	106	111.4 Å²	111.4	69%	0.688	58%	0.581	S	S	*	*	H	α-helix	trans	-55	-26.8	-179.2	-29	36.1	0	0	0	113.7	M542	P538-M542 WeakPolarHBondContact O-CB 3.3Å; P538-M542 WeakPolarHBondContact O-CG 3.27Å; P538-M542 PolarHBondContact O-N 3.16Å
539	A	72.7	Confident	70	Confident	61 Å²	61	113 Å²	113	50%	0.504	58%	0.583	S	S	.	*	H	α-helix	trans	-66.2	-42.8	172.5	0	0	0	0	0	112.9	S537 M542 I543	S537-A539 PolarHBondContact O-N 3.39Å; A539-M542 PolarHBondContact O-N 3.24Å; A539-I543 WeakPolarHBondContact O-CB 3.45Å; A539-I543 WeakPolarHBondContact O-CD1 3.38Å; A539-I543 WeakPolarHBondContact O-CG1 2.97Å; A539-I543 PolarHBondContact O-N 3.02Å
540	V	76.1	Confident	70.5	Confident	65 Å²	65	110.4 Å²	110.4	39%	0.394	57%	0.573	S	S	.	*	H	α-helix	trans	-64.2	-52	175.2	173.1	0	0	0	0	109.9	P536 S537 M542 I543 D544	P536-V540 HydrophobicContact CB-CB 4.34Å; P536-V540 HydrophobicContact CB-CG1 4.09Å; S537-V540 WeakPolarHBondContact O-CA 3.47Å; S537-V540 WeakPolarHBondContact O-CB 3.47Å; S537-V540 PolarHBondContact O-N 2.93Å; V540-M542 PolarHBondContact O-N 3.22Å; V540-I543 WeakPolarHBondContact O-CA 3.4Å; V540-I543 WeakPolarHBondContact O-CB 3.25Å; V540-I543 PolarHBondContact O-N 3.16Å; V540-D544 VanDerWaalsContact CG1-OD2 3.28Å; V540-D544 WeakPolarHBondContact CG1-OD2 3.32Å; V540-D544 PolarHBondContact O-N 3.18Å
541	V	77	Confident	70.6	Confident	67 Å²	67	108 Å²	108	41%	0.406	57%	0.57	S	S	.	*	H	α-helix	trans	-56.1	-38.7	178	-178.6	0	0	0	0	112	P536 S537 K545	P536-V541 HydrophobicContact CB-CG2 3.97Å; P536-V541 HydrophobicContact CG-CG2 3.73Å; S537-V541 PolarHBondContact O-N 3.22Å; S537-V541 VanDerWaalsContact O-N 3.09Å; V541-K545 WeakPolarHBondContact O-CB 3.24Å; V541-K545 PolarHBondContact O-N 3.29Å
542	M	72.1	Confident	70.7	Confident	118 Å²	118	105.3 Å²	105.3	58%	0.581	56%	0.559	S	S	*	*	H	α-helix	trans	-74.8	-25.5	176.7	-73.5	-75.5	-80.2	0	0	114	P538 A539 V540 R546	P538-M542 WeakPolarHBondContact O-CB 3.3Å; P538-M542 WeakPolarHBondContact O-CG 3.27Å; P538-M542 PolarHBondContact O-N 3.16Å; A539-M542 PolarHBondContact O-N 3.24Å; V540-M542 PolarHBondContact O-N 3.22Å; M542-R546 VanDerWaalsContact O-CB 3.23Å; M542-R546 WeakPolarHBondContact O-CB 3.43Å; M542-R546 PolarHBondContact O-N 2.79Å
543	I	74.2	Confident	70.7	Confident	102 Å²	102	98.2 Å²	98.2	52%	0.523	54%	0.54	S	S	.	.	H	α-helix	trans	-73.7	-46.4	171.3	-74	163.3	0	0	0	109.6	A539 V540 R546 R547	A539-I543 WeakPolarHBondContact O-CB 3.45Å; A539-I543 WeakPolarHBondContact O-CD1 3.38Å; A539-I543 WeakPolarHBondContact O-CG1 2.97Å; A539-I543 PolarHBondContact O-N 3.02Å; V540-I543 WeakPolarHBondContact O-CA 3.4Å; V540-I543 WeakPolarHBondContact O-CB 3.25Å; V540-I543 PolarHBondContact O-N 3.16Å; I543-R546 CarbonylContact O-C 3.58Å; I543-R546 WeakPolarHBondContact O-CA 3.19Å; I543-R546 WeakPolarHBondContact O-CB 3.15Å; I543-R546 PolarHBondContact O-N 3.06Å; I543-R546 VanDerWaalsContact O-N 3.13Å; I543-R547 PolarHBondContact O-N 3.31Å
544	D	74.9	Confident	70.2	Confident	69 Å²	69	98.5 Å²	98.5	37%	0.369	54%	0.539	S	S	.	.	H	α-helix	trans	-66.3	-46	-179.3	-64.7	-33.2	0	0	0	111.1	V540 R546 R547 E548	V540-D544 VanDerWaalsContact CG1-OD2 3.28Å; V540-D544 WeakPolarHBondContact CG1-OD2 3.32Å; V540-D544 PolarHBondContact O-N 3.18Å; D544-R546 PolarHBondContact O-N 3.12Å; D544-R546 VanDerWaalsContact O-N 3.16Å; D544-R547 CarbonylContact O-C 3.56Å; D544-R547 WeakPolarHBondContact O-CA 3.4Å; D544-R547 VanDerWaalsContact O-CB 3.31Å; D544-R547 WeakPolarHBondContact O-CB 3.09Å; D544-R547 PolarHBondContact O-N 3.17Å; D544-E548 WeakPolarHBondContact O-CB 3.41Å; D544-E548 PolarHBondContact O-N 3.24Å
545	K	76.6	Confident	69.2	Low	124 Å²	124	101.1 Å²	101.1	54%	0.539	54%	0.536	S	S	.	.	H	α-helix	trans	-64.1	-19.8	173.5	-162.6	160.2	-166.8	162.1	0	113.5	V541 K549	V541-K545 WeakPolarHBondContact O-CB 3.24Å; V541-K545 PolarHBondContact O-N 3.29Å; K545-K549 WeakPolarHBondContact O-CB 3.38Å; K545-K549 VanDerWaalsContact O-CG 3.27Å; K545-K549 WeakPolarHBondContact O-CG 3.48Å; K545-K549 PolarHBondContact O-N 3.18Å
546	R	74.1	Confident	67.7	Low	165 Å²	165	100.1 Å²	100.1	62%	0.623	53%	0.532	S	S	*	.	H	α-helix	trans	-88.2	-17.4	170.6	-175.7	-179	-66.6	167.4	0	112.9	M542 I543 D544 R550	M542-R546 VanDerWaalsContact O-CB 3.23Å; M542-R546 WeakPolarHBondContact O-CB 3.43Å; M542-R546 PolarHBondContact O-N 2.79Å; I543-R546 CarbonylContact O-C 3.58Å; I543-R546 WeakPolarHBondContact O-CA 3.19Å; I543-R546 WeakPolarHBondContact O-CB 3.15Å; I543-R546 PolarHBondContact O-N 3.06Å; I543-R546 VanDerWaalsContact O-N 3.13Å; D544-R546 PolarHBondContact O-N 3.12Å; D544-R546 VanDerWaalsContact O-N 3.16Å; R546-R550 PolarHBondContact O-NE 3.07Å; R546-R550 VanDerWaalsContact O-NE 3.12Å
547	R	73.1	Confident	66.1	Low	61 Å²	61	103.6 Å²	103.6	23%	0.23	55%	0.545	C	S	.	.	H	α-helix	trans	-84.7	-49.4	172.8	-171	-170.7	-163.9	161.2	3.2	110.2	I543 D544 K549 R550 M551 D629 Y654	I543-R547 PolarHBondContact O-N 3.31Å; D544-R547 CarbonylContact O-C 3.56Å; D544-R547 WeakPolarHBondContact O-CA 3.4Å; D544-R547 VanDerWaalsContact O-CB 3.31Å; D544-R547 WeakPolarHBondContact O-CB 3.09Å; D544-R547 PolarHBondContact O-N 3.17Å; R547-K549 VanDerWaalsContact C-N 3.33Å; R547-K549 PolarHBondContact O-N 2.94Å; R547-R550 CarbonylContact O-C 3.53Å; R547-R550 WeakPolarHBondContact O-CA 3.39Å; R547-R550 WeakPolarHBondContact O-CB 3.31Å; R547-R550 PolarHBondContact O-N 2.99Å; R547-M551 WeakPolarHBondContact O-CG 3.35Å; R547-M551 PolarHBondContact O-N 2.87Å; R547-D629 IonicContact CZ-OD1 2.7Å; R547-D629 IonicContact CZ-OD2 3.07Å; R547-D629 IonicContact NH1-OD1 2.81Å; R547-D629 PolarHBondContact NH1-OD1 3.39Å; R547-D629 IonicContact NH1-OD2 2.76Å; R547-D629 PolarHBondContact NH1-OD2 3.4Å; R547-D629 IonicContact NH2-OD1 3.21Å; R547-D629 PolarHBondContact NH2-OD1 3.09Å; R547-D629 IonicContact NH2-OD2 3.22Å; R547-Y654 VanDerWaalsContact NH2-CE1 3.27Å
548	E	69.2	Low	64.2	Low	113 Å²	113	104 Å²	104	53%	0.528	56%	0.558	S	S	.	*	H	α-helix	trans	-47.7	-53	169.4	-178.8	-172.6	-147	0	0	111	D544 R550 M551 T552	D544-E548 WeakPolarHBondContact O-CB 3.41Å; D544-E548 PolarHBondContact O-N 3.24Å; E548-R550 PolarHBondContact O-N 3.13Å; E548-R550 VanDerWaalsContact O-N 3.1Å; E548-M551 PolarHBondContact O-N 3.24Å; E548-T552 PolarHBondContact O-N 3.37Å; E548-T552 PolarHBondContact O-OG1 3.36Å; E548-T552 VanDerWaalsContact O-OG1 3.06Å
549	K	72.5	Confident	62.3	Low	145 Å²	145	105.3 Å²	105.3	63%	0.63	56%	0.564	S	S	*	*	H	α-helix	trans	-59.9	-18.5	174.6	-79.7	-175.5	174.2	-165.1	0	115.8	K545 R547 G553	K545-K549 WeakPolarHBondContact O-CB 3.38Å; K545-K549 VanDerWaalsContact O-CG 3.27Å; K545-K549 WeakPolarHBondContact O-CG 3.48Å; K545-K549 PolarHBondContact O-N 3.18Å; R547-K549 VanDerWaalsContact C-N 3.33Å; R547-K549 PolarHBondContact O-N 2.94Å; K549-G553 WeakPolarHBondContact O-CA 3.33Å; K549-G553 PolarHBondContact O-N 3.16Å; K549-G553 VanDerWaalsContact O-N 3.16Å
550	R	68.8	Low	60.3	Low	153 Å²	153	110.6 Å²	110.6	58%	0.577	58%	0.584	S	S	*	*	H	α-helix	trans	-90	-29.4	172	-75.9	-178.2	-69.5	150.1	2.9	112.5	R546 R547 E548	R546-R550 PolarHBondContact O-NE 3.07Å; R546-R550 VanDerWaalsContact O-NE 3.12Å; R547-R550 CarbonylContact O-C 3.53Å; R547-R550 WeakPolarHBondContact O-CA 3.39Å; R547-R550 WeakPolarHBondContact O-CB 3.31Å; R547-R550 PolarHBondContact O-N 2.99Å; E548-R550 PolarHBondContact O-N 3.13Å; E548-R550 VanDerWaalsContact O-N 3.1Å
551	M	62.1	Low	58.6	Low	137 Å²	137	112.5 Å²	112.5	68%	0.675	60%	0.6	S	S	*	*	H	α-helix	trans	-70.4	-46.1	172.1	-57.3	-66.5	-96	0	0	110.6	R547 E548	R547-M551 WeakPolarHBondContact O-CG 3.35Å; R547-M551 PolarHBondContact O-N 2.87Å; E548-M551 PolarHBondContact O-N 3.24Å
552	T	63.4	Low	56.7	Low	80 Å²	80	120.4 Å²	120.4	49%	0.491	62%	0.622	S	S	.	*	H	α-helix	trans	-78.2	-31.2	179.2	56.2	0	0	0	0	113.2	E548 V554 Q555	E548-T552 PolarHBondContact O-N 3.37Å; E548-T552 PolarHBondContact O-OG1 3.36Å; E548-T552 VanDerWaalsContact O-OG1 3.06Å; T552-V554 PolarHBondContact O-N 3.19Å; T552-Q555 PolarHBondContact O-N 2.8Å
553	G	53.6	Low	54.9	Low	42 Å²	42	122.9 Å²	122.9	43%	0.433	64%	0.638	S	S	.	*	T	Hydrogen-bonded Turn	trans	-66.2	-1.4	-178.2	0	0	0	0	0	116.4	K549	K549-G553 WeakPolarHBondContact O-CA 3.33Å; K549-G553 PolarHBondContact O-N 3.16Å; K549-G553 VanDerWaalsContact O-N 3.16Å
554	V	51.5	Low	52.9	Low	116 Å²	116	121.2 Å²	121.2	70%	0.703	65%	0.646	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.8	-20.5	171.7	-178.8	0	0	0	0	111.8	T552	T552-V554 PolarHBondContact O-N 3.19Å
555	Q	44.1	Very low	51	Low	143 Å²	143	124.7 Å²	124.7	67%	0.668	67%	0.67	S	S	*	*	S	Bend	trans	-86.3	-7.8	-177.8	-66	-177.7	-10.3	0	0	113.9	T552 I557	T552-Q555 PolarHBondContact O-N 2.8Å; Q555-I557 VanDerWaalsContact C-N 3.3Å; Q555-I557 PolarHBondContact O-N 2.97Å
556	S	39.6	Very low	48.9	Very low	97 Å²	97	125.5 Å²	125.5	68%	0.678	68%	0.679	S	S	*	*			trans	-90.4	31.7	-175.7	67.1	0	0	0	0	114.4
557	I	40.6	Very low	47.1	Very low	153 Å²	153	129.2 Å²	129.2	79%	0.785	69%	0.693	S	S	*	*	S	Bend	trans	-122.9	88.4	172.4	-57.6	-178.4	0	0	0	108.5	Q555	Q555-I557 VanDerWaalsContact C-N 3.3Å; Q555-I557 PolarHBondContact O-N 2.97Å
558	G	34.5	Very low	45.1	Very low	67 Å²	67	132.2 Å²	132.2	69%	0.691	71%	0.714	S	S	*	*	S	Bend	trans	76.9	88.2	163.6	0	0	0	0	0	117.6
559	V	37.6	Very low	43.4	Very low	134 Å²	134	130.6 Å²	130.6	81%	0.812	73%	0.727	S	S	*	*				-146	86	123.3	-172	0	0	0	0	109.2	S561	V559-S561 PolarHBondContact O-N 3.22Å
560	D	30.8	Very low	41.5	Very low	172 Å²	172	130 Å²	130	92%	0.92	74%	0.736	S	S	*	*			trans	-82.2	87.3	161.8	-95.4	-51	0	0	0	108.8
561	S	39.5	Very low	39.7	Very low	104 Å²	104	130.4 Å²	130.4	73%	0.727	75%	0.746	S	S	*	*			trans	-150.8	147.5	170.7	-85.6	0	0	0	0	112.6	V559	V559-S561 PolarHBondContact O-N 3.22Å
562	R	37.7	Very low	38.2	Very low	233 Å²	233	129.7 Å²	129.7	88%	0.879	75%	0.75	S	S	*	*			trans	-98.1	165.7	-172.8	-65.7	170.8	176.2	146	0	110.7
563	N	35	Very low	36.7	Very low	171 Å²	171	130.8 Å²	130.8	91%	0.914	76%	0.76	S	S	*	*			trans	81.6	136.7	-175.6	-43.3	-32.7	0	0	0	112.8
564	G	31.5	Very low	35.7	Very low	67 Å²	67	134.5 Å²	134.5	69%	0.691	77%	0.774	S	S	*	*			cis	171.7	-178.6	-6.9	0	0	0	0	0	113.9
565	T	35.5	Very low	34.8	Very low	141 Å²	141	135.7 Å²	135.7	87%	0.865	78%	0.777	S	S	*	*			trans	68	83.6	159.6	-41.1	0	0	0	0	117.9
566	L	33	Very low	34.2	Very low	141 Å²	141	135 Å²	135	74%	0.738	78%	0.782	S	S	*	*			trans	-17.9	135.2	142.3	-164.5	103.7	0	0	0	115.7
567	R	34.9	Very low	33.9	Very low	244 Å²	244	136.1 Å²	136.1	92%	0.921	78%	0.781	S	S	*	*			trans	-144.6	101.5	155.4	-140.8	179.5	-168.8	-139.7	0.5	112
568	N	32.1	Very low	33.4	Very low	124 Å²	124	141.5 Å²	141.5	66%	0.663	79%	0.792	S	S	*	*			trans	-79.8	139.3	169.8	-59.7	11	0	0	0	108.5
569	G	34	Very low	33.8	Very low	78 Å²	78	143.7 Å²	143.7	80%	0.804	79%	0.792	S	S	*	*			trans	-135.3	119.4	177.6	0	0	0	0	0	111
570	T	31.1	Very low	34.1	Very low	132 Å²	132	145.8 Å²	145.8	81%	0.81	80%	0.798	S	S	*	*			trans	-87.4	172.5	178.1	-37.7	0	0	0	0	110.4
571	M	30.7	Very low	35.1	Very low	162 Å²	162	141.2 Å²	141.2	80%	0.798	77%	0.768	S	S	*	*			trans	78.5	146.1	164.6	-29.7	-154.1	82.8	0	0	113.8
572	T	32.5	Very low	36.1	Very low	123 Å²	123	141.7 Å²	141.7	76%	0.755	76%	0.763	S	S	*	*			cis	-153.4	179	-9.2	-2.9	0	0	0	0	109.6
573	S	30.2	Very low	37.7	Very low	102 Å²	102	135.3 Å²	135.3	71%	0.713	75%	0.752	S	S	*	*			trans	-64.2	161.7	166.6	53.2	0	0	0	0	113.5
574	V	33.3	Very low	39.4	Very low	120 Å²	120	131 Å²	131	73%	0.727	73%	0.732	S	S	*	*	S	Bend	trans	87.8	103.3	170.2	-169.6	0	0	0	0	115.1
575	D	32.6	Very low	41.4	Very low	141 Å²	141	129.1 Å²	129.1	75%	0.754	71%	0.705	S	S	*	*			trans	67.3	141	148.9	-53.7	-15.1	0	0	0	123.4
576	T	32.1	Very low	43.4	Very low	128 Å²	128	125.1 Å²	125.1	79%	0.785	68%	0.679	S	S	*	*			trans	78.9	141.9	156.1	27.3	0	0	0	0	122.7
577	D	32	Very low	45.7	Very low	122 Å²	122	120.6 Å²	120.6	65%	0.652	66%	0.661	S	S	*	*			trans	69.9	96.6	153.2	-61.6	-3.3	0	0	0	122.9	T579	D577-T579 PolarHBondContact O-N 3.02Å; D577-T579 PolarHBondContact O-OG1 3.42Å
578	W	31.6	Very low	47.9	Very low	265 Å²	265	114.7 Å²	114.7	100%	1.004	64%	0.642	S	S	*	*			trans	-51.1	82.5	166.5	-64.2	81.6	0	0	0	114.3
579	T	41.7	Very low	50.5	Low	114 Å²	114	110 Å²	110	70%	0.699	62%	0.617	S	S	*	*			trans	-124.8	7.1	-175.6	47.9	0	0	0	0	115.3	D577 R581	D577-T579 PolarHBondContact O-N 3.02Å; D577-T579 PolarHBondContact O-OG1 3.42Å; T579-R581 VanDerWaalsContact C-N 3.25Å; T579-R581 PolarHBondContact O-N 3.04Å
580	D	44.1	Very low	52.9	Low	177 Å²	177	111.2 Å²	111.2	95%	0.947	61%	0.605	S	S	*	*			trans	-75.8	78	170.7	-158.9	11	0	0	0	110.6
581	R	51.5	Low	55.6	Low	76 Å²	76	114 Å²	114	29%	0.287	60%	0.601	S	S	.	*			trans	-96.3	136.2	-178.6	-81.2	-96.4	163.7	-176	-6.5	110.5	T579 N586 H624	T579-R581 VanDerWaalsContact C-N 3.25Å; T579-R581 PolarHBondContact O-N 3.04Å; R581-N586 WeakPolarHBondContact CB-OD1 2.7Å; R581-N586 PolarHBondContact O-ND2 2.95Å; R581-N586 VanDerWaalsContact O-ND2 3.09Å; R581-H624 VanDerWaalsContact CZ-NE2 3.28Å; R581-H624 PolarHBondContact NH1-CD2 2.87Å; R581-H624 PolarHBondContact NH2-CE1 2.7Å; R581-H624 PolarHBondContact NH2-NE2 3.38Å
582	D	61.1	Low	58.4	Low	115 Å²	115	107.3 Å²	107.3	62%	0.615	57%	0.568	S	S	*	*			trans	-42.2	126.9	175.5	-91.8	-50.6	0	0	0	111.9	V584 L585 N586	D582-V584 PolarHBondContact O-N 2.9Å; D582-V584 VanDerWaalsContact O-N 3.12Å; D582-L585 HydrophobicContact CB-CB 3.84Å; D582-L585 WeakPolarHBondContact O-CA 3.18Å; D582-L585 WeakPolarHBondContact O-CB 3.38Å; D582-L585 PolarHBondContact O-N 3Å; D582-N586 PolarHBondContact O-N 3.21Å
583	P	70.5	Confident	61.1	Low	99 Å²	99	104.4 Å²	104.4	64%	0.643	55%	0.548	S	S	*	.	H	α-helix	trans	-62.9	-26	-178.4	24	-33.6	0	0	0	112.5	L585 A587	P583-L585 VanDerWaalsContact C-N 3.31Å; P583-A587 VanDerWaalsContact O-CB 3.31Å; P583-A587 WeakPolarHBondContact O-CB 3.45Å; P583-A587 PolarHBondContact O-N 2.94Å
584	V	72.7	Confident	63.9	Low	81 Å²	81	102 Å²	102	49%	0.491	53%	0.534	S	S	.	.	H	α-helix	trans	-71.1	-26.1	173.4	-177.3	0	0	0	0	112.2	D582 K588	D582-V584 PolarHBondContact O-N 2.9Å; D582-V584 VanDerWaalsContact O-N 3.12Å; V584-K588 WeakPolarHBondContact O-CG 3.26Å
585	L	72.6	Confident	66.5	Low	27 Å²	27	101.3 Å²	101.3	14%	0.141	52%	0.523	C	S	.	.	H	α-helix	trans	-84.4	-40.6	177.6	-169.5	148.8	0	0	0	110.4	D582 P583 K588 L589 V623	D582-L585 HydrophobicContact CB-CB 3.84Å; D582-L585 WeakPolarHBondContact O-CA 3.18Å; D582-L585 WeakPolarHBondContact O-CB 3.38Å; D582-L585 PolarHBondContact O-N 3Å; P583-L585 VanDerWaalsContact C-N 3.31Å; L585-K588 WeakPolarHBondContact O-CB 3.42Å; L585-K588 PolarHBondContact O-N 3.13Å; L585-K588 VanDerWaalsContact O-N 3.11Å; L585-L589 HydrophobicContact CD2-CD1 3.75Å; L585-L589 HydrophobicContact CD2-CG 4.3Å; L585-L589 WeakPolarHBondContact O-CG 3.47Å; L585-L589 PolarHBondContact O-N 2.84Å; L585-L589 VanDerWaalsContact O-N 3.09Å; L585-V623 HydrophobicContact CD1-CG1 4.42Å; L585-V623 HydrophobicContact CD2-CG1 4.01Å; L585-V623 HydrophobicContact CG-CG1 3.81Å
586	N	76.6	Confident	69.1	Low	57 Å²	57	95 Å²	95	31%	0.305	49%	0.49	S	S	.	.	H	α-helix	trans	-59.3	-49.8	171.8	-59.9	-18.4	0	0	0	110.6	R581 D582 K588 L589 D590	R581-N586 WeakPolarHBondContact CB-OD1 2.7Å; R581-N586 PolarHBondContact O-ND2 2.95Å; R581-N586 VanDerWaalsContact O-ND2 3.09Å; D582-N586 PolarHBondContact O-N 3.21Å; N586-K588 PolarHBondContact O-N 3.3Å; N586-L589 WeakPolarHBondContact O-CA 3.14Å; N586-L589 WeakPolarHBondContact O-CB 3.5Å; N586-L589 PolarHBondContact O-N 3.46Å; N586-D590 PolarHBondContact O-N 3.05Å
587	A	81.7	Confident	71.8	Confident	45 Å²	45	93.5 Å²	93.5	37%	0.372	47%	0.474	S	S	.	.	H	α-helix	trans	-63.8	-7.3	176.4	0	0	0	0	0	115.3	P583 R591	P583-A587 VanDerWaalsContact O-CB 3.31Å; P583-A587 WeakPolarHBondContact O-CB 3.45Å; P583-A587 PolarHBondContact O-N 2.94Å; A587-R591 WeakPolarHBondContact O-CD 3.3Å; A587-R591 WeakPolarHBondContact O-CG 3.3Å; A587-R591 PolarHBondContact O-NE 3.23Å
588	K	82	Confident	74.5	Confident	120 Å²	120	90.9 Å²	90.9	52%	0.522	46%	0.462	S	S	.	.	H	α-helix	trans	-90.8	-43	165.9	-74.8	174.5	178.2	-178.3	0	111.7	V584 L585 N586 D590 R591 I592	V584-K588 WeakPolarHBondContact O-CG 3.26Å; L585-K588 WeakPolarHBondContact O-CB 3.42Å; L585-K588 PolarHBondContact O-N 3.13Å; L585-K588 VanDerWaalsContact O-N 3.11Å; N586-K588 PolarHBondContact O-N 3.3Å; K588-D590 VanDerWaalsContact C-N 3.34Å; K588-R591 PolarHBondContact O-N 3.43Å; K588-I592 WeakPolarHBondContact O-CG1 3.46Å; K588-I592 PolarHBondContact O-N 3.38Å; K588-I592 VanDerWaalsContact O-N 3.16Å
589	L	85.2	Confident	77	Confident	26 Å²	26	79.2 Å²	79.2	14%	0.136	42%	0.419	C	S	.	.	H	α-helix	trans	-59.1	-45.9	174.7	-64.8	170.5	0	0	0	110.7	L585 N586 R591 I592 D593 K620 V623	L585-L589 HydrophobicContact CD2-CD1 3.75Å; L585-L589 HydrophobicContact CD2-CG 4.3Å; L585-L589 WeakPolarHBondContact O-CG 3.47Å; L585-L589 PolarHBondContact O-N 2.84Å; L585-L589 VanDerWaalsContact O-N 3.09Å; N586-L589 WeakPolarHBondContact O-CA 3.14Å; N586-L589 WeakPolarHBondContact O-CB 3.5Å; N586-L589 PolarHBondContact O-N 3.46Å; L589-R591 PolarHBondContact O-N 3.3Å; L589-I592 PolarHBondContact O-N 3.03Å; L589-I592 VanDerWaalsContact O-N 3.11Å; L589-D593 PolarHBondContact O-N 3.08Å; L589-K620 HydrophobicContact CD2-CG 3.69Å; L589-V623 HydrophobicContact CD2-CB 4.09Å; L589-V623 HydrophobicContact CD2-CG1 3.75Å; L589-V623 HydrophobicContact CG-CG1 4.05Å
590	D	85.5	Confident	79.2	Confident	103 Å²	103	77.5 Å²	77.5	55%	0.551	40%	0.402	S	S	*	.	H	α-helix	trans	-57.2	-35.4	178.2	-57.7	-29.8	0	0	0	112.7	N586 K588 A594	N586-D590 PolarHBondContact O-N 3.05Å; K588-D590 VanDerWaalsContact C-N 3.34Å; D590-A594 WeakPolarHBondContact O-CB 3.5Å; D590-A594 PolarHBondContact O-N 3.02Å
591	R	88.5	Confident	81.2	Confident	191 Å²	191	77.4 Å²	77.4	72%	0.721	39%	0.388	S	S	*	.	H	α-helix	trans	-72.6	-43.4	177.1	-70	176.2	-175	-161	-0.7	112.1	A587 K588 L589 D593 A594 E595	A587-R591 WeakPolarHBondContact O-CD 3.3Å; A587-R591 WeakPolarHBondContact O-CG 3.3Å; A587-R591 PolarHBondContact O-NE 3.23Å; K588-R591 PolarHBondContact O-N 3.43Å; L589-R591 PolarHBondContact O-N 3.3Å; R591-D593 VanDerWaalsContact C-N 3.33Å; R591-A594 PolarHBondContact O-N 2.99Å; R591-E595 WeakPolarHBondContact O-CB 3.21Å; R591-E595 PolarHBondContact O-N 3.19Å
592	I	88	Confident	82.4	Confident	21 Å²	21	80.4 Å²	80.4	11%	0.108	41%	0.409	C	S	.	.	H	α-helix	trans	-63.5	-42.9	177.4	-67.4	162.3	0	0	0	109.8	K588 L589 E595 I596 L616 V623	K588-I592 WeakPolarHBondContact O-CG1 3.46Å; K588-I592 PolarHBondContact O-N 3.38Å; K588-I592 VanDerWaalsContact O-N 3.16Å; L589-I592 PolarHBondContact O-N 3.03Å; L589-I592 VanDerWaalsContact O-N 3.11Å; I592-E595 PolarHBondContact O-N 2.8Å; I592-I596 HydrophobicContact CG2-CD1 3.83Å; I592-I596 VanDerWaalsContact O-CG1 3.3Å; I592-I596 WeakPolarHBondContact O-CG1 3.26Å; I592-I596 PolarHBondContact O-N 2.64Å; I592-L616 HydrophobicContact CG2-CB 4.23Å; I592-V623 HydrophobicContact CD1-CG2 3.77Å
593	D	89.6	Confident	83.1	Confident	62 Å²	62	76 Å²	76	33%	0.332	39%	0.391	S	S	.	.	H	α-helix	trans	-68	-36.7	178.5	-73	-23.8	0	0	0	112.3	L589 R591 I596 E597 K620	L589-D593 PolarHBondContact O-N 3.08Å; R591-D593 VanDerWaalsContact C-N 3.33Å; D593-I596 PolarHBondContact O-N 3.29Å; D593-E597 PolarHBondContact O-N 3.02Å; D593-K620 IonicContact OD1-NZ 3.63Å; D593-K620 PolarHBondContact OD1-NZ 2.99Å; D593-K620 IonicContact OD2-NZ 3.58Å; D593-K620 PolarHBondContact OD2-NZ 3.31Å
594	A	89.5	Confident	83	Confident	52 Å²	52	77.6 Å²	77.6	43%	0.43	39%	0.39	S	S	.	.	H	α-helix	trans	-65.2	-37.6	171.6	0	0	0	0	0	112.9	D590 R591 E597 T598	D590-A594 WeakPolarHBondContact O-CB 3.5Å; D590-A594 PolarHBondContact O-N 3.02Å; R591-A594 PolarHBondContact O-N 2.99Å; A594-E597 PolarHBondContact O-N 3.31Å; A594-T598 PolarHBondContact O-N 3.26Å
595	E	87.3	Confident	83	Confident	105 Å²	105	79.6 Å²	79.6	49%	0.491	41%	0.407	S	S	.	.	H	α-helix	trans	-71.2	-38	176.7	-164.9	176.1	173	0	0	112	R591 I592 E597 T598 L599 L616	R591-E595 WeakPolarHBondContact O-CB 3.21Å; R591-E595 PolarHBondContact O-N 3.19Å; I592-E595 PolarHBondContact O-N 2.8Å; E595-E597 VanDerWaalsContact C-N 3.3Å; E595-E597 PolarHBondContact O-N 3.03Å; E595-T598 PolarHBondContact O-N 3.4Å; E595-T598 PolarHBondContact O-OG1 3Å; E595-L599 WeakPolarHBondContact O-CG 3.42Å; E595-L599 PolarHBondContact O-N 2.87Å; E595-L616 HydrophobicContact CB-CD1 4.04Å; E595-L616 HydrophobicContact CG-CD1 3.71Å
596	I	88.4	Confident	83.3	Confident	10 Å²	10	80.7 Å²	80.7	5%	0.051	42%	0.418	C	S	.	.	H	α-helix	trans	-61.3	-40.2	169	-69.7	164.4	0	0	0	110.4	I592 D593 L599 K600 I613 L616 E617	I592-I596 HydrophobicContact CG2-CD1 3.83Å; I592-I596 VanDerWaalsContact O-CG1 3.3Å; I592-I596 WeakPolarHBondContact O-CG1 3.26Å; I592-I596 PolarHBondContact O-N 2.64Å; D593-I596 PolarHBondContact O-N 3.29Å; I596-L599 PolarHBondContact O-N 2.98Å; I596-K600 HydrophobicContact CG2-CD 3.9Å; I596-K600 HydrophobicContact CG2-CG 4.48Å; I596-K600 VanDerWaalsContact O-CG 3.32Å; I596-K600 WeakPolarHBondContact O-CG 3.34Å; I596-K600 PolarHBondContact O-N 3.35Å; I596-I613 HydrophobicContact CG2-CG2 4.31Å; I596-L616 HydrophobicContact CD1-CB 3.98Å; I596-L616 HydrophobicContact CG1-CB 3.69Å; I596-L616 HydrophobicContact CG1-CD1 4Å; I596-E617 HydrophobicContact CD1-CG 3.73Å
597	E	88.5	Confident	83.6	Confident	96 Å²	96	81 Å²	81	45%	0.449	43%	0.433	S	S	.	.	H	α-helix	trans	-66.8	-40.7	177.9	-151.3	-156.9	163.4	0	0	112.5	D593 A594 E595 K600 R601	D593-E597 PolarHBondContact O-N 3.02Å; A594-E597 PolarHBondContact O-N 3.31Å; E595-E597 VanDerWaalsContact C-N 3.3Å; E595-E597 PolarHBondContact O-N 3.03Å; E597-K600 PolarHBondContact O-N 3.26Å; E597-R601 WeakPolarHBondContact O-CB 3.44Å; E597-R601 VanDerWaalsContact O-CG 3.24Å; E597-R601 WeakPolarHBondContact O-CG 3.18Å; E597-R601 PolarHBondContact O-N 3.14Å; E597-R601 IonicContact OE1-CZ 3.22Å; E597-R601 IonicContact OE1-NE 3.04Å; E597-R601 PolarHBondContact OE1-NE 3.35Å; E597-R601 IonicContact OE1-NH2 2.67Å; E597-R601 PolarHBondContact OE1-NH2 2.99Å; E597-R601 IonicContact OE2-CZ 3.54Å; E597-R601 IonicContact OE2-NE 3.89Å; E597-R601 IonicContact OE2-NH2 2.92Å; E597-R601 PolarHBondContact OE2-NH2 2.62Å
598	T	87.5	Confident	83.7	Confident	67 Å²	67	84.8 Å²	84.8	41%	0.411	45%	0.446	S	S	.	.	H	α-helix	trans	-65.7	-39.1	175.6	58.4	0	0	0	0	111.9	A594 E595 R601 L602	A594-T598 PolarHBondContact O-N 3.26Å; E595-T598 PolarHBondContact O-N 3.4Å; E595-T598 PolarHBondContact O-OG1 3Å; T598-R601 PolarHBondContact O-N 2.76Å; T598-L602 WeakPolarHBondContact O-CB 3.49Å; T598-L602 VanDerWaalsContact O-CG 3.29Å; T598-L602 WeakPolarHBondContact O-CG 3.25Å; T598-L602 PolarHBondContact O-N 2.8Å
599	L	85.7	Confident	83.8	Confident	19 Å²	19	79.8 Å²	79.8	10%	0.099	43%	0.426	C	S	.	.	H	α-helix	trans	-64.9	-39.3	174.8	-70.3	168.6	0	0	0	112.8	E595 I596 L602 G603 T609 L612 I613 L616	E595-L599 WeakPolarHBondContact O-CG 3.42Å; E595-L599 PolarHBondContact O-N 2.87Å; I596-L599 PolarHBondContact O-N 2.98Å; L599-L602 PolarHBondContact O-N 3.21Å; L599-G603 PolarHBondContact O-N 2.88Å; L599-T609 HydrophobicContact CD2-CG2 4.18Å; L599-L612 HydrophobicContact CD1-CB 3.73Å; L599-L612 HydrophobicContact CD2-CB 4.34Å; L599-L612 HydrophobicContact CD2-CD1 4.03Å; L599-I613 HydrophobicContact CB-CD1 3.96Å; L599-I613 HydrophobicContact CB-CG1 3.69Å; L599-I613 HydrophobicContact CD1-CG1 4.04Å; L599-L616 HydrophobicContact CD1-CD1 3.5Å; L599-L616 VanDerWaalsContact CD1-CD1 3.5Å
600	K	87.6	Confident	83.9	Confident	78 Å²	78	80.8 Å²	80.8	34%	0.339	44%	0.438	S	S	.	.	H	α-helix	trans	-64.6	-42.1	174.2	-71.7	175.9	178.7	166	0	111.3	I596 E597 L602 G603 E604 I613 E617	I596-K600 HydrophobicContact CG2-CD 3.9Å; I596-K600 HydrophobicContact CG2-CG 4.48Å; I596-K600 VanDerWaalsContact O-CG 3.32Å; I596-K600 WeakPolarHBondContact O-CG 3.34Å; I596-K600 PolarHBondContact O-N 3.35Å; E597-K600 PolarHBondContact O-N 3.26Å; K600-L602 VanDerWaalsContact C-N 3.32Å; K600-L602 PolarHBondContact O-N 2.96Å; K600-G603 PolarHBondContact O-N 3.05Å; K600-G603 VanDerWaalsContact O-N 3.15Å; K600-E604 HydrophobicContact CB-CG 4.13Å; K600-E604 HydrophobicContact CG-CG 4.09Å; K600-E604 WeakPolarHBondContact CG-OE1 3.45Å; K600-I613 HydrophobicContact CG-CD1 3.64Å; K600-I613 HydrophobicContact CG-CG1 4.5Å; K600-E617 IonicContact NZ-OE1 3.6Å; K600-E617 PolarHBondContact NZ-OE1 2.95Å
601	R	85.1	Confident	83.9	Confident	175 Å²	175	78.4 Å²	78.4	66%	0.66	43%	0.432	S	S	*	.	H	α-helix	trans	-64.1	-30.5	173.3	-68.9	169.1	-176.2	-175.7	3.6	113.7	E597 T598 G603	E597-R601 WeakPolarHBondContact O-CB 3.44Å; E597-R601 VanDerWaalsContact O-CG 3.24Å; E597-R601 WeakPolarHBondContact O-CG 3.18Å; E597-R601 PolarHBondContact O-N 3.14Å; E597-R601 IonicContact OE1-CZ 3.22Å; E597-R601 IonicContact OE1-NE 3.04Å; E597-R601 PolarHBondContact OE1-NE 3.35Å; E597-R601 IonicContact OE1-NH2 2.67Å; E597-R601 PolarHBondContact OE1-NH2 2.99Å; E597-R601 IonicContact OE2-CZ 3.54Å; E597-R601 IonicContact OE2-NE 3.89Å; E597-R601 IonicContact OE2-NH2 2.92Å; E597-R601 PolarHBondContact OE2-NH2 2.62Å; T598-R601 PolarHBondContact O-N 2.76Å; R601-G603 VanDerWaalsContact C-N 3.26Å; R601-G603 PolarHBondContact O-N 3.28Å
602	L	77.2	Confident	83.9	Confident	139 Å²	139	72.8 Å²	72.8	73%	0.728	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.8	-9.6	175.3	-73.8	168.5	0	0	0	113.6	T598 L599 K600	T598-L602 WeakPolarHBondContact O-CB 3.49Å; T598-L602 VanDerWaalsContact O-CG 3.29Å; T598-L602 WeakPolarHBondContact O-CG 3.25Å; T598-L602 PolarHBondContact O-N 2.8Å; L599-L602 PolarHBondContact O-N 3.21Å; K600-L602 VanDerWaalsContact C-N 3.32Å; K600-L602 PolarHBondContact O-N 2.96Å
603	G	75.1	Confident	83.9	Confident	22 Å²	22	72.5 Å²	72.5	23%	0.227	42%	0.415	C	S	.	.	T	Hydrogen-bonded Turn	trans	118.6	109.3	170.6	0	0	0	0	0	112.7	L599 K600 R601 S605 S606 T609	L599-G603 PolarHBondContact O-N 2.88Å; K600-G603 PolarHBondContact O-N 3.05Å; K600-G603 VanDerWaalsContact O-N 3.15Å; R601-G603 VanDerWaalsContact C-N 3.26Å; R601-G603 PolarHBondContact O-N 3.28Å; G603-S605 PolarHBondContact O-N 3.45Å; G603-S605 VanDerWaalsContact O-N 3.1Å; G603-S606 PolarHBondContact O-N 3.35Å; G603-T609 PolarHBondContact O-OG1 3.45Å
604	E	69.3	Low	83.7	Confident	133 Å²	133	76.4 Å²	76.4	62%	0.621	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.7	-11.3	176	-56.8	-177.1	145.5	0	0	113.7	K600	K600-E604 HydrophobicContact CB-CG 4.13Å; K600-E604 HydrophobicContact CG-CG 4.09Å; K600-E604 WeakPolarHBondContact CG-OE1 3.45Å
605	S	71.7	Confident	83.6	Confident	123 Å²	123	80.6 Å²	80.6	86%	0.86	44%	0.442	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85	-8	-178.1	55.2	0	0	0	0	115.1	G603	G603-S605 PolarHBondContact O-N 3.45Å; G603-S605 VanDerWaalsContact O-N 3.1Å
606	S	79.4	Confident	83.7	Confident	51 Å²	51	76.8 Å²	76.8	36%	0.357	43%	0.425	S	S	.	.	S	Bend	trans	-86.8	128.6	173.8	177.2	0	0	0	0	110.7	G603 I608 T609 A610	G603-S606 PolarHBondContact O-N 3.35Å; S606-I608 PolarHBondContact O-N 3.37Å; S606-I608 VanDerWaalsContact O-N 3.07Å; S606-I608 PolarHBondContact OG-N 3.45Å; S606-T609 WeakPolarHBondContact CB-OG1 3.3Å; S606-T609 PolarHBondContact O-N 2.8Å; S606-T609 VanDerWaalsContact O-N 3.17Å; S606-T609 PolarHBondContact O-OG1 2.96Å; S606-A610 PolarHBondContact O-N 3.44Å
607	G	82.5	Confident	83.6	Confident	62 Å²	62	80.5 Å²	80.5	64%	0.639	44%	0.442	S	S	*	.	H	α-helix	trans	-59.5	-21.5	175.5	0	0	0	0	0	113.7	A611	G607-A611 WeakPolarHBondContact O-CB 3.49Å; G607-A611 PolarHBondContact O-N 2.93Å
608	I	83.3	Confident	83.4	Confident	125 Å²	125	78.1 Å²	78.1	64%	0.641	44%	0.438	S	S	*	.	H	α-helix	trans	-78.2	-45.9	176.7	-57.2	173	0	0	0	110.8	S606 A611 L612	S606-I608 PolarHBondContact O-N 3.37Å; S606-I608 VanDerWaalsContact O-N 3.07Å; S606-I608 PolarHBondContact OG-N 3.45Å; I608-A611 PolarHBondContact O-N 2.93Å; I608-L612 HydrophobicContact CG2-CD1 4.16Å; I608-L612 WeakPolarHBondContact O-CG 3.45Å; I608-L612 PolarHBondContact O-N 2.94Å
609	T	85.7	Confident	83.1	Confident	16 Å²	16	76.7 Å²	76.7	10%	0.098	43%	0.431	C	S	.	.	H	α-helix	trans	-66.8	-39.5	177	50.7	0	0	0	0	110.7	L599 G603 S606 A611 L612 I613	L599-T609 HydrophobicContact CD2-CG2 4.18Å; G603-T609 PolarHBondContact O-OG1 3.45Å; S606-T609 WeakPolarHBondContact CB-OG1 3.3Å; S606-T609 PolarHBondContact O-N 2.8Å; S606-T609 VanDerWaalsContact O-N 3.17Å; S606-T609 PolarHBondContact O-OG1 2.96Å; T609-A611 PolarHBondContact O-N 3.02Å; T609-L612 PolarHBondContact O-N 3.47Å; T609-I613 WeakPolarHBondContact O-CB 3.22Å; T609-I613 WeakPolarHBondContact O-CD1 3.23Å; T609-I613 WeakPolarHBondContact O-CG1 3.38Å; T609-I613 PolarHBondContact O-N 3.35Å
610	A	86.1	Confident	82.9	Confident	46 Å²	46	79.2 Å²	79.2	38%	0.38	44%	0.441	S	S	.	.	H	α-helix	trans	-59.3	-43.4	173.7	0	0	0	0	0	112.6	S606 Q614	S606-A610 PolarHBondContact O-N 3.44Å; A610-Q614 WeakPolarHBondContact O-CB 3.36Å; A610-Q614 PolarHBondContact O-N 3.27Å
611	A	86	Confident	82.2	Confident	53 Å²	53	81.9 Å²	81.9	44%	0.438	46%	0.458	S	S	.	.	H	α-helix	trans	-65.7	-42	176.1	0	0	0	0	0	112.7	G607 I608 T609 Q614 E615	G607-A611 WeakPolarHBondContact O-CB 3.49Å; G607-A611 PolarHBondContact O-N 2.93Å; I608-A611 PolarHBondContact O-N 2.93Å; T609-A611 PolarHBondContact O-N 3.02Å; A611-Q614 PolarHBondContact O-N 3.47Å; A611-E615 PolarHBondContact O-N 2.85Å
612	L	87.5	Confident	81.3	Confident	74 Å²	74	78.6 Å²	78.6	39%	0.387	45%	0.451	S	S	.	.	H	α-helix	trans	-66.3	-40.1	176.4	-70.2	170.5	0	0	0	112.2	L599 I608 T609 Q614 E615 L616	L599-L612 HydrophobicContact CD1-CB 3.73Å; L599-L612 HydrophobicContact CD2-CB 4.34Å; L599-L612 HydrophobicContact CD2-CD1 4.03Å; I608-L612 HydrophobicContact CG2-CD1 4.16Å; I608-L612 WeakPolarHBondContact O-CG 3.45Å; I608-L612 PolarHBondContact O-N 2.94Å; T609-L612 PolarHBondContact O-N 3.47Å; L612-Q614 VanDerWaalsContact C-N 3.34Å; L612-E615 PolarHBondContact O-N 3.41Å; L612-L616 WeakPolarHBondContact O-CB 3.36Å; L612-L616 WeakPolarHBondContact O-CG 3.23Å; L612-L616 PolarHBondContact O-N 2.89Å
613	I	88	Confident	80.6	Confident	15 Å²	15	73.5 Å²	73.5	8%	0.077	43%	0.425	C	S	.	.	H	α-helix	trans	-60.5	-45.2	172.6	-70.5	161.9	0	0	0	109.8	I596 L599 K600 T609 E615 L616 E617	I596-I613 HydrophobicContact CG2-CG2 4.31Å; L599-I613 HydrophobicContact CB-CD1 3.96Å; L599-I613 HydrophobicContact CB-CG1 3.69Å; L599-I613 HydrophobicContact CD1-CG1 4.04Å; K600-I613 HydrophobicContact CG-CD1 3.64Å; K600-I613 HydrophobicContact CG-CG1 4.5Å; T609-I613 WeakPolarHBondContact O-CB 3.22Å; T609-I613 WeakPolarHBondContact O-CD1 3.23Å; T609-I613 WeakPolarHBondContact O-CG1 3.38Å; T609-I613 PolarHBondContact O-N 3.35Å; I613-E615 VanDerWaalsContact C-N 3.33Å; I613-E615 PolarHBondContact O-N 3.41Å; I613-L616 PolarHBondContact O-N 2.92Å; I613-E617 HydrophobicContact CG2-CG 4.26Å; I613-E617 WeakPolarHBondContact CG2-OE1 3.13Å; I613-E617 WeakPolarHBondContact O-CB 3.41Å; I613-E617 WeakPolarHBondContact O-CG 3.26Å; I613-E617 PolarHBondContact O-N 3.21Å
614	Q	87	Confident	79.7	Confident	144 Å²	144	77.5 Å²	77.5	67%	0.673	44%	0.438	S	S	*	.	H	α-helix	trans	-62.9	-37.4	177.5	-170.2	177.8	14.8	0	0	112.5	A610 A611 L612 A618	A610-Q614 WeakPolarHBondContact O-CB 3.36Å; A610-Q614 PolarHBondContact O-N 3.27Å; A611-Q614 PolarHBondContact O-N 3.47Å; L612-Q614 VanDerWaalsContact C-N 3.34Å; Q614-A618 VanDerWaalsContact O-CB 3.27Å; Q614-A618 WeakPolarHBondContact O-CB 3.25Å; Q614-A618 PolarHBondContact O-N 2.83Å
615	E	87.6	Confident	79	Confident	140 Å²	140	74.1 Å²	74.1	65%	0.654	42%	0.422	S	S	*	.	H	α-helix	trans	-69.3	-40.8	175.5	-173.7	165	-160.9	0	0	112.2	A611 L612 I613 A618 S619	A611-E615 PolarHBondContact O-N 2.85Å; L612-E615 PolarHBondContact O-N 3.41Å; I613-E615 VanDerWaalsContact C-N 3.33Å; I613-E615 PolarHBondContact O-N 3.41Å; E615-A618 CarbonylContact O-C 3.6Å; E615-A618 PolarHBondContact O-N 3.49Å; E615-S619 PolarHBondContact O-N 2.78Å
616	L	88.5	Confident	78.2	Confident	25 Å²	25	72 Å²	72	13%	0.131	40%	0.403	C	S	.	.	H	α-helix	trans	-67.9	-41.5	175.1	-72.4	170.2	0	0	0	112.4	I592 E595 I596 L599 L612 I613 A618 S619 K620	I592-L616 HydrophobicContact CG2-CB 4.23Å; E595-L616 HydrophobicContact CB-CD1 4.04Å; E595-L616 HydrophobicContact CG-CD1 3.71Å; I596-L616 HydrophobicContact CD1-CB 3.98Å; I596-L616 HydrophobicContact CG1-CB 3.69Å; I596-L616 HydrophobicContact CG1-CD1 4Å; L599-L616 HydrophobicContact CD1-CD1 3.5Å; L599-L616 VanDerWaalsContact CD1-CD1 3.5Å; L612-L616 WeakPolarHBondContact O-CB 3.36Å; L612-L616 WeakPolarHBondContact O-CG 3.23Å; L612-L616 PolarHBondContact O-N 2.89Å; I613-L616 PolarHBondContact O-N 2.92Å; L616-A618 VanDerWaalsContact C-N 3.33Å; L616-A618 PolarHBondContact O-N 2.88Å; L616-S619 WeakPolarHBondContact O-CA 3.4Å; L616-S619 WeakPolarHBondContact O-CB 3.47Å; L616-S619 PolarHBondContact O-N 3.36Å; L616-S619 PolarHBondContact O-OG 2.96Å; L616-K620 PolarHBondContact O-N 3.43Å
617	E	86.4	Confident	76.9	Confident	88 Å²	88	73.9 Å²	73.9	41%	0.411	41%	0.41	S	S	.	.	H	α-helix	trans	-64.1	-38.1	173.7	-71.9	177.7	179.1	0	0	110.8	I596 K600 I613 S619 K620 L621	I596-E617 HydrophobicContact CD1-CG 3.73Å; K600-E617 IonicContact NZ-OE1 3.6Å; K600-E617 PolarHBondContact NZ-OE1 2.95Å; I613-E617 HydrophobicContact CG2-CG 4.26Å; I613-E617 WeakPolarHBondContact CG2-OE1 3.13Å; I613-E617 WeakPolarHBondContact O-CB 3.41Å; I613-E617 WeakPolarHBondContact O-CG 3.26Å; I613-E617 PolarHBondContact O-N 3.21Å; E617-S619 VanDerWaalsContact C-N 3.32Å; E617-S619 PolarHBondContact O-N 3.35Å; E617-K620 WeakPolarHBondContact O-CB 3.47Å; E617-K620 PolarHBondContact O-N 3.48Å; E617-L621 PolarHBondContact O-N 3.3Å
618	A	84.1	Confident	75.5	Confident	45 Å²	45	74.9 Å²	74.9	37%	0.372	40%	0.4	S	S	.	.	H	α-helix	trans	-67.2	-29.2	170	0	0	0	0	0	113.4	Q614 E615 L616 H622	Q614-A618 VanDerWaalsContact O-CB 3.27Å; Q614-A618 WeakPolarHBondContact O-CB 3.25Å; Q614-A618 PolarHBondContact O-N 2.83Å; E615-A618 CarbonylContact O-C 3.6Å; E615-A618 PolarHBondContact O-N 3.49Å; L616-A618 VanDerWaalsContact C-N 3.33Å; L616-A618 PolarHBondContact O-N 2.88Å; A618-H622 PolarHBondContact O-N 2.6Å; A618-H622 PolarHBondContact O-ND1 3.27Å
619	S	81.1	Confident	74.1	Confident	37 Å²	37	70.1 Å²	70.1	26%	0.259	38%	0.376	S	S	.	.	H	α-helix	trans	-69.5	-35.3	172.4	90.8	0	0	0	0	111.8	E615 L616 E617 L621 H622 V623	E615-S619 PolarHBondContact O-N 2.78Å; L616-S619 WeakPolarHBondContact O-CA 3.4Å; L616-S619 WeakPolarHBondContact O-CB 3.47Å; L616-S619 PolarHBondContact O-N 3.36Å; L616-S619 PolarHBondContact O-OG 2.96Å; E617-S619 VanDerWaalsContact C-N 3.32Å; E617-S619 PolarHBondContact O-N 3.35Å; S619-L621 VanDerWaalsContact C-N 3.29Å; S619-L621 PolarHBondContact O-N 3.34Å; S619-H622 CarbonylContact O-C 3.59Å; S619-H622 WeakPolarHBondContact O-CA 3.17Å; S619-H622 WeakPolarHBondContact O-CB 3.3Å; S619-H622 PolarHBondContact O-N 3.36Å; S619-V623 PolarHBondContact O-N 3.31Å
620	K	82.5	Confident	72.6	Confident	73 Å²	73	72.5 Å²	72.5	32%	0.317	39%	0.392	S	S	.	.	H	α-helix	trans	-59.6	-39.5	177.3	-162.1	171.1	-174.6	168.5	0	111.8	L589 D593 L616 E617 H622 V623 H624	L589-K620 HydrophobicContact CD2-CG 3.69Å; D593-K620 IonicContact OD1-NZ 3.63Å; D593-K620 PolarHBondContact OD1-NZ 2.99Å; D593-K620 IonicContact OD2-NZ 3.58Å; D593-K620 PolarHBondContact OD2-NZ 3.31Å; L616-K620 PolarHBondContact O-N 3.43Å; E617-K620 WeakPolarHBondContact O-CB 3.47Å; E617-K620 PolarHBondContact O-N 3.48Å; K620-H622 VanDerWaalsContact C-N 3.35Å; K620-V623 PolarHBondContact O-N 3.24Å; K620-H624 PolarHBondContact O-N 2.97Å
621	L	72.3	Confident	71.2	Confident	133 Å²	133	75.1 Å²	75.1	70%	0.696	40%	0.398	S	S	*	.	H	α-helix	trans	-63	-38.9	171.8	-61.3	175.9	0	0	0	112.3	E617 S619 H624 E625	E617-L621 PolarHBondContact O-N 3.3Å; S619-L621 VanDerWaalsContact C-N 3.29Å; S619-L621 PolarHBondContact O-N 3.34Å; L621-H624 WeakPolarHBondContact O-CB 3.47Å; L621-H624 PolarHBondContact O-N 3.49Å; L621-H624 VanDerWaalsContact O-N 3.16Å; L621-E625 PolarHBondContact O-N 3.43Å
622	H	65	Low	70	Confident	107 Å²	107	74.8 Å²	74.8	50%	0.495	39%	0.393	S	S	.	.	H	α-helix	trans	-73.1	-25.5	177.3	-76.1	91.1	0	0	0	114	A618 S619 K620 H624 E625	A618-H622 PolarHBondContact O-N 2.6Å; A618-H622 PolarHBondContact O-ND1 3.27Å; S619-H622 CarbonylContact O-C 3.59Å; S619-H622 WeakPolarHBondContact O-CA 3.17Å; S619-H622 WeakPolarHBondContact O-CB 3.3Å; S619-H622 PolarHBondContact O-N 3.36Å; K620-H622 VanDerWaalsContact C-N 3.35Å; H622-H624 PolarHBondContact O-N 3.17Å; H622-E625 PolarHBondContact O-N 2.8Å
623	V	63.3	Low	68.5	Low	32 Å²	32	72.6 Å²	72.6	19%	0.194	39%	0.385	C	S	.	.	H	α-helix	trans	-68.9	-25.6	168.6	175.5	0	0	0	0	111.2	L585 L589 I592 S619 K620	L585-V623 HydrophobicContact CD1-CG1 4.42Å; L585-V623 HydrophobicContact CD2-CG1 4.01Å; L585-V623 HydrophobicContact CG-CG1 3.81Å; L589-V623 HydrophobicContact CD2-CB 4.09Å; L589-V623 HydrophobicContact CD2-CG1 3.75Å; L589-V623 HydrophobicContact CG-CG1 4.05Å; I592-V623 HydrophobicContact CD1-CG2 3.77Å; S619-V623 PolarHBondContact O-N 3.31Å; K620-V623 PolarHBondContact O-N 3.24Å
624	H	55.9	Low	67.2	Low	106 Å²	106	76.3 Å²	76.3	49%	0.491	41%	0.413	S	S	.	.	H	α-helix	trans	-80.4	-21.1	175.9	-127	-116.8	0	0	0	113.9	R581 K620 L621 H622 T626	R581-H624 VanDerWaalsContact CZ-NE2 3.28Å; R581-H624 PolarHBondContact NH1-CD2 2.87Å; R581-H624 PolarHBondContact NH2-CE1 2.7Å; R581-H624 PolarHBondContact NH2-NE2 3.38Å; K620-H624 PolarHBondContact O-N 2.97Å; L621-H624 WeakPolarHBondContact O-CB 3.47Å; L621-H624 PolarHBondContact O-N 3.49Å; L621-H624 VanDerWaalsContact O-N 3.16Å; H622-H624 PolarHBondContact O-N 3.17Å; H624-T626 VanDerWaalsContact C-N 3.33Å; H624-T626 PolarHBondContact O-N 3.3Å
625	E	54.2	Low	65.7	Low	62 Å²	62	78.5 Å²	78.5	29%	0.29	42%	0.415	S	S	.	.	S	Bend	trans	-68.9	87.8	168.5	-174.2	178.9	-108.7	0	0	108.9	L621 H622 D627 K646 R651	L621-E625 PolarHBondContact O-N 3.43Å; H622-E625 PolarHBondContact O-N 2.8Å; E625-D627 PolarHBondContact O-N 3.12Å; E625-K646 WeakPolarHBondContact OE1-CE 3.27Å; E625-K646 IonicContact OE1-NZ 3.21Å; E625-K646 PolarHBondContact OE1-NZ 3.07Å; E625-K646 IonicContact OE2-NZ 2.72Å; E625-K646 PolarHBondContact OE2-NZ 2.97Å; E625-R651 IonicContact OE2-CZ 3.54Å; E625-R651 IonicContact OE2-NH2 3.63Å; E625-R651 PolarHBondContact OE2-NH2 2.85Å
626	T	54.8	Low	64	Low	77 Å²	77	75.5 Å²	75.5	47%	0.472	41%	0.41	S	S	.	.			trans	-53.7	134.8	175.9	44.9	0	0	0	0	109.8	H624 L628	H624-T626 VanDerWaalsContact C-N 3.33Å; H624-T626 PolarHBondContact O-N 3.3Å; T626-L628 PolarHBondContact O-N 3.02Å
627	D	53.9	Low	61.7	Low	91 Å²	91	80.7 Å²	80.7	49%	0.487	44%	0.444	S	S	.	.			trans	-77.8	54.5	-167.8	-124.8	-34.6	0	0	0	111.8	E625 D629 R651 Y654	E625-D627 PolarHBondContact O-N 3.12Å; D627-D629 PolarHBondContact O-N 3.07Å; D627-R651 IonicContact OD1-CZ 2.73Å; D627-R651 IonicContact OD1-NH1 2.67Å; D627-R651 PolarHBondContact OD1-NH1 3.1Å; D627-R651 IonicContact OD2-NH1 3.65Å; D627-R651 PolarHBondContact OD2-NH1 3.06Å; D627-R651 VanDerWaalsContact OD2-NH1 3.12Å; D627-Y654 VanDerWaalsContact CB-OH 3.26Å; D627-Y654 WeakPolarHBondContact CB-OH 3.39Å; D627-Y654 PolarHBondContact O-OH 3.14Å; D627-Y654 PolarHBondContact OD1-OH 2.92Å
628	L	52.3	Low	59.9	Low	84 Å²	84	80.9 Å²	80.9	44%	0.44	45%	0.448	S	S	.	.			trans	-61.3	113.7	-178.5	-68.4	176.1	0	0	0	109.6	T626 A633	T626-L628 PolarHBondContact O-N 3.02Å; L628-A633 HydrophobicContact CB-CB 4.47Å
629	D	54.4	Low	58.5	Low	24 Å²	24	83.3 Å²	83.3	13%	0.128	47%	0.468	C	S	.	.			trans	-53.6	135.8	167.4	-170.2	36.2	0	0	0	109.5	R547 D627 I631 S632 A633 Y654	R547-D629 IonicContact CZ-OD1 2.7Å; R547-D629 IonicContact CZ-OD2 3.07Å; R547-D629 IonicContact NH1-OD1 2.81Å; R547-D629 PolarHBondContact NH1-OD1 3.39Å; R547-D629 IonicContact NH1-OD2 2.76Å; R547-D629 PolarHBondContact NH1-OD2 3.4Å; R547-D629 IonicContact NH2-OD1 3.21Å; R547-D629 PolarHBondContact NH2-OD1 3.09Å; R547-D629 IonicContact NH2-OD2 3.22Å; D627-D629 PolarHBondContact O-N 3.07Å; D629-I631 PolarHBondContact O-N 2.82Å; D629-I631 WeakPolarHBondContact OD2-CB 3.13Å; D629-S632 PolarHBondContact N-OG 3.05Å; D629-S632 PolarHBondContact O-N 2.7Å; D629-S632 PolarHBondContact O-OG 2.81Å; D629-A633 PolarHBondContact O-N 3.02Å; D629-Y654 HydrophobicContact CB-CD1 4.37Å; D629-Y654 HydrophobicContact CB-CE1 4.07Å; D629-Y654 VanDerWaalsContact OD1-CD1 3.3Å; D629-Y654 WeakPolarHBondContact OD1-CD1 3.42Å
630	P	54.1	Low	57.5	Low	66 Å²	66	88.7 Å²	88.7	43%	0.429	49%	0.494	S	S	.	.	H	α-helix	trans	-54	-19	175.7	15.4	-30.7	0	0	0	114.2	S634	P630-S634 WeakPolarHBondContact O-CB 3.39Å; P630-S634 PolarHBondContact O-N 3.14Å; P630-S634 PolarHBondContact O-OG 2.94Å
631	I	57.2	Low	56.2	Low	101 Å²	101	89.8 Å²	89.8	52%	0.518	51%	0.507	S	S	.	.	H	α-helix	trans	-77.6	-36.4	171.7	-62.3	172.2	0	0	0	112.7	D629 S634 R635	D629-I631 PolarHBondContact O-N 2.82Å; D629-I631 WeakPolarHBondContact OD2-CB 3.13Å; I631-S634 PolarHBondContact O-OG 3.17Å; I631-R635 WeakPolarHBondContact O-CD 3.28Å; I631-R635 WeakPolarHBondContact O-CG 3.46Å
632	S	59	Low	55.3	Low	46 Å²	46	91.3 Å²	91.3	32%	0.322	51%	0.51	S	S	.	.	H	α-helix	trans	-78.6	-36.7	173.7	60.7	0	0	0	0	111.5	D629 S634 R635 S636	D629-S632 PolarHBondContact N-OG 3.05Å; D629-S632 PolarHBondContact O-N 2.7Å; D629-S632 PolarHBondContact O-OG 2.81Å; S632-S634 VanDerWaalsContact C-N 3.28Å; S632-S634 PolarHBondContact O-N 3.43Å; S632-R635 WeakPolarHBondContact O-CA 3.4Å; S632-R635 WeakPolarHBondContact O-CB 3.24Å; S632-R635 PolarHBondContact O-N 3.34Å; S632-S636 PolarHBondContact O-N 3.22Å
633	A	57.9	Low	54.6	Low	29 Å²	29	88.5 Å²	88.5	24%	0.24	50%	0.502	C	S	.	.	H	α-helix	trans	-57	-40.7	170.5	0	0	0	0	0	111.8	L628 D629 R635 P643	L628-A633 HydrophobicContact CB-CB 4.47Å; D629-A633 PolarHBondContact O-N 3.02Å; A633-R635 PolarHBondContact O-N 2.92Å; A633-R635 VanDerWaalsContact O-N 3.17Å; A633-P643 HydrophobicContact CB-CG 4.19Å
634	S	59.1	Low	54.1	Low	93 Å²	93	89.9 Å²	89.9	65%	0.65	52%	0.522	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.8	4.3	174.2	69.9	0	0	0	0	115	P630 I631 S632	P630-S634 WeakPolarHBondContact O-CB 3.39Å; P630-S634 PolarHBondContact O-N 3.14Å; P630-S634 PolarHBondContact O-OG 2.94Å; I631-S634 PolarHBondContact O-OG 3.17Å; S632-S634 VanDerWaalsContact C-N 3.28Å; S632-S634 PolarHBondContact O-N 3.43Å
635	R	56.5	Low	53.7	Low	189 Å²	189	93.8 Å²	93.8	71%	0.713	53%	0.534	S	S	*	.	T	Hydrogen-bonded Turn	trans	-119.9	-4.5	-177.4	-80.1	175.8	163.3	-106.1	-4.1	114.1	I631 S632 A633 P637	I631-R635 WeakPolarHBondContact O-CD 3.28Å; I631-R635 WeakPolarHBondContact O-CG 3.46Å; S632-R635 WeakPolarHBondContact O-CA 3.4Å; S632-R635 WeakPolarHBondContact O-CB 3.24Å; S632-R635 PolarHBondContact O-N 3.34Å; A633-R635 PolarHBondContact O-N 2.92Å; A633-R635 VanDerWaalsContact O-N 3.17Å; R635-P637 WeakPolarHBondContact O-CD 3.32Å
636	S	51.7	Low	53.7	Low	78 Å²	78	94.9 Å²	94.9	55%	0.545	54%	0.538	S	S	.	.			trans	-89.9	109.8	176.7	-67.1	0	0	0	0	110.6	S632 N638	S632-S636 PolarHBondContact O-N 3.22Å; S636-N638 PolarHBondContact O-N 3.03Å
637	P	41	Very low	53.6	Low	133 Å²	133	94.9 Å²	94.9	86%	0.864	54%	0.538	S	S	*	.			trans	-81.2	26	-175.2	35.7	-38.1	0	0	0	113.7	R635 A639	R635-P637 WeakPolarHBondContact O-CD 3.32Å; P637-A639 PolarHBondContact O-N 3.39Å
638	N	47.1	Very low	53.4	Low	92 Å²	92	97.8 Å²	97.8	49%	0.492	54%	0.542	S	S	.	.			trans	-87.2	91.6	-178.8	-173.1	4.5	0	0	0	110.7	S636 N640 V641	S636-N638 PolarHBondContact O-N 3.03Å; N638-N640 PolarHBondContact O-N 3.11Å; N638-N640 PolarHBondContact OD1-N 3.06Å; N638-V641 PolarHBondContact O-N 3.43Å
639	A	56	Low	53.4	Low	96 Å²	96	102.4 Å²	102.4	79%	0.793	56%	0.555	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.2	-10.9	-179.2	0	0	0	0	0	114.8	P637	P637-A639 PolarHBondContact O-N 3.39Å
640	N	60.1	Low	53.5	Low	150 Å²	150	110.8 Å²	110.8	80%	0.802	58%	0.584	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.4	-0.4	-177.3	-62.3	-3.4	0	0	0	113.9	N638	N638-N640 PolarHBondContact O-N 3.11Å; N638-N640 PolarHBondContact OD1-N 3.06Å
641	V	54.4	Low	53.3	Low	96 Å²	96	111.5 Å²	111.5	58%	0.582	58%	0.579	S	S	*	*			trans	-140.1	104.7	-178.8	-175.8	0	0	0	0	110.9	N638 P643	N638-V641 PolarHBondContact O-N 3.43Å; V641-P643 WeakPolarHBondContact O-CD 3.46Å
642	E	52.5	Low	53.2	Low	165 Å²	165	114.2 Å²	114.2	77%	0.771	59%	0.589	S	S	*	*			trans	-76.7	123.3	170.3	-67.4	-165.3	161.3	0	0	111.1
643	P	50.5	Low	53.1	Low	49 Å²	49	115.2 Å²	115.2	32%	0.318	61%	0.606	S	S	.	*			trans	-76	129.2	174.4	30.2	-32.7	0	0	0	110.9	A633 V641 Y645	A633-P643 HydrophobicContact CB-CG 4.19Å; V641-P643 WeakPolarHBondContact O-CD 3.46Å; P643-Y645 PolarHBondContact O-N 2.93Å; P643-Y645 VanDerWaalsContact O-N 3.07Å
644	G	53	Low	52.9	Low	60 Å²	60	116.2 Å²	116.2	62%	0.619	60%	0.604	S	S	*	*			trans	-56.5	110.5	-175	0	0	0	0	0	114.3	K646	G644-K646 PolarHBondContact O-N 3.07Å
645	Y	47.8	Very low	52.6	Low	189 Å²	189	114.6 Å²	114.6	74%	0.741	59%	0.59	S	S	*	*			trans	-70.4	81.8	-173.3	-62.4	-72.1	0	0	0	114.3	P643	P643-Y645 PolarHBondContact O-N 2.93Å; P643-Y645 VanDerWaalsContact O-N 3.07Å
646	K	55.1	Low	52.1	Low	85 Å²	85	109.6 Å²	109.6	37%	0.37	58%	0.584	S	S	.	*			trans	-82	125.9	165	-73.6	165.8	-179.8	164.1	0	109.4	E625 G644	E625-K646 WeakPolarHBondContact OE1-CE 3.27Å; E625-K646 IonicContact OE1-NZ 3.21Å; E625-K646 PolarHBondContact OE1-NZ 3.07Å; E625-K646 IonicContact OE2-NZ 2.72Å; E625-K646 PolarHBondContact OE2-NZ 2.97Å; G644-K646 PolarHBondContact O-N 3.07Å
647	T	53	Low	51.9	Low	76 Å²	76	111 Å²	111	47%	0.466	59%	0.592	S	S	.	*			trans	-61.9	148	-174.7	60.1	0	0	0	0	111.9	Y649 R650	T647-Y649 PolarHBondContact O-N 3.45Å; T647-R650 WeakPolarHBondContact O-CB 3.31Å; T647-R650 PolarHBondContact O-N 3.04Å
648	R	49.6	Very low	52.4	Low	152 Å²	152	110 Å²	110	57%	0.574	59%	0.587	S	S	*	*	T	Hydrogen-bonded Turn	trans	-52.8	-27.1	179.3	-174.2	-177.4	-69.1	173.3	-1	113.5	T655	R648-T655 HydrophobicContact CG-CG2 4.16Å
649	Y	51.3	Low	52.4	Low	181 Å²	181	115.6 Å²	115.6	71%	0.71	60%	0.602	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.5	-10.1	179.2	-54.8	-67.2	0	0	0	114.3	T647	T647-Y649 PolarHBondContact O-N 3.45Å
650	R	55.9	Low	51.6	Low	200 Å²	200	117.6 Å²	117.6	76%	0.755	60%	0.599	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.7	-20	-178.8	-113.5	-179.9	176.1	173.4	-1.8	114.7	T647	T647-R650 WeakPolarHBondContact O-CB 3.31Å; T647-R650 PolarHBondContact O-N 3.04Å
651	R	50.5	Low	50.7	Low	82 Å²	82	117 Å²	117	31%	0.309	60%	0.601	S	S	.	*			trans	-124.9	99.2	175	-72.5	-170.5	178	-127	-1.4	110.6	E625 D627 G653 Y654	E625-R651 IonicContact OE2-CZ 3.54Å; E625-R651 IonicContact OE2-NH2 3.63Å; E625-R651 PolarHBondContact OE2-NH2 2.85Å; D627-R651 IonicContact OD1-CZ 2.73Å; D627-R651 IonicContact OD1-NH1 2.67Å; D627-R651 PolarHBondContact OD1-NH1 3.1Å; D627-R651 IonicContact OD2-NH1 3.65Å; D627-R651 PolarHBondContact OD2-NH1 3.06Å; D627-R651 VanDerWaalsContact OD2-NH1 3.12Å; R651-G653 PolarHBondContact O-N 3.21Å; R651-G653 VanDerWaalsContact O-N 3.1Å; R651-Y654 HydrophobicContact CB-CD2 3.96Å; R651-Y654 HydrophobicContact CB-CE2 4.5Å; R651-Y654 PolarHBondContact O-N 3.19Å
652	H	54.3	Low	50	Low	158 Å²	158	122.4 Å²	122.4	73%	0.731	61%	0.611	S	S	*	*	G	3₁₀ helix	trans	-60.4	-20.1	-175.1	-71.8	-68.7	0	0	0	115.6	Y654 T655	H652-Y654 PolarHBondContact O-N 2.92Å; H652-Y654 VanDerWaalsContact O-N 3.12Å; H652-T655 PolarHBondContact O-OG1 3.28Å
653	G	57.3	Low	49.3	Very low	66 Å²	66	125.5 Å²	125.5	68%	0.68	62%	0.616	S	S	*	*	G	3₁₀ helix	trans	-62.8	-16.5	177.4	0	0	0	0	0	115	R651	R651-G653 PolarHBondContact O-N 3.21Å; R651-G653 VanDerWaalsContact O-N 3.1Å
654	Y	53.7	Low	48.6	Very low	51 Å²	51	129.5 Å²	129.5	20%	0.2	63%	0.634	C	S	.	*	G	3₁₀ helix	trans	-108.3	-5.6	-170.6	-66.4	-95.4	0	0	0	113.9	R547 D627 D629 R651 H652	R547-Y654 VanDerWaalsContact NH2-CE1 3.27Å; D627-Y654 VanDerWaalsContact CB-OH 3.26Å; D627-Y654 WeakPolarHBondContact CB-OH 3.39Å; D627-Y654 PolarHBondContact O-OH 3.14Å; D627-Y654 PolarHBondContact OD1-OH 2.92Å; D629-Y654 HydrophobicContact CB-CD1 4.37Å; D629-Y654 HydrophobicContact CB-CE1 4.07Å; D629-Y654 VanDerWaalsContact OD1-CD1 3.3Å; D629-Y654 WeakPolarHBondContact OD1-CD1 3.42Å; R651-Y654 HydrophobicContact CB-CD2 3.96Å; R651-Y654 HydrophobicContact CB-CE2 4.5Å; R651-Y654 PolarHBondContact O-N 3.19Å; H652-Y654 PolarHBondContact O-N 2.92Å; H652-Y654 VanDerWaalsContact O-N 3.12Å
655	T	53.8	Low	47.7	Very low	59 Å²	59	137.5 Å²	137.5	36%	0.362	65%	0.646	S	S	.	*	S	Bend	trans	-78.2	138.3	-178.7	30.2	0	0	0	0	113.4	R648 H652	R648-T655 HydrophobicContact CG-CG2 4.16Å; H652-T655 PolarHBondContact O-OG1 3.28Å
656	S	45.3	Very low	47.1	Very low	84 Å²	84	140 Å²	140	59%	0.587	65%	0.654	S	S	*	*			trans	-63.9	137.4	179.2	-46.6	0	0	0	0	111.7	S658	S656-S658 PolarHBondContact O-N 3.5Å
657	P	48.7	Very low	46.1	Very low	108 Å²	108	141.4 Å²	141.4	70%	0.701	67%	0.674	S	S	*	*	S	Bend	trans	-63.4	5.1	-171.7	-26.3	35.6	0	0	0	118.3	R659	P657-R659 VanDerWaalsContact C-N 3.32Å; P657-R659 PolarHBondContact O-N 3.32Å
658	S	51.4	Low	45	Very low	110 Å²	110	140.7 Å²	140.7	77%	0.769	68%	0.683	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.9	7.7	-166.5	-47.1	0	0	0	0	115.3	S656	S656-S658 PolarHBondContact O-N 3.5Å
659	R	46.7	Very low	44.4	Very low	211 Å²	211	142.7 Å²	142.7	80%	0.796	70%	0.698	S	S	*	*	T	Hydrogen-bonded Turn	trans	-121.4	-1.4	-176.4	-81.2	-169.9	66	158.2	-2.4	116.3	P657 T661	P657-R659 VanDerWaalsContact C-N 3.32Å; P657-R659 PolarHBondContact O-N 3.32Å; R659-T661 PolarHBondContact O-N 2.93Å
660	D	37.9	Very low	43.6	Very low	138 Å²	138	142.3 Å²	142.3	74%	0.738	71%	0.708	S	S	*	*			trans	-77.8	69.4	173.7	-70.6	-33.1	0	0	0	111.9	R662	D660-R662 PolarHBondContact O-N 2.58Å
661	T	41.6	Very low	42.4	Very low	138 Å²	138	141.3 Å²	141.3	85%	0.847	72%	0.717	S	S	*	*			trans	-75.6	-6.6	166.7	52.4	0	0	0	0	112.6	R659	R659-T661 PolarHBondContact O-N 2.93Å
662	R	39.5	Very low	41.6	Very low	209 Å²	209	142.9 Å²	142.9	79%	0.789	74%	0.741	S	S	*	*			trans	-102.4	74.6	167.6	-66.9	-170.7	-179.4	-171.3	0.6	110.9	D660 D664	D660-R662 PolarHBondContact O-N 2.58Å; R662-D664 PolarHBondContact O-N 3.12Å; R662-D664 VanDerWaalsContact O-N 3.07Å
663	R	38.4	Very low	40.6	Very low	229 Å²	229	145 Å²	145	86%	0.864	74%	0.743	S	S	*	*			trans	-79.9	78.8	163.1	-173.2	175.7	-67.3	-162.2	-3.4	108.6
664	D	37.1	Very low	39.4	Very low	133 Å²	133	151.9 Å²	151.9	71%	0.711	75%	0.749	S	S	*	*			trans	-60.8	136.3	179.2	-90.7	-61.8	0	0	0	111.8	R662 R666	R662-D664 PolarHBondContact O-N 3.12Å; R662-D664 VanDerWaalsContact O-N 3.07Å; D664-R666 PolarHBondContact O-N 2.87Å
665	R	33.7	Very low	38.4	Very low	229 Å²	229	155.1 Å²	155.1	86%	0.864	77%	0.769	S	S	*	*			trans	-93	92.6	178.5	-80.7	178.5	164.2	178.7	-5.3	109.8
666	R	34.2	Very low	37.4	Very low	241 Å²	241	159.9 Å²	159.9	91%	0.909	79%	0.787	S	S	*	*			trans	176.7	143.3	159.9	-89.5	141.2	-138.6	-107.5	11.9	105.8	D664	D664-R666 PolarHBondContact O-N 2.87Å
667	S	35.1	Very low	36.7	Very low	114 Å²	114	166.3 Å²	166.3	80%	0.797	80%	0.8	S	S	*	*			cis	-150.5	172.5	0.4	-163.1	0	0	0	0	110
668	G	30.1	Very low	36	Very low	62 Å²	62	166.1 Å²	166.1	64%	0.639	80%	0.801	S	S	*	*			trans	107.1	26.2	138.9	0	0	0	0	0	122
669	H	37	Very low	35.2	Very low	193 Å²	193	166.3 Å²	166.3	89%	0.894	80%	0.803	S	S	*	*			trans	-127.3	125.7	160.4	-68.9	-48.7	0	0	0	111.3
670	N	33.8	Very low	35.1	Very low	174 Å²	174	163 Å²	163	93%	0.93	81%	0.806	S	S	*	*			trans	-80.8	156	-169.4	-83.6	-39.9	0	0	0	113.9
671	L	30.9	Very low	34.8	Very low	178 Å²	178	160 Å²	160	93%	0.932	81%	0.808	S	S	*	*			trans	-96.2	120.9	-177.4	-83.6	147.3	0	0	0	112.5
672	S	33.3	Very low	34.4	Very low	116 Å²	116	157 Å²	157	81%	0.811	80%	0.804	S	S	*	*			trans	-168	126.6	155.5	-171.2	0	0	0	0	104.9
673	Y	33.2	Very low	34.1	Very low	201 Å²	201	158.7 Å²	158.7	79%	0.788	81%	0.81	S	S	*	*			cis	-157.4	119	25.1	170.4	-78.7	0	0	0	104.4
674	R	32.8	Very low	34.1	Very low	211 Å²	211	153.9 Å²	153.9	80%	0.796	81%	0.812	S	S	*	*			cis	72.9	117.5	47.6	-171.4	167.8	-176.7	158.2	2.8	114.8
675	L	33.2	Very low	34	Very low	120 Å²	120	150.7 Å²	150.7	63%	0.628	81%	0.81	S	S	*	*			trans	66.9	144.5	177	-99.8	69.2	0	0	0	114
676	E	31.7	Very low	34.2	Very low	158 Å²	158	146.7 Å²	146.7	74%	0.738	81%	0.811	S	S	*	*			cis	-126.5	151.4	0.8	-57.2	-174.6	137	0	0	108.9
677	Y	31.6	Very low	34.2	Very low	220 Å²	220	141.9 Å²	141.9	86%	0.863	80%	0.802	S	S	*	*				-150.2	145.7	76.2	-112.8	-103.5	0	0	0	111.9
678	S	32.2	Very low	34.3	Very low	103 Å²	103	142.6 Å²	142.6	72%	0.72	80%	0.804	S	S	*	*			trans	-112.4	165.4	169.3	-63.4	0	0	0	0	110.4
679	S	36.1	Very low	34.4	Very low	115 Å²	115	143.1 Å²	143.1	80%	0.804	80%	0.798	S	S	*	*			trans	68.7	128.7	166	-51.7	0	0	0	0	115.4
680	T	43.4	Very low	34.1	Very low	142 Å²	142	143.1 Å²	143.1	87%	0.871	80%	0.796	S	S	*	*			cis	-143	170.6	4.4	60.8	0	0	0	0	108.7
681	G	32.8	Very low	34.2	Very low	74 Å²	74	140.2 Å²	140.2	76%	0.763	79%	0.786	S	S	*	*			cis	149.5	151.4	-6.7	0	0	0	0	0	112.5
682	G	32.8	Very low	34.4	Very low	74 Å²	74	136.3 Å²	136.3	76%	0.763	77%	0.774	S	S	*	*			trans	100.1	145.6	-178.5	0	0	0	0	0	114.3
683	R	33.7	Very low	34.7	Very low	245 Å²	245	137.2 Å²	137.2	93%	0.925	78%	0.775	S	S	*	*			cis	-171.7	166.7	-25.5	-122	173.4	-169.8	-143.1	3.7	106.3
684	S	37.5	Very low	34.8	Very low	128 Å²	128	133.5 Å²	133.5	90%	0.895	78%	0.775	S	S	*	*			trans	74.8	118	178.3	-51.5	0	0	0	0	115.5
685	G	35.5	Very low	34.7	Very low	66 Å²	66	134.7 Å²	134.7	68%	0.68	78%	0.78	S	S	*	*			cis	-162.4	158.7	-0.4	0	0	0	0	0	116.6
686	T	37.8	Very low	35	Very low	145 Å²	145	134.8 Å²	134.8	89%	0.89	79%	0.787	S	S	*	*			trans	51.5	94.7	157	50.4	0	0	0	0	119
687	I	33.9	Very low	34.9	Very low	141 Å²	141	130 Å²	130	72%	0.723	78%	0.78	S	S	*	*			trans	-58	161.5	141.8	-16.4	176.3	0	0	0	109.5
688	P	36.2	Very low	35.2	Very low	128 Å²	128	129.9 Å²	129.9	83%	0.831	78%	0.78	S	S	*	*				-135.9	159	88.7	32.9	-17.8	0	0	0	114.9
689	S	33.4	Very low	35.4	Very low	73 Å²	73	130.8 Å²	130.8	51%	0.51	78%	0.781	S	S	.	*			trans	-99.7	-176.8	-179.2	-55.9	0	0	0	0	111.9
690	F	30.3	Very low	35.6	Very low	194 Å²	194	130.7 Å²	130.7	85%	0.851	78%	0.781	S	S	*	*			trans	83.1	156.5	167.8	-43.3	-63.7	0	0	0	114.4
691	P	35.4	Very low	35.2	Very low	112 Å²	112	127 Å²	127	73%	0.727	77%	0.771	S	S	*	*				-135	-137.4	-93.3	34.6	-11.7	0	0	0	111.4
692	S	36.6	Very low	35.5	Very low	97 Å²	97	130.7 Å²	130.7	68%	0.678	77%	0.772	S	S	*	*			trans	76	117.1	168.3	69.6	0	0	0	0	118.9
693	T	38.2	Very low	35.8	Very low	135 Å²	135	134.5 Å²	134.5	83%	0.828	77%	0.774	S	S	*	*			trans	65	140.1	144.8	49.5	0	0	0	0	121.4
694	P	35.4	Very low	36	Very low	122 Å²	122	133.2 Å²	133.2	79%	0.792	77%	0.77	S	S	*	*			trans	-103.8	-163.2	-175.3	43.4	-38.9	0	0	0	113.9
695	R	31.8	Very low	36	Very low	236 Å²	236	130.5 Å²	130.5	89%	0.891	76%	0.762	S	S	*	*			trans	94.4	163.9	160.6	-105.5	-164.7	170.3	175.2	-2.1	116.6
696	P	38.2	Very low	36.1	Very low	122 Å²	122	138.7 Å²	138.7	79%	0.792	77%	0.773	S	S	*	*				-136	-178.1	-118.1	42.8	-23.6	0	0	0	115.8
697	G	31	Very low	36	Very low	57 Å²	57	135.9 Å²	135.9	59%	0.588	76%	0.764	S	S	*	*			trans	177.4	162.2	165.8	0	0	0	0	0	114.6
698	Y	36.2	Very low	36.2	Very low	218 Å²	218	135.1 Å²	135.1	86%	0.855	77%	0.766	S	S	*	*			trans	61.7	101.9	173.8	-51	-75.9	0	0	0	115.1
699	T	37.3	Very low	36.3	Very low	122 Å²	122	133.3 Å²	133.3	75%	0.748	76%	0.756	S	S	*	*				62.3	139	50.1	88	0	0	0	0	112.7
700	S	39.4	Very low	36.2	Very low	113 Å²	113	137.7 Å²	137.7	79%	0.79	77%	0.773	S	S	*	*			cis	-155.8	165.8	26.5	-52.8	0	0	0	0	113.1
701	G	36.2	Very low	36.6	Very low	65 Å²	65	134.2 Å²	134.2	67%	0.67	77%	0.77	S	S	*	*			trans	122.3	94.3	167.3	0	0	0	0	0	114.6
702	I	38.2	Very low	36.4	Very low	151 Å²	151	140.2 Å²	140.2	77%	0.774	78%	0.778	S	S	*	*				68.8	114.1	63.7	-53.9	163.8	0	0	0	109.9
703	L	39.2	Very low	36.5	Very low	154 Å²	154	140.8 Å²	140.8	81%	0.806	78%	0.779	S	S	*	*			cis	-128.1	134.1	27.1	-67.1	162.9	0	0	0	111.8
704	Y	38.2	Very low	36.2	Very low	219 Å²	219	143.8 Å²	143.8	86%	0.859	78%	0.781	S	S	*	*				77.9	119.5	77.1	-100.7	-78.6	0	0	0	117.3
705	G	38.2	Very low	36	Very low	70 Å²	70	144.9 Å²	144.9	72%	0.722	78%	0.779	S	S	*	*			trans	-159.4	-10.3	-175.7	0	0	0	0	0	120.8
706	R	38.2	Very low	36.2	Very low	239 Å²	239	136.8 Å²	136.8	90%	0.902	77%	0.769	S	S	*	*			trans	60	161.7	176.7	-68.2	-179.6	164.1	105.9	-3.5	116.5
707	A	34.5	Very low	36	Very low	85 Å²	85	136.7 Å²	136.7	70%	0.702	77%	0.766	S	S	*	*			cis	-163.7	150.6	-34.4	0	0	0	0	0	105.7
708	V	39.1	Very low	36.4	Very low	126 Å²	126	141.8 Å²	141.8	76%	0.764	77%	0.774	S	S	*	*				175	99.6	86.9	158.5	0	0	0	0	105.4
709	S	36.6	Very low	36.3	Very low	89 Å²	89	138.3 Å²	138.3	62%	0.622	77%	0.77	S	S	*	*				52	107.6	115.9	66.7	0	0	0	0	117.5
710	L	33.1	Very low	36.5	Very low	166 Å²	166	135.7 Å²	135.7	87%	0.869	77%	0.768	S	S	*	*				89.2	160.8	83.7	-80.4	170.4	0	0	0	113.4
711	P	37.2	Very low	36.3	Very low	120 Å²	120	137.7 Å²	137.7	78%	0.779	77%	0.77	S	S	*	*			cis	-129.2	-165.9	-8.9	36.6	-16.4	0	0	0	114.2
712	R	31.3	Very low	36.5	Very low	239 Å²	239	141.1 Å²	141.1	90%	0.902	78%	0.778	S	S	*	*			trans	-154.8	169.7	171.8	-153.1	-170	-171	-154.1	3.9	108.9
713	P	39.4	Very low	36.4	Very low	109 Å²	109	141.5 Å²	141.5	71%	0.708	78%	0.781	S	S	*	*				-102.3	-174.7	-75.8	38.9	-26.7	0	0	0	112.9
714	F	32.5	Very low	36.3	Very low	198 Å²	198	142 Å²	142	87%	0.868	78%	0.783	S	S	*	*			trans	-144.7	174.2	160.1	-137.6	-99.9	0	0	0	113.5
715	I	30.8	Very low	36.2	Very low	144 Å²	144	136.9 Å²	136.9	74%	0.738	77%	0.771	S	S	*	*			trans	-93.8	151	-154.9	-66.5	152.1	0	0	0	115	V717	I715-V717 HydrophobicContact CG2-CG2 4.26Å
716	G	35.2	Very low	36.3	Very low	66 Å²	66	142 Å²	142	68%	0.68	78%	0.776	S	S	*	*			trans	-175.1	105	168.1	0	0	0	0	0	108.3
717	V	35.3	Very low	36	Very low	121 Å²	121	135.1 Å²	135.1	73%	0.733	76%	0.764	S	S	*	*				43.7	127.3	75.2	-127.1	0	0	0	0	111.9	I715	I715-V717 HydrophobicContact CG2-CG2 4.26Å
718	E	38.4	Very low	36	Very low	163 Å²	163	137 Å²	137	76%	0.762	77%	0.767	S	S	*	*			cis	-153.7	149	36	-77.3	169.9	-151.2	0	0	116
719	N	35.1	Very low	35.9	Very low	145 Å²	145	138.4 Å²	138.4	78%	0.775	77%	0.77	S	S	*	*			trans	49.3	151.5	132.4	-49.3	-26.6	0	0	0	125.6
720	G	39.8	Very low	35.8	Very low	68 Å²	68	139.8 Å²	139.8	70%	0.701	78%	0.779	S	S	*	*			trans	110.4	103.1	169.1	0	0	0	0	0	113.8
721	D	36.6	Very low	35.9	Very low	154 Å²	154	135 Å²	135	82%	0.824	77%	0.77	S	S	*	*			cis	89.9	94.8	42.9	-67.4	-38.6	0	0	0	116.1
722	T	40.5	Very low	35.9	Very low	138 Å²	138	138 Å²	138	85%	0.847	77%	0.773	S	S	*	*			trans	177.1	123.6	134.1	25	0	0	0	0	106.9
723	L	34.9	Very low	36.3	Very low	159 Å²	159	132.8 Å²	132.8	83%	0.832	77%	0.768	S	S	*	*				68.9	101	50.8	-82.3	174.6	0	0	0	116.1
724	L	38.7	Very low	36.3	Very low	163 Å²	163	133.3 Å²	133.3	85%	0.853	77%	0.771	S	S	*	*			trans	173.7	103.9	133.5	-89.4	156.7	0	0	0	106.1
725	D	34.8	Very low	36.4	Very low	112 Å²	112	130.7 Å²	130.7	60%	0.599	77%	0.771	S	S	*	*				80.3	97.4	64.2	-174.5	45.8	0	0	0	114.1
726	Q	39.6	Very low	36.5	Very low	179 Å²	179	127.7 Å²	127.7	84%	0.836	77%	0.767	S	S	*	*				-168.6	154.8	109.1	-105	158.2	54.3	0	0	112.5
727	S	32.6	Very low	36.3	Very low	93 Å²	93	129.9 Å²	129.9	65%	0.65	77%	0.772	S	S	*	*			trans	-125.2	-175.9	-170.3	61	0	0	0	0	111.8
728	T	35.2	Very low	36.2	Very low	124 Å²	124	130 Å²	130	76%	0.761	78%	0.779	S	S	*	*			trans	77.4	148.9	175.2	80.5	0	0	0	0	115.4
729	L	35.7	Very low	36	Very low	157 Å²	157	125.6 Å²	125.6	82%	0.822	78%	0.777	S	S	*	*			cis	-129.3	168.4	4.5	-99.4	105.5	0	0	0	113.6
730	S	35.6	Very low	36.1	Very low	118 Å²	118	126.1 Å²	126.1	83%	0.825	78%	0.778	S	S	*	*			trans	-43.4	164.3	157.7	-42.6	0	0	0	0	114.9
731	G	35	Very low	36	Very low	65 Å²	65	134.7 Å²	134.7	67%	0.67	79%	0.789	S	S	*	*			cis	160.8	-172.8	1.4	0	0	0	0	0	111.9
732	H	37.5	Very low	36.1	Very low	184 Å²	184	130.7 Å²	130.7	85%	0.852	78%	0.784	S	S	*	*			trans	64.3	102.7	172	-76.8	-90.1	0	0	0	120.7
733	V	38.6	Very low	36	Very low	129 Å²	129	129.6 Å²	129.6	78%	0.782	78%	0.782	S	S	*	*				38.2	129.5	115.9	-175.7	0	0	0	0	119.2
734	P	41.1	Very low	36.2	Very low	120 Å²	120	129 Å²	129	78%	0.779	78%	0.779	S	S	*	*			trans	-94.5	160.4	-166.6	38.3	-38.3	0	0	0	116.2
735	V	34.3	Very low	36.2	Very low	143 Å²	143	125.8 Å²	125.8	87%	0.867	77%	0.77	S	S	*	*			trans	-165.8	148.8	149.3	124.1	0	0	0	0	112.8
736	A	31.3	Very low	36.4	Very low	80 Å²	80	125.9 Å²	125.9	66%	0.661	78%	0.775	S	S	*	*			trans	40.5	111.7	158.1	0	0	0	0	0	123.5
737	S	31.5	Very low	36.4	Very low	112 Å²	112	123 Å²	123	78%	0.783	77%	0.769	S	S	*	*				70.7	143	112.6	-50.4	0	0	0	0	124.4
738	S	33.1	Very low	36.6	Very low	124 Å²	124	124.6 Å²	124.6	87%	0.867	77%	0.77	S	S	*	*			trans	96.5	113.5	141.6	-59.8	0	0	0	0	121.8
739	G	34.7	Very low	36.6	Very low	70 Å²	70	129.1 Å²	129.1	72%	0.722	77%	0.773	S	S	*	*			trans	115.8	164.1	135.1	0	0	0	0	0	118
740	I	38.3	Very low	36.6	Very low	156 Å²	156	127.1 Å²	127.1	80%	0.8	77%	0.768	S	S	*	*			cis	-161.3	164.8	-7.4	-99.7	145.4	0	0	0	107.8
741	R	37.2	Very low	36.7	Very low	249 Å²	249	129.2 Å²	129.2	94%	0.94	77%	0.768	S	S	*	*			trans	105	124	171.3	-57.5	177.4	-162.2	-128.2	-0.8	114.8
742	G	37.6	Very low	36.9	Very low	69 Å²	69	131.3 Å²	131.3	71%	0.711	77%	0.77	S	S	*	*			cis	170.5	157.2	-12	0	0	0	0	0	114.9
743	S	39.3	Very low	36.9	Very low	116 Å²	116	128.3 Å²	128.3	81%	0.811	77%	0.769	S	S	*	*			trans	68.5	142.1	165.6	-60.2	0	0	0	0	118.9
744	L	39	Very low	36.8	Very low	146 Å²	146	133.1 Å²	133.1	76%	0.764	77%	0.774	S	S	*	*			cis	-158.3	139.8	-10.3	-108.2	167.5	0	0	0	109.7
745	S	38.6	Very low	36.8	Very low	95 Å²	95	134.9 Å²	134.9	66%	0.664	77%	0.771	S	S	*	*			trans	39	148.1	141.8	-57.4	0	0	0	0	122.9
746	T	38.2	Very low	36.6	Very low	115 Å²	115	132.5 Å²	132.5	71%	0.706	76%	0.761	S	S	*	*			cis	-163.4	153	8.6	1.9	0	0	0	0	112.6
747	T	39.3	Very low	36.7	Very low	117 Å²	117	138.5 Å²	138.5	72%	0.718	77%	0.768	S	S	*	*			trans	61	146.9	150.4	58.3	0	0	0	0	121.7
748	L	38.1	Very low	37	Very low	128 Å²	128	141.4 Å²	141.4	67%	0.67	77%	0.769	S	S	*	*			cis	-166.9	124	-18.9	-106.9	174	0	0	0	110.6
749	R	34.8	Very low	37.3	Very low	218 Å²	218	141.4 Å²	141.4	82%	0.823	77%	0.766	S	S	*	*			trans	60.3	163.8	157.7	-41.8	-178.3	-179.8	-179.5	1.6	116.8
750	T	35.7	Very low	37.3	Very low	115 Å²	115	141.9 Å²	141.9	71%	0.706	77%	0.771	S	S	*	*			cis	-153.8	140.5	6	-27.5	0	0	0	0	111.7
751	I	38.5	Very low	37.1	Very low	162 Å²	162	137.2 Å²	137.2	83%	0.831	76%	0.761	S	S	*	*			trans	66.2	153.7	155	-81.2	164.6	0	0	0	118.6
752	P	38.9	Very low	37.1	Very low	109 Å²	109	134.8 Å²	134.8	71%	0.708	76%	0.76	S	S	*	*			trans	-123.6	-173.5	-153.8	43.5	-29.4	0	0	0	116.9
753	S	37.3	Very low	37	Very low	121 Å²	121	136.8 Å²	136.8	85%	0.846	76%	0.763	S	S	*	*			trans	87	118	163.6	-61.5	0	0	0	0	118.5
754	R	36.6	Very low	36.8	Very low	231 Å²	231	138.2 Å²	138.2	87%	0.872	76%	0.762	S	S	*	*			trans	-123.4	166.1	-176.1	-74.8	-178.8	155.1	-159.4	-2.4	108.9
755	H	40	Very low	36.8	Very low	157 Å²	157	140.5 Å²	140.5	73%	0.727	77%	0.768	S	S	*	*			cis	-153.5	163	-12.5	-135.7	-76.2	0	0	0	108.8
756	S	30.2	Very low	36.7	Very low	93 Å²	93	141.6 Å²	141.6	65%	0.65	78%	0.776	S	S	*	*			trans	-116	140.8	159	-70.5	0	0	0	0	111.3
757	Y	34	Very low	36.7	Very low	206 Å²	206	139.2 Å²	139.2	81%	0.808	77%	0.774	S	S	*	*			trans	47.1	149.3	140.1	-80.9	-93.1	0	0	0	125.4
758	H	37.3	Very low	36.6	Very low	172 Å²	172	142.5 Å²	142.5	80%	0.796	78%	0.781	S	S	*	*			trans	84.1	140.4	153.4	-74.7	-62.8	0	0	0	122.5
759	P	40	Very low	36.5	Very low	124 Å²	124	140.5 Å²	140.5	81%	0.805	78%	0.784	S	S	*	*			trans	-121.1	170.8	176.7	43.5	-33.4	0	0	0	115.4
760	G	33.6	Very low	36.8	Very low	81 Å²	81	137.6 Å²	137.6	84%	0.835	78%	0.783	S	S	*	*			trans	150.8	144.4	151.8	0	0	0	0	0	117.8
761	G	34.9	Very low	37	Very low	58 Å²	58	139.9 Å²	139.9	60%	0.598	79%	0.791	S	S	*	*			trans	115.5	104.9	144.3	0	0	0	0	0	121.1
762	H	37.7	Very low	36.9	Very low	198 Å²	198	135.5 Å²	135.5	92%	0.917	79%	0.786	S	S	*	*			trans	58.7	167.4	142.2	-44.8	-71.3	0	0	0	119.5
763	S	35	Very low	37.3	Very low	110 Å²	110	136.1 Å²	136.1	77%	0.769	79%	0.79	S	S	*	*			cis	-143.3	-177.9	1.8	55.8	0	0	0	0	112.1
764	N	34.8	Very low	37.3	Very low	147 Å²	147	135.9 Å²	135.9	79%	0.786	78%	0.779	S	S	*	*			trans	-89.1	168.1	-172.3	-43.4	-48.4	0	0	0	114.3
765	H	39	Very low	37.3	Very low	193 Å²	193	134.2 Å²	134.2	89%	0.894	77%	0.773	S	S	*	*			trans	-162.7	176.4	130.2	-99.4	-62.8	0	0	0	111.3
766	S	37	Very low	36.9	Very low	118 Å²	118	132.1 Å²	132.1	83%	0.825	77%	0.771	S	S	*	*			trans	-139	158.4	-154.1	52.7	0	0	0	0	114.9
767	G	38.7	Very low	36.9	Very low	66 Å²	66	133.5 Å²	133.5	68%	0.68	78%	0.775	S	S	*	*			trans	-177.1	135.7	169.5	0	0	0	0	0	114.3
768	E	35.6	Very low	36.9	Very low	185 Å²	185	130.3 Å²	130.3	86%	0.864	78%	0.777	S	S	*	*			trans	-49	150.6	-179.4	-66.7	112.5	126.6	0	0	116.3
769	A	36.7	Very low	36.6	Very low	87 Å²	87	127.5 Å²	127.5	72%	0.719	77%	0.772	S	S	*	*			cis	81.4	129.5	38.5	0	0	0	0	0	115.4
770	I	41.2	Very low	36.1	Very low	157 Å²	157	126.2 Å²	126.2	81%	0.805	77%	0.766	S	S	*	*			trans	179.9	130.4	156.7	-95	149.2	0	0	0	109.9
771	N	39.6	Very low	36.3	Very low	162 Å²	162	130.8 Å²	130.8	87%	0.866	77%	0.766	S	S	*	*			trans	30.9	146.5	155.3	-51.6	-17.1	0	0	0	122.4
772	G	36.6	Very low	36.1	Very low	71 Å²	71	132.9 Å²	132.9	73%	0.732	77%	0.771	S	S	*	*			cis	-176	177.3	2.1	0	0	0	0	0	112.8
773	P	47	Very low	36	Very low	121 Å²	121	131 Å²	131	79%	0.786	77%	0.767	S	S	*	*			trans	-115	-154.4	-162.9	43.8	-34.8	0	0	0	115.6
774	D	37.3	Very low	35.7	Very low	117 Å²	117	132.6 Å²	132.6	63%	0.626	77%	0.767	S	S	*	*			trans	83	147.9	174.2	-72	-14.8	0	0	0	117.1
775	R	36.4	Very low	35.6	Very low	196 Å²	196	132.5 Å²	132.5	74%	0.74	77%	0.772	S	S	*	*			cis	-162.7	150	-7.7	-121	173.1	-142.4	-167.1	18.8	115.7
776	T	32.4	Very low	35.2	Very low	113 Å²	113	129.9 Å²	129.9	69%	0.693	77%	0.765	S	S	*	*			trans	40.5	125	144.4	54.3	0	0	0	0	125.6
777	V	29.9	Very low	34.9	Very low	121 Å²	121	133.6 Å²	133.6	73%	0.733	77%	0.766	S	S	*	*				53.6	114.5	121.8	-173.3	0	0	0	0	121.5
778	T	34.7	Very low	34.7	Very low	139 Å²	139	137.5 Å²	137.5	85%	0.853	77%	0.77	S	S	*	*				-175.7	164.7	123.8	29.2	0	0	0	0	107.4
779	V	31.2	Very low	34.6	Very low	113 Å²	113	136.8 Å²	136.8	69%	0.685	77%	0.767	S	S	*	*			cis	163.5	130.4	-33.3	146.5	0	0	0	0	105.4
780	S	29.8	Very low	34.4	Very low	97 Å²	97	139.1 Å²	139.1	68%	0.678	77%	0.767	S	S	*	*			trans	66.7	161.5	162.4	61.7	0	0	0	0	122.6
781	E	36.5	Very low	34	Very low	177 Å²	177	140 Å²	140	83%	0.827	77%	0.768	S	S	*	*			trans	74.7	128.6	165.5	-67.7	164	-161.7	0	0	118.2
782	S	32	Very low	33.9	Very low	103 Å²	103	138.3 Å²	138.3	72%	0.72	77%	0.769	S	S	*	*			cis	121.6	149.7	2.3	-75.1	0	0	0	0	111.7
783	L	34.3	Very low	33.8	Very low	158 Å²	158	146.4 Å²	146.4	83%	0.827	78%	0.777	S	S	*	*			trans	74.1	127.4	179.7	-45.7	176.9	0	0	0	113.3
784	N	30	Very low	33.5	Very low	144 Å²	144	146.2 Å²	146.2	77%	0.77	78%	0.776	S	S	*	*				68.3	113.7	53	-75.9	-3.2	0	0	0	114.7
785	T	32.1	Very low	33.3	Very low	145 Å²	145	148.4 Å²	148.4	89%	0.89	79%	0.786	S	S	*	*				-175	160.6	116.5	22.6	0	0	0	0	111.7
786	N	31.4	Very low	33.1	Very low	138 Å²	138	141.8 Å²	141.8	74%	0.738	78%	0.779	S	S	*	*			trans	-91	163	165.3	-43.1	-69.5	0	0	0	109.2
787	F	30.3	Very low	33.2	Very low	195 Å²	195	145.3 Å²	145.3	86%	0.855	79%	0.785	S	S	*	*				-177.9	178.2	106.4	-106.4	-75.3	0	0	0	113.3
788	I	32.9	Very low	33.6	Very low	149 Å²	149	147.4 Å²	147.4	76%	0.764	79%	0.786	S	S	*	*			trans	-102	152.1	-174.5	-64.1	154.7	0	0	0	109
789	E	33.6	Very low	33.6	Very low	169 Å²	169	147.9 Å²	147.9	79%	0.79	78%	0.784	S	S	*	*			trans	174.9	156	149	-99.9	-178.1	-140.8	0	0	108.7
790	N	33.7	Very low	34	Very low	137 Å²	137	145 Å²	145	73%	0.733	78%	0.777	S	S	*	*			cis	-153.4	173	-4.3	-133.3	-33.4	0	0	0	111
791	E	31.6	Very low	34.4	Very low	174 Å²	174	149.4 Å²	149.4	81%	0.813	79%	0.792	S	S	*	*			trans	-86.4	160.3	-177.2	-59.1	-170.4	136.4	0	0	116
792	S	37.7	Very low	34.3	Very low	128 Å²	128	144.5 Å²	144.5	90%	0.895	79%	0.788	S	S	*	*			trans	-157.8	166.5	147.4	-22.9	0	0	0	0	112.7
793	R	34.7	Very low	34.4	Very low	241 Å²	241	144.9 Å²	144.9	91%	0.909	79%	0.791	S	S	*	*			trans	-125.7	171.8	-163.7	-100.2	-170.8	169.4	-166.2	-2.4	115.8
794	P	40	Very low	34.3	Very low	116 Å²	116	144.7 Å²	144.7	75%	0.753	79%	0.79	S	S	*	*			trans	-111.5	-178.3	-155.9	43.8	-39.8	0	0	0	117.9
795	I	34	Very low	34.6	Very low	164 Å²	164	144.2 Å²	144.2	84%	0.841	79%	0.792	S	S	*	*			trans	-145.6	151.8	169.6	-58	174.6	0	0	0	106.3	F797	I795-F797 HydrophobicContact CG2-CE2 4.47Å
796	G	31.9	Very low	34.7	Very low	57 Å²	57	143.1 Å²	143.1	59%	0.588	79%	0.786	S	S	*	*			cis	165.9	178.6	-2.6	0	0	0	0	0	111.1
797	F	35.3	Very low	34.9	Very low	187 Å²	187	142.4 Å²	142.4	82%	0.82	79%	0.791	S	S	*	*			trans	70.6	126.6	-179.8	-49.5	-77.7	0	0	0	115.5	I795	I795-F797 HydrophobicContact CG2-CE2 4.47Å
798	H	37	Very low	35.1	Very low	165 Å²	165	136.9 Å²	136.9	76%	0.764	79%	0.789	S	S	*	*			cis	69.3	131.3	49.5	-69.1	-85.4	0	0	0	113.4
799	D	36.5	Very low	35	Very low	149 Å²	149	138.7 Å²	138.7	80%	0.797	80%	0.8	S	S	*	*			cis	-161.3	-178.7	-5.2	-124.8	-42.6	0	0	0	108.5
800	G	37.9	Very low	34.9	Very low	52 Å²	52	135.9 Å²	135.9	54%	0.536	80%	0.799	S	S	.	*			cis	166	160.9	0.2	0	0	0	0	0	112.9
801	L	38.7	Very low	35.1	Very low	190 Å²	190	136.7 Å²	136.7	100%	0.995	80%	0.8	S	S	*	*			trans	66.8	144.4	172.5	-49.5	172.4	0	0	0	118.1
802	G	34.2	Very low	35.3	Very low	73 Å²	73	135.1 Å²	135.1	75%	0.753	80%	0.797	S	S	*	*			cis	173.2	165.7	-10.3	0	0	0	0	0	115.2
803	S	34.6	Very low	35	Very low	112 Å²	112	132.3 Å²	132.3	78%	0.783	79%	0.788	S	S	*	*			trans	78.8	97.7	161.3	-137.7	0	0	0	0	123.1
804	L	31.5	Very low	34.8	Very low	154 Å²	154	130 Å²	130	81%	0.806	79%	0.785	S	S	*	*				40.7	118.1	124.1	-57.1	169.6	0	0	0	122
805	T	36	Very low	34.6	Very low	133 Å²	133	132.6 Å²	132.6	82%	0.816	79%	0.789	S	S	*	*				-170.6	106.1	108.7	35	0	0	0	0	113.9
806	T	35.2	Very low	34.5	Very low	122 Å²	122	129.1 Å²	129.1	75%	0.748	79%	0.785	S	S	*	*			trans	27.3	132.1	134.2	60.7	0	0	0	0	123.5
807	S	35	Very low	34.5	Very low	123 Å²	123	135.6 Å²	135.6	86%	0.86	80%	0.8	S	S	*	*			trans	97.4	124.9	139.5	-58.1	0	0	0	0	121.3
808	G	34.4	Very low	34.6	Very low	79 Å²	79	132 Å²	132	81%	0.814	80%	0.798	S	S	*	*			trans	102.8	85.9	143.6	0	0	0	0	0	117.7
809	L	31.1	Very low	34.5	Very low	187 Å²	187	127.4 Å²	127.4	98%	0.979	80%	0.795	S	S	*	*			trans	-76.5	124.9	175.8	-67.1	172.2	0	0	0	113
810	S	32.7	Very low	34.7	Very low	111 Å²	111	128.4 Å²	128.4	78%	0.776	80%	0.801	S	S	*	*			trans	-161.6	172.7	164.6	-157.2	0	0	0	0	109.7
811	M	37.2	Very low	34.5	Very low	154 Å²	154	133.3 Å²	133.3	76%	0.759	82%	0.815	S	S	*	*			trans	80.8	138.6	-159.6	-51.3	-89.5	82.4	0	0	112.6
812	D	36.1	Very low	34.4	Very low	141 Å²	141	132 Å²	132	75%	0.754	81%	0.807	S	S	*	*			cis	78.7	97.9	32	-65.1	-45	0	0	0	115.9
813	G	31.5	Very low	34.2	Very low	68 Å²	68	134.4 Å²	134.4	70%	0.701	81%	0.807	S	S	*	*				77	124.7	126.3	0	0	0	0	0	122.5
814	F	30.7	Very low	34.2	Very low	194 Å²	194	136.7 Å²	136.7	85%	0.851	81%	0.809	S	S	*	*			trans	77.7	170.1	147.3	-79.9	-88.3	0	0	0	120.4
815	M	34.4	Very low	34.4	Very low	170 Å²	170	135.5 Å²	135.5	84%	0.837	81%	0.809	S	S	*	*			trans	74.5	120.6	-171.5	-44.3	-46.1	167	0	0	114
816	A	31.8	Very low	34	Very low	91 Å²	91	134.8 Å²	134.8	75%	0.752	81%	0.809	S	S	*	*			cis	87.8	85.9	6.4	0	0	0	0	0	118
817	E	33.9	Very low	34.3	Very low	192 Å²	192	134.9 Å²	134.9	90%	0.897	81%	0.811	S	S	*	*			trans	-166.9	160.9	164.6	-100.6	166.2	-163.8	0	0	106.3
818	S	35.8	Very low	34.2	Very low	111 Å²	111	137.8 Å²	137.8	78%	0.776	81%	0.811	S	S	*	*			cis	-173.3	147.5	-32.7	51.8	0	0	0	0	108.9
819	G	35.2	Very low	34.3	Very low	69 Å²	69	141.8 Å²	141.8	71%	0.711	81%	0.814	S	S	*	*			trans	87.4	153.7	176.9	0	0	0	0	0	115.1
820	D	40.1	Very low	34.4	Very low	171 Å²	171	135.3 Å²	135.3	91%	0.914	79%	0.792	S	S	*	*			cis	-142.7	161.9	-0.8	-76.3	-38.1	0	0	0	111.8
821	D	34	Very low	34.4	Very low	155 Å²	155	140.9 Å²	140.9	83%	0.829	80%	0.798	S	S	*	*			trans	-83.3	135.4	-173	-70.5	-65.5	0	0	0	115.5
822	I	37.3	Very low	34.1	Very low	163 Å²	163	142.9 Å²	142.9	84%	0.836	80%	0.803	S	S	*	*			trans	-139.9	109.3	147.1	-55.8	-177.6	0	0	0	110.3
823	T	30.1	Very low	34	Very low	123 Å²	123	143 Å²	143	76%	0.755	80%	0.803	S	S	*	*			trans	-91.9	130.4	172.5	50.2	0	0	0	0	112.7
824	I	34.4	Very low	34.1	Very low	160 Å²	160	148.6 Å²	148.6	82%	0.821	81%	0.807	S	S	*	*			trans	-133	138.1	159.6	-61.8	-175.9	0	0	0	110.1
825	T	36	Very low	34.1	Very low	129 Å²	129	145.3 Å²	145.3	79%	0.791	81%	0.809	S	S	*	*			trans	-90.5	149	-167.7	50.4	0	0	0	0	114.9
826	S	26.9	Very low	34.1	Very low	117 Å²	117	149 Å²	149	82%	0.818	81%	0.814	S	S	*	*			trans	-87.7	147.9	169	-46.1	0	0	0	0	113.3
827	P	42.4	Very low	34.3	Very low	124 Å²	124	150.9 Å²	150.9	81%	0.805	82%	0.816	S	S	*	*			trans	-104.7	151	159	35.7	-29	0	0	0	112.5
828	H	32	Very low	34.5	Very low	185 Å²	185	148.7 Å²	148.7	86%	0.856	82%	0.815	S	S	*	*			trans	-85.6	143	178.2	-76.9	-102.1	0	0	0	113.3
829	N	36.3	Very low	34.4	Very low	163 Å²	163	148 Å²	148	87%	0.872	82%	0.816	S	S	*	*			trans	-170.6	145.4	138.9	-98.6	-26.4	0	0	0	110.5
830	G	33.4	Very low	34.3	Very low	51 Å²	51	148.4 Å²	148.4	53%	0.526	82%	0.82	S	S	.	*			cis	153.7	35.7	-2.5	0	0	0	0	0	116.2
831	Y	33.4	Very low	34.1	Very low	228 Å²	228	148 Å²	148	89%	0.894	82%	0.817	S	S	*	*			trans	-126.9	149	-178.9	-66.9	-70	0	0	0	113.6
832	F	30.6	Very low	34.2	Very low	195 Å²	195	146.6 Å²	146.6	86%	0.855	82%	0.816	S	S	*	*			trans	-128.2	179.9	-156.8	-120.5	-94.6	0	0	0	111.9
833	L	34.3	Very low	34.1	Very low	144 Å²	144	143.6 Å²	143.6	75%	0.754	81%	0.81	S	S	*	*			trans	82.1	139.6	174.4	-49.1	164.6	0	0	0	114
834	K	33.1	Very low	34.3	Very low	185 Å²	185	143 Å²	143	80%	0.804	81%	0.811	S	S	*	*			cis	-152.2	114.1	0.5	-136.4	163.2	-176	168.7	0	110.7
835	S	30.9	Very low	34.3	Very low	126 Å²	126	141.3 Å²	141.3	88%	0.881	81%	0.807	S	S	*	*			trans	-83.6	137.4	170.8	-49.7	0	0	0	0	110.5
836	R	35	Very low	34.4	Very low	248 Å²	248	142.3 Å²	142.3	94%	0.936	81%	0.814	S	S	*	*			trans	-139.7	130.7	163.6	-159	176.2	-169.5	-173.6	2.5	110.8
837	T	35.8	Very low	34.7	Very low	130 Å²	130	140 Å²	140	80%	0.798	81%	0.809	S	S	*	*			trans	-76.8	135.7	-174.9	14.9	0	0	0	0	113.2
838	V	37.8	Very low	34.6	Very low	146 Å²	146	142 Å²	142	89%	0.885	81%	0.812	S	S	*	*			trans	-139.2	134	134.2	-172	0	0	0	0	106.7
839	A	34.3	Very low	34.9	Very low	97 Å²	97	144.3 Å²	144.3	80%	0.802	81%	0.813	S	S	*	*			trans	-101.7	143.1	175.5	0	0	0	0	0	110.3
840	G	33	Very low	35.1	Very low	76 Å²	76	141.8 Å²	141.8	78%	0.784	81%	0.805	S	S	*	*			trans	-166	81.9	-177.6	0	0	0	0	0	112.2
841	L	35	Very low	35.4	Very low	162 Å²	162	146.1 Å²	146.1	85%	0.848	82%	0.821	S	S	*	*	P	Polyproline II helix	trans	-76.2	134	171.8	-72.7	163.9	0	0	0	110.2	S843	L841-S843 PolarHBondContact O-N 3.49Å
842	P	35.6	Very low	35.5	Very low	127 Å²	127	138.1 Å²	138.1	83%	0.825	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-70.4	116.6	157.8	29.7	-30.5	0	0	0	108.5
843	S	36.4	Very low	35.8	Very low	99 Å²	99	135.3 Å²	135.3	69%	0.692	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-91.2	128.6	-170.5	47.6	0	0	0	0	113.4	L841	L841-S843 PolarHBondContact O-N 3.49Å
844	S	32.8	Very low	36	Very low	112 Å²	112	133.8 Å²	133.8	78%	0.783	80%	0.8	S	S	*	*			trans	64	164.1	158.3	73	0	0	0	0	116.2
845	V	36.3	Very low	36.2	Very low	123 Å²	123	130.5 Å²	130.5	75%	0.745	80%	0.797	S	S	*	*			cis	-130.9	125.2	14.5	174.7	0	0	0	0	111.4
846	T	37.8	Very low	36.4	Very low	150 Å²	150	133.7 Å²	133.7	92%	0.92	80%	0.798	S	S	*	*			trans	-80.3	125.4	153	37.8	0	0	0	0	108.8
847	G	33.4	Very low	36.3	Very low	70 Å²	70	130 Å²	130	72%	0.722	79%	0.791	S	S	*	*			trans	-161.1	63.5	-170.3	0	0	0	0	0	115.7
848	L	38.9	Very low	36.4	Very low	166 Å²	166	128 Å²	128	87%	0.869	78%	0.781	S	S	*	*			trans	-94.1	118.7	170.9	-79.5	170.7	0	0	0	111.5
849	R	38.8	Very low	36.2	Very low	233 Å²	233	130.6 Å²	130.6	88%	0.879	78%	0.776	S	S	*	*			trans	69.7	164.7	161.3	-65.3	-178.4	165.7	-170	-3.2	117.5
850	P	40.3	Very low	36.2	Very low	109 Å²	109	132.6 Å²	132.6	71%	0.708	77%	0.768	S	S	*	*			cis	-137.3	-160.4	-45.6	38.1	-19.4	0	0	0	112.2
851	V	40	Very low	36.1	Very low	143 Å²	143	134.8 Å²	134.8	87%	0.867	76%	0.758	S	S	*	*			trans	76.1	142	173.5	-163.2	0	0	0	0	114.8
852	G	35.6	Very low	36.2	Very low	59 Å²	59	135.4 Å²	135.4	61%	0.608	76%	0.756	S	S	*	*			cis	153.7	85.2	-15.7	0	0	0	0	0	117
853	L	36.9	Very low	36.2	Very low	136 Å²	136	135.8 Å²	135.8	71%	0.712	75%	0.746	S	S	*	*			trans	63.9	168.7	167.8	-95	69.6	0	0	0	117	M479	M479-L853 HydrophobicContact CE-CD2 3.68Å; M479-L853 HydrophobicContact SD-CD2 3.99Å
854	P	37.4	Very low	36.1	Very low	113 Å²	113	140.3 Å²	140.3	73%	0.734	75%	0.75	S	S	*	*			cis	-123.2	-171.5	-16	37.5	-18.7	0	0	0	112.5
855	P	38.1	Very low	36.3	Very low	115 Å²	115	143.5 Å²	143.5	75%	0.747	75%	0.749	S	S	*	*			trans	-109.2	164.8	-163.4	40.4	-34.3	0	0	0	117.1
856	H	35.5	Very low	36.2	Very low	193 Å²	193	142.5 Å²	142.5	89%	0.894	75%	0.748	S	S	*	*			trans	-145.1	124	162.9	-94.1	-84.7	0	0	0	112.9
857	H	31.9	Very low	36.3	Very low	170 Å²	170	141.1 Å²	141.1	79%	0.787	74%	0.744	S	S	*	*			trans	-82.4	168.8	145.1	-126.1	-122.5	0	0	0	107.2
858	P	38	Very low	36.4	Very low	90 Å²	90	143.1 Å²	143.1	58%	0.584	75%	0.748	S	S	*	*			cis	-153.2	-175.8	32.8	44.2	-23.5	0	0	0	118.8
859	Y	34	Very low	36.4	Very low	199 Å²	199	140.9 Å²	140.9	78%	0.78	75%	0.746	S	S	*	*			trans	64.8	164.7	152.3	-64.8	-46.3	0	0	0	119
860	H	34.9	Very low	36.4	Very low	140 Å²	140	134.2 Å²	134.2	65%	0.648	74%	0.74	S	S	*	*			cis	-149.2	160.5	-6	-141.5	-88.2	0	0	0	112.1
861	H	31.4	Very low	36.4	Very low	121 Å²	121	136 Å²	136	56%	0.56	74%	0.741	S	S	*	*			trans	11.7	143.7	160.4	-82.5	-145.9	0	0	0	124.7	H863	H861-H863 AromaticContact CE1-NE2 3.78Å; H861-H863 AromaticContact ND1-CD2 3.46Å; H861-H863 PolarHBondContact ND1-CD2 3.05Å; H861-H863 AromaticContact ND1-NE2 3.58Å
862	H	35.4	Very low	36.4	Very low	175 Å²	175	139.2 Å²	139.2	81%	0.81	74%	0.738	S	S	*	*				177	121.2	105.6	-96.2	-81.7	0	0	0	108.8
863	H	35.5	Very low	36.4	Very low	135 Å²	135	148 Å²	148	63%	0.625	75%	0.753	S	S	*	*				106	155.4	54.9	-108.3	-88.8	0	0	0	113.4	H861	H861-H863 AromaticContact CE1-NE2 3.78Å; H861-H863 AromaticContact ND1-CD2 3.46Å; H861-H863 PolarHBondContact ND1-CD2 3.05Å; H861-H863 AromaticContact ND1-NE2 3.58Å
864	Y	34.8	Very low	36.5	Very low	195 Å²	195	145.3 Å²	145.3	77%	0.765	76%	0.757	S	S	*	*			trans	77.6	131.7	-177	-61.9	-90.8	0	0	0	115.8
865	K	36.9	Very low	36.6	Very low	178 Å²	178	151.2 Å²	151.2	77%	0.774	77%	0.765	S	S	*	*			cis	-153.6	165.3	-5.1	-140.6	171.7	-165.4	170.5	0	112
866	S	35.6	Very low	36.5	Very low	103 Å²	103	151.5 Å²	151.5	72%	0.72	77%	0.765	S	S	*	*			trans	-27.1	155.4	175.5	-45.5	0	0	0	0	118.8
867	S	38.1	Very low	36.8	Very low	120 Å²	120	148.1 Å²	148.1	84%	0.839	76%	0.763	S	S	*	*				-153.3	176.9	53.8	-68.8	0	0	0	0	116.1
868	S	36.8	Very low	37	Very low	113 Å²	113	146.4 Å²	146.4	79%	0.79	77%	0.765	S	S	*	*			trans	-128.9	151.7	-154.6	-46.1	0	0	0	0	116.3
869	S	39	Very low	37.2	Very low	118 Å²	118	147.9 Å²	147.9	83%	0.825	77%	0.774	S	S	*	*			trans	-175.1	119.1	147	-80.4	0	0	0	0	108.3
870	A	39.3	Very low	37.5	Very low	93 Å²	93	142.9 Å²	142.9	77%	0.769	77%	0.774	S	S	*	*				74	132.9	77.5	0	0	0	0	0	113.9
871	M	39.7	Very low	37.7	Very low	147 Å²	147	142.5 Å²	142.5	72%	0.724	78%	0.784	S	S	*	*			cis	-165.8	147.4	-5.1	-120.6	-162.8	-165.3	0	0	113.1
872	R	39.4	Very low	38.1	Very low	211 Å²	211	141.1 Å²	141.1	80%	0.796	79%	0.794	S	S	*	*			trans	63.6	168.4	151.4	-63.8	176.3	-170.5	-111	0.8	119.7
873	R	36.6	Very low	38.2	Very low	244 Å²	244	139.8 Å²	139.8	92%	0.921	80%	0.798	S	S	*	*				-173.9	134.2	-56.1	-116	-172	-174	-166.9	3.6	111.7
874	G	38.4	Very low	38.2	Very low	79 Å²	79	137.4 Å²	137.4	81%	0.814	81%	0.81	S	S	*	*			trans	92.5	164.7	162.4	0	0	0	0	0	116.9
875	R	38.7	Very low	38.1	Very low	236 Å²	236	132 Å²	132	89%	0.891	81%	0.813	S	S	*	*			cis	-161.6	130.5	-5.9	-136.7	-168.7	-169.2	176.7	2.4	112.8
876	T	37	Very low	38.1	Very low	122 Å²	122	129.9 Å²	129.9	75%	0.748	82%	0.821	S	S	*	*			trans	25.4	130.8	145.3	56.8	0	0	0	0	123.8
877	S	41.5	Very low	38.1	Very low	121 Å²	121	128.7 Å²	128.7	85%	0.846	83%	0.825	S	S	*	*				-174.3	153.7	127	51.1	0	0	0	0	114.1
878	T	35.8	Very low	38	Very low	135 Å²	135	131.5 Å²	131.5	83%	0.828	83%	0.827	S	S	*	*			trans	-154.1	136.7	176.3	-38.2	0	0	0	0	110.7
879	P	41.6	Very low	37.6	Very low	121 Å²	121	129.1 Å²	129.1	79%	0.786	82%	0.82	S	S	*	*				-138.9	157.6	124.8	16.7	5.7	0	0	0	111.7
880	A	40.2	Very low	37.5	Very low	94 Å²	94	132.9 Å²	132.9	78%	0.777	82%	0.818	S	S	*	*			cis	105.1	143.4	34.9	0	0	0	0	0	112.6
881	P	40.8	Very low	37.2	Very low	132 Å²	132	136.7 Å²	136.7	86%	0.857	82%	0.824	S	S	*	*			trans	-125.9	179.2	-144.9	42.7	-29.2	0	0	0	116.8
882	A	38.1	Very low	37.1	Very low	92 Å²	92	135.2 Å²	135.2	76%	0.76	82%	0.823	S	S	*	*			trans	-142.9	111.7	172.2	0	0	0	0	0	115.1
883	T	37.3	Very low	36.8	Very low	146 Å²	146	133.2 Å²	133.2	90%	0.896	83%	0.828	S	S	*	*			trans	24.2	129.9	143.8	53.3	0	0	0	0	123.4
884	G	35.5	Very low	36.7	Very low	85 Å²	85	126.4 Å²	126.4	88%	0.876	82%	0.816	S	S	*	*			trans	147.6	124.3	139.5	0	0	0	0	0	116.7
885	G	33.6	Very low	36.7	Very low	81 Å²	81	130.5 Å²	130.5	84%	0.835	82%	0.819	S	S	*	*			trans	124.9	101.2	163.7	0	0	0	0	0	116.7
886	S	36.5	Very low	36.6	Very low	135 Å²	135	126.7 Å²	126.7	94%	0.944	82%	0.816	S	S	*	*			trans	-58.6	141.7	-179.8	-48.9	0	0	0	0	116
887	G	35.4	Very low	36.6	Very low	77 Å²	77	127.8 Å²	127.8	79%	0.794	82%	0.816	S	S	*	*			trans	176.4	102	166	0	0	0	0	0	112.7
888	M	35.7	Very low	36.4	Very low	180 Å²	180	127.8 Å²	127.8	89%	0.887	81%	0.807	S	S	*	*			trans	-76.7	127.7	-178.3	-72.9	177.3	67.3	0	0	112
889	G	30.3	Very low	36.6	Very low	63 Å²	63	127.7 Å²	127.7	65%	0.649	80%	0.8	S	S	*	*			trans	-176.6	57.9	179.7	0	0	0	0	0	111.3	L891	G889-L891 PolarHBondContact O-N 3.09Å
890	Y	35	Very low	36.4	Very low	197 Å²	197	127 Å²	127	77%	0.773	79%	0.79	S	S	*	*			trans	-64.1	116.8	-176.5	-68.2	-78.8	0	0	0	111.2	T892	Y890-T892 PolarHBondContact O-N 2.84Å; Y890-T892 VanDerWaalsContact O-N 3.16Å
891	L	34.8	Very low	36.5	Very low	173 Å²	173	126.4 Å²	126.4	91%	0.906	79%	0.785	S	S	*	*			trans	-65.4	111.7	163	-73.7	87.7	0	0	0	108.2	G889	G889-L891 PolarHBondContact O-N 3.09Å
892	T	36.9	Very low	36.4	Very low	115 Å²	115	130.6 Å²	130.6	71%	0.706	79%	0.785	S	S	*	*			trans	-93.4	116.8	164.3	53.4	0	0	0	0	108.8	Y890 P894	Y890-T892 PolarHBondContact O-N 2.84Å; Y890-T892 VanDerWaalsContact O-N 3.16Å; T892-P894 WeakPolarHBondContact O-CD 3.24Å
893	D	32.2	Very low	36.8	Very low	169 Å²	169	131.1 Å²	131.1	90%	0.904	78%	0.78	S	S	*	*			trans	-58.4	131.7	165.1	-76.3	-61.5	0	0	0	110.8
894	P	36.4	Very low	37.3	Very low	102 Å²	102	126.8 Å²	126.8	66%	0.662	76%	0.756	S	S	*	*			trans	-138.9	31.1	172.7	37.6	-16.2	0	0	0	114.1	T892	T892-P894 WeakPolarHBondContact O-CD 3.24Å
895	D	36.8	Very low	38	Very low	164 Å²	164	129 Å²	129	88%	0.877	75%	0.752	S	S	*	*			trans	-100.4	14.7	173	-94.7	-39.4	0	0	0	113.6
896	L	37.5	Very low	38.7	Very low	156 Å²	156	130.8 Å²	130.8	82%	0.817	74%	0.739	S	S	*	*	S	Bend	trans	-97.7	116.4	154.7	-164.3	78.9	0	0	0	107.6
897	L	36.9	Very low	39.3	Very low	146 Å²	146	127 Å²	127	76%	0.764	71%	0.712	S	S	*	*			trans	85.6	72.7	-178.8	-47.9	174.9	0	0	0	117.5
898	D	37.7	Very low	40	Very low	121 Å²	121	132.6 Å²	132.6	65%	0.647	71%	0.71	S	S	*	*			trans	-116.4	85.1	140.7	-170.5	3.3	0	0	0	110.9	D900	D898-D900 PolarHBondContact OD1-N 2.72Å
899	I	39.8	Very low	40.9	Very low	133 Å²	133	130.9 Å²	130.9	68%	0.682	70%	0.703	S	S	*	*			trans	-101.9	82	164.3	-61.5	174.7	0	0	0	107.1	R488	R488-I899 PolarHBondContact NH2-O 2.98Å
900	D	36.7	Very low	41.8	Very low	107 Å²	107	137 Å²	137	57%	0.572	71%	0.707	S	S	*	*			trans	-165.2	12.1	146.6	-92.9	-12.5	0	0	0	114.3	R488 D898 Y902	R488-D900 IonicContact CZ-OD1 3.83Å; R488-D900 IonicContact CZ-OD2 3.26Å; R488-D900 VanDerWaalsContact CZ-OD2 3.26Å; R488-D900 IonicContact NH1-OD1 3.76Å; R488-D900 IonicContact NH1-OD2 2.7Å; R488-D900 PolarHBondContact NH1-OD2 2.86Å; R488-D900 IonicContact NH2-OD1 2.98Å; R488-D900 PolarHBondContact NH2-OD1 3.33Å; R488-D900 IonicContact NH2-OD2 2.91Å; R488-D900 PolarHBondContact NH2-OD2 3.14Å; D898-D900 PolarHBondContact OD1-N 2.72Å; D900-Y902 VanDerWaalsContact C-N 3.33Å; D900-Y902 PolarHBondContact O-N 3.41Å
901	A	43.2	Very low	42.2	Very low	81 Å²	81	133.2 Å²	133.2	67%	0.669	71%	0.707	S	S	*	*			trans	-67.2	76.4	-178.2	0	0	0	0	0	114.8
902	Y	38.1	Very low	42.8	Very low	219 Å²	219	132.4 Å²	132.4	86%	0.859	70%	0.702	S	S	*	*	P	Polyproline II helix	trans	-59.6	129.4	166.6	-119	-90	0	0	0	109.9	D900 S904	D900-Y902 VanDerWaalsContact C-N 3.33Å; D900-Y902 PolarHBondContact O-N 3.41Å; Y902-S904 PolarHBondContact O-N 2.85Å; Y902-S904 VanDerWaalsContact O-N 3.14Å
903	P	45.9	Very low	43.1	Very low	103 Å²	103	131.2 Å²	131.2	67%	0.669	70%	0.703	S	S	*	*	P	Polyproline II helix	trans	-67.6	116.8	-177.4	25.9	-33.5	0	0	0	110.8
904	S	47.8	Very low	43.3	Very low	55 Å²	55	128.4 Å²	128.4	39%	0.385	70%	0.697	S	S	.	*	P	Polyproline II helix	trans	-59.2	147.6	170.7	123.8	0	0	0	0	110.1	Y902 Q906 S907	Y902-S904 PolarHBondContact O-N 2.85Å; Y902-S904 VanDerWaalsContact O-N 3.14Å; S904-Q906 PolarHBondContact O-N 3.27Å; S904-Q906 PolarHBondContact OG-N 3.15Å; S904-Q906 PolarHBondContact OG-OE1 2.99Å; S904-S907 WeakPolarHBondContact O-CB 3.17Å; S904-S907 PolarHBondContact O-N 3.19Å; S904-S907 PolarHBondContact O-OG 2.87Å
905	V	50.2	Low	43.5	Very low	132 Å²	132	128.8 Å²	128.8	80%	0.8	70%	0.702	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.7	-16.5	-177.6	-171.7	0	0	0	0	112.3
906	Q	48.6	Very low	43.5	Very low	119 Å²	119	124.9 Å²	124.9	56%	0.556	69%	0.688	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.1	10.8	174.4	-57	95.2	-15.2	0	0	114.8	S904 W908 L909	S904-Q906 PolarHBondContact O-N 3.27Å; S904-Q906 PolarHBondContact OG-N 3.15Å; S904-Q906 PolarHBondContact OG-OE1 2.99Å; Q906-W908 PolarHBondContact O-N 3.19Å; Q906-L909 HydrophobicContact CB-CD1 4.22Å; Q906-L909 HydrophobicContact CG-CD1 4.31Å; Q906-L909 WeakPolarHBondContact O-CB 3.25Å; Q906-L909 PolarHBondContact O-N 3.03Å
907	S	48.9	Very low	43.4	Very low	55 Å²	55	126.3 Å²	126.3	39%	0.385	69%	0.687	S	S	.	*	G	3₁₀ helix	trans	-53.7	-39.8	179.3	59.5	0	0	0	0	113.1	S904 L909 R910	S904-S907 WeakPolarHBondContact O-CB 3.17Å; S904-S907 PolarHBondContact O-N 3.19Å; S904-S907 PolarHBondContact O-OG 2.87Å; S907-L909 PolarHBondContact O-N 3.27Å; S907-L909 VanDerWaalsContact O-N 3.14Å; S907-R910 PolarHBondContact O-N 3.43Å
908	W	51	Low	43.6	Very low	194 Å²	194	130.2 Å²	130.2	74%	0.735	69%	0.693	S	S	*	*	G	3₁₀ helix	trans	-61.1	-15.4	176.3	-48.9	90.8	0	0	0	115.3	Q906 P970	Q906-W908 PolarHBondContact O-N 3.19Å; W908-P970 HydrophobicContact CH2-CB 4.4Å; W908-P970 HydrophobicContact CZ3-CB 4.05Å; W908-P970 HydrophobicContact CZ3-CG 4.25Å
909	L	54	Low	43.7	Very low	144 Å²	144	134.1 Å²	134.1	75%	0.754	71%	0.708	S	S	*	*	G	3₁₀ helix	trans	-97.6	-4.9	-178	-75.3	160.3	0	0	0	113.4	Q906 S907	Q906-L909 HydrophobicContact CB-CD1 4.22Å; Q906-L909 HydrophobicContact CG-CD1 4.31Å; Q906-L909 WeakPolarHBondContact O-CB 3.25Å; Q906-L909 PolarHBondContact O-N 3.03Å; S907-L909 PolarHBondContact O-N 3.27Å; S907-L909 VanDerWaalsContact O-N 3.14Å
910	R	50.6	Low	44.4	Very low	192 Å²	192	133.5 Å²	133.5	73%	0.725	70%	0.7	S	S	*	*	S	Bend	trans	-82.2	128.1	171.9	-62.5	-170	-173	-148.6	2.4	109.3	S907 I912	S907-R910 PolarHBondContact O-N 3.43Å; R910-I912 PolarHBondContact O-N 3.26Å
911	P	41.7	Very low	45.4	Very low	118 Å²	118	134.1 Å²	134.1	77%	0.766	71%	0.713	S	S	*	*			trans	-54.5	133.6	159.8	-20.5	32.5	0	0	0	108.5	A913	P911-A913 VanDerWaalsContact C-N 3.29Å; P911-A913 PolarHBondContact O-N 2.95Å
912	I	47.6	Very low	46.6	Very low	156 Å²	156	133.6 Å²	133.6	80%	0.8	70%	0.695	S	S	*	*			trans	-68.4	96.1	169.4	-61.8	171.1	0	0	0	106.2	R910 S914	R910-I912 PolarHBondContact O-N 3.26Å; I912-S914 PolarHBondContact O-N 3.19Å
913	A	42.9	Very low	48.4	Very low	90 Å²	90	130.2 Å²	130.2	74%	0.744	69%	0.685	S	S	*	*			trans	-54.3	132	169.1	0	0	0	0	0	107.8	P911 S915	P911-A913 VanDerWaalsContact C-N 3.29Å; P911-A913 PolarHBondContact O-N 2.95Å; A913-S915 PolarHBondContact O-N 2.92Å
914	S	37.3	Very low	50.1	Low	109 Å²	109	131 Å²	131	76%	0.762	68%	0.683	S	S	*	*			trans	-53.2	109.6	-161.1	38.3	0	0	0	0	112.8	I912 S916	I912-S914 PolarHBondContact O-N 3.19Å; S914-S916 PolarHBondContact O-N 3.1Å
915	S	39.5	Very low	51.6	Low	110 Å²	110	131.1 Å²	131.1	77%	0.769	68%	0.675	S	S	*	*			trans	-71.5	67.3	169	-177.8	0	0	0	0	110	A913	A913-S915 PolarHBondContact O-N 2.92Å
916	S	36.6	Very low	53.1	Low	83 Å²	83	128 Å²	128	58%	0.58	66%	0.657	S	S	*	*			trans	-54.4	151	171.2	68.2	0	0	0	0	110.5	S914	S914-S916 PolarHBondContact O-N 3.1Å
917	K	37.4	Very low	54.6	Low	185 Å²	185	124.1 Å²	124.1	80%	0.804	64%	0.638	S	S	*	*	S	Bend	trans	76.1	71.3	-177.6	-46.3	157.4	-173.1	172.3	0	114.3
918	Y	40.4	Very low	56	Low	229 Å²	229	126.7 Å²	126.7	90%	0.898	64%	0.644	S	S	*	*				-175.7	85.8	119	-95.2	-63.1	0	0	0	110.1	K920	Y918-K920 VanDerWaalsContact C-N 3.32Å; Y918-K920 PolarHBondContact O-N 3.38Å
919	E	40.3	Very low	57.4	Low	203 Å²	203	119 Å²	119	95%	0.949	62%	0.618	S	S	*	*			trans	-72.4	87.8	168.3	-71.9	-173.3	127.3	0	0	110	S921	E919-S921 PolarHBondContact O-N 2.94Å
920	K	53.5	Low	58.4	Low	120 Å²	120	112.3 Å²	112.3	52%	0.522	58%	0.583	S	S	.	*			trans	-78.7	101.2	168.1	-171.7	-177.6	178.6	-171	0	107.4	Y918 F922 D942	Y918-K920 VanDerWaalsContact C-N 3.32Å; Y918-K920 PolarHBondContact O-N 3.38Å; K920-F922 HydrophobicContact CD-CE1 4.28Å; K920-F922 HydrophobicContact CD-CZ 4.27Å; K920-F922 WeakPolarHBondContact O-CD2 3.13Å; K920-F922 WeakPolarHBondContact O-CE2 3.21Å; K920-F922 PolarHBondContact O-N 2.89Å; K920-D942 IonicContact NZ-OD2 2.75Å; K920-D942 PolarHBondContact NZ-OD2 3.13Å
921	S	58	Low	59.7	Low	120 Å²	120	105.2 Å²	105.2	84%	0.839	56%	0.558	S	S	*	*			trans	-66.7	101.5	179.6	43.6	0	0	0	0	111.2	E919	E919-S921 PolarHBondContact O-N 2.94Å
922	F	67.3	Low	60.9	Low	69 Å²	69	103 Å²	103	30%	0.303	54%	0.544	S	S	.	.	P	Polyproline II helix	trans	-70.1	144.8	175.6	-64.5	-80.7	0	0	0	110.7	K920 C948 Y949	K920-F922 HydrophobicContact CD-CE1 4.28Å; K920-F922 HydrophobicContact CD-CZ 4.27Å; K920-F922 WeakPolarHBondContact O-CD2 3.13Å; K920-F922 WeakPolarHBondContact O-CE2 3.21Å; K920-F922 PolarHBondContact O-N 2.89Å; F922-C948 WeakPolarHBondContact CB-O 3.49Å; F922-C948 HydrophobicContact CD1-CB 4.02Å; F922-C948 HydrophobicContact CD2-CB 3.83Å; F922-C948 HydrophobicContact CE1-CB 3.95Å; F922-C948 HydrophobicContact CE2-CB 3.77Å; F922-C948 HydrophobicContact CG-CB 3.96Å; F922-C948 WeakPolarHBondContact CG-O 3.47Å; F922-C948 HydrophobicContact CZ-CB 3.82Å; F922-Y949 HydrophobicContact CB-CD1 4.43Å; F922-Y949 HydrophobicContact CD1-CD1 4.29Å; F922-Y949 HydrophobicContact CD1-CD2 4.14Å; F922-Y949 AromaticContact CD1-CE1 3.83Å; F922-Y949 HydrophobicContact CD1-CE1 3.83Å; F922-Y949 AromaticContact CD1-CE2 3.65Å; F922-Y949 HydrophobicContact CD1-CE2 3.65Å; F922-Y949 HydrophobicContact CD1-CG 4.44Å; F922-Y949 AromaticContact CD1-CZ 3.49Å; F922-Y949 VanDerWaalsContact CD1-CZ 3.49Å; F922-Y949 AromaticContact CE1-CE2 3.87Å; F922-Y949 HydrophobicContact CE1-CE2 3.87Å; F922-Y949 AromaticContact CE1-CZ 3.9Å
923	K	77	Confident	61.6	Low	149 Å²	149	99.5 Å²	99.5	65%	0.648	53%	0.534	S	S	*	.	P	Polyproline II helix	trans	-84.4	127.1	172.3	-68.9	-175.1	-179.8	-178	0	108.7	Y925 Y949	K923-Y925 HydrophobicContact CB-CD2 4.34Å; K923-Y925 HydrophobicContact CB-CE2 3.72Å; K923-Y925 VanDerWaalsContact O-CD2 3.23Å; K923-Y925 WeakPolarHBondContact O-CD2 3.11Å; K923-Y949 WeakPolarHBondContact O-CD1 3.48Å
924	I	81.6	Confident	62.4	Low	119 Å²	119	97 Å²	97	61%	0.61	51%	0.511	S	S	*	.	P	Polyproline II helix	trans	-71.3	129.1	175.6	-64.7	171.6	0	0	0	109.2	Y949	I924-Y949 CarbonylContact C-O 3.53Å; I924-Y949 WeakPolarHBondContact CA-O 3.36Å
925	Y	79.2	Confident	63.5	Low	58 Å²	58	99.8 Å²	99.8	23%	0.227	52%	0.518	C	S	.	.			trans	-128.8	141.1	172.7	-69.5	-82.4	0	0	0	109.1	K923 L930 L938 V941 Y949	K923-Y925 HydrophobicContact CB-CD2 4.34Å; K923-Y925 HydrophobicContact CB-CE2 3.72Å; K923-Y925 VanDerWaalsContact O-CD2 3.23Å; K923-Y925 WeakPolarHBondContact O-CD2 3.11Å; Y925-L930 HydrophobicContact CD2-CD2 4.49Å; Y925-L930 WeakPolarHBondContact O-CD1 3.47Å; Y925-L938 HydrophobicContact CD1-CD1 3.9Å; Y925-L938 HydrophobicContact CD1-CD2 4.2Å; Y925-L938 HydrophobicContact CD2-CD1 4.05Å; Y925-L938 HydrophobicContact CE1-CD1 4.09Å; Y925-L938 HydrophobicContact CE1-CD2 3.8Å; Y925-L938 HydrophobicContact CE2-CD1 4.22Å; Y925-L938 HydrophobicContact CG-CD1 3.89Å; Y925-V941 HydrophobicContact CD2-CG2 4.39Å; Y925-V941 HydrophobicContact CE2-CG2 3.91Å; Y925-Y949 HydrophobicContact CD2-CD1 4.16Å; Y925-Y949 HydrophobicContact CE2-CD1 4.27Å; Y925-Y949 PolarHBondContact N-O 2.9Å
926	P	80.9	Confident	64.5	Low	65 Å²	65	100.5 Å²	100.5	42%	0.422	51%	0.509	S	S	.	.			trans	-68.9	150.6	177.7	28.9	-34.1	0	0	0	111.6	E928 V929 E954	P926-E928 PolarHBondContact O-N 2.85Å; P926-E928 VanDerWaalsContact O-N 3.08Å; P926-V929 HydrophobicContact CG-CG2 4.04Å; P926-V929 PolarHBondContact O-N 2.83Å; P926-E954 VanDerWaalsContact CA-OE1 3.23Å; P926-E954 WeakPolarHBondContact CA-OE1 3.48Å
927	Y	80.2	Confident	65.5	Low	38 Å²	38	103.3 Å²	103.3	15%	0.149	52%	0.517	C	S	.	.	H	α-helix	trans	-47.3	-41.5	-175.2	175.8	-142	0	0	0	114.3	V929 L930 K931 E954 L958 L981 L983	Y927-V929 PolarHBondContact O-N 3.4Å; Y927-V929 VanDerWaalsContact O-N 3.12Å; Y927-L930 PolarHBondContact O-N 3Å; Y927-K931 HydrophobicContact CD2-CG 4.09Å; Y927-K931 HydrophobicContact CE2-CD 4.31Å; Y927-K931 VanDerWaalsContact CE2-CE 3.43Å; Y927-K931 HydrophobicContact CE2-CG 3.8Å; Y927-K931 WeakPolarHBondContact O-CG 3.17Å; Y927-K931 PolarHBondContact O-N 3.25Å; Y927-E954 PolarHBondContact N-OE1 2.94Å; Y927-L958 HydrophobicContact CD1-CD1 3.67Å; Y927-L958 HydrophobicContact CD1-CD2 3.72Å; Y927-L958 HydrophobicContact CD1-CG 4.36Å; Y927-L958 HydrophobicContact CD2-CD1 3.67Å; Y927-L958 HydrophobicContact CE1-CD1 4.03Å; Y927-L958 HydrophobicContact CE1-CD2 3.43Å; Y927-L958 VanDerWaalsContact CE1-CD2 3.43Å; Y927-L958 HydrophobicContact CE1-CG 4.4Å; Y927-L958 HydrophobicContact CE2-CD1 4.05Å; Y927-L958 HydrophobicContact CG-CD1 3.47Å; Y927-L958 VanDerWaalsContact CG-CD1 3.47Å; Y927-L958 HydrophobicContact CG-CD2 4.37Å; Y927-L981 HydrophobicContact CE2-CB 4.17Å; Y927-L981 WeakPolarHBondContact CE2-O 3.16Å; Y927-L981 WeakPolarHBondContact OH-CA 3.42Å; Y927-L981 PolarHBondContact OH-O 3.31Å; Y927-L983 HydrophobicContact CD2-CD2 4.3Å; Y927-L983 HydrophobicContact CE2-CD1 4.41Å; Y927-L983 HydrophobicContact CE2-CD2 4.27Å; Y927-L983 HydrophobicContact CE2-CG 4.29Å
928	E	78.1	Confident	66.7	Low	110 Å²	110	96.5 Å²	96.5	51%	0.514	49%	0.489	S	S	.	.	H	α-helix	trans	-56.8	-27.6	-179.3	-76.3	51.8	-114.9	0	0	114	P926 K931	P926-E928 PolarHBondContact O-N 2.85Å; P926-E928 VanDerWaalsContact O-N 3.08Å; E928-K931 IonicContact OE1-NZ 2.65Å; E928-K931 PolarHBondContact OE1-NZ 2.75Å
929	V	80.4	Confident	67.6	Low	31 Å²	31	95.3 Å²	95.3	19%	0.188	49%	0.488	C	S	.	.	H	α-helix	trans	-100.4	-7.4	-176.9	-164.7	0	0	0	0	111.8	P926 Y927 S934 Q936 L938	P926-V929 HydrophobicContact CG-CG2 4.04Å; P926-V929 PolarHBondContact O-N 2.83Å; Y927-V929 PolarHBondContact O-N 3.4Å; Y927-V929 VanDerWaalsContact O-N 3.12Å; V929-S934 PolarHBondContact O-OG 2.75Å; V929-Q936 HydrophobicContact CG1-CB 4.39Å; V929-L938 HydrophobicContact CG1-CD1 4.14Å; V929-L938 HydrophobicContact CG1-CD2 4.02Å; V929-L938 HydrophobicContact CG1-CG 4.31Å
930	L	76.7	Confident	69	Low	5 Å²	5	89 Å²	89	3%	0.026	48%	0.477	C	S	.	.	H	α-helix	trans	-100.9	-18.5	176.5	-67.9	173	0	0	0	113.5	Y925 Y927 L938 V941 L946 L950 L983	Y925-L930 HydrophobicContact CD2-CD2 4.49Å; Y925-L930 WeakPolarHBondContact O-CD1 3.47Å; Y927-L930 PolarHBondContact O-N 3Å; L930-L938 HydrophobicContact CD2-CD1 3.91Å; L930-V941 HydrophobicContact CD2-CG1 4.29Å; L930-L946 HydrophobicContact CD2-CD2 3.95Å; L930-L950 HydrophobicContact CD1-CD1 3.63Å; L930-L950 HydrophobicContact CD1-CG 3.77Å; L930-L983 HydrophobicContact CB-CD2 3.92Å
931	K	78	Confident	69.8	Low	43 Å²	43	84.2 Å²	84.2	19%	0.187	46%	0.458	C	S	.	.	S	Bend	trans	-54.1	137.2	172	-72.6	161.5	-174.4	163.4	0	111.2	Y927 E928 S933 S934 D982	Y927-K931 HydrophobicContact CD2-CG 4.09Å; Y927-K931 HydrophobicContact CE2-CD 4.31Å; Y927-K931 VanDerWaalsContact CE2-CE 3.43Å; Y927-K931 HydrophobicContact CE2-CG 3.8Å; Y927-K931 WeakPolarHBondContact O-CG 3.17Å; Y927-K931 PolarHBondContact O-N 3.25Å; E928-K931 IonicContact OE1-NZ 2.65Å; E928-K931 PolarHBondContact OE1-NZ 2.75Å; K931-S933 PolarHBondContact O-N 3.08Å; K931-S934 VanDerWaalsContact O-CB 3.28Å; K931-S934 WeakPolarHBondContact O-CB 3.44Å; K931-S934 PolarHBondContact O-N 2.76Å; K931-S934 PolarHBondContact O-OG 3.33Å; K931-D982 CarbonylContact C-O 3.49Å; K931-D982 WeakPolarHBondContact CA-O 3.5Å
932	S	66.1	Low	70.3	Confident	70 Å²	70	81.5 Å²	81.5	49%	0.49	43%	0.434	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.7	-11	177.5	58.1	0	0	0	0	113.9	S934 D982 L984	S932-S934 VanDerWaalsContact C-N 3.33Å; S932-D982 PolarHBondContact N-O 3.22Å; S932-D982 PolarHBondContact OG-O 3.03Å; S932-L984 WeakPolarHBondContact CB-O 3.46Å; S932-L984 PolarHBondContact OG-O 3.05Å
933	S	61.7	Low	70.4	Confident	83 Å²	83	87.2 Å²	87.2	58%	0.58	45%	0.454	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.1	-6.8	166	53.7	0	0	0	0	114.5	K931	K931-S933 PolarHBondContact O-N 3.08Å
934	S	61.4	Low	70.1	Confident	38 Å²	38	85.2 Å²	85.2	27%	0.266	45%	0.454	S	S	.	.			trans	-81.6	129.8	176	73.8	0	0	0	0	111.6	V929 K931 S932 Q936	V929-S934 PolarHBondContact O-OG 2.75Å; K931-S934 VanDerWaalsContact O-CB 3.28Å; K931-S934 WeakPolarHBondContact O-CB 3.44Å; K931-S934 PolarHBondContact O-N 2.76Å; K931-S934 PolarHBondContact O-OG 3.33Å; S932-S934 VanDerWaalsContact C-N 3.33Å; S934-Q936 PolarHBondContact O-N 3.37Å
935	N	58.5	Low	69.7	Low	168 Å²	168	83.8 Å²	83.8	90%	0.898	45%	0.445	S	S	*	.			trans	-79.5	9.6	-179.1	-70.4	-54.9	0	0	0	113.6
936	Q	62.4	Low	69.7	Low	125 Å²	125	81.6 Å²	81.6	58%	0.584	44%	0.437	S	S	*	.			trans	-99.2	101.1	-169	-163.6	164.8	28.8	0	0	111.3	V929 S934 L938	V929-Q936 HydrophobicContact CG1-CB 4.39Å; S934-Q936 PolarHBondContact O-N 3.37Å; Q936-L938 PolarHBondContact O-N 2.87Å
937	L	56.4	Low	69.6	Low	142 Å²	142	79.6 Å²	79.6	74%	0.743	42%	0.422	S	S	*	.			trans	-70.1	86.5	-176.9	-67	172.9	0	0	0	112.8	K939	L937-K939 PolarHBondContact O-N 2.96Å; L937-K939 VanDerWaalsContact O-N 3.07Å
938	L	62.9	Low	69.7	Low	42 Å²	42	79.8 Å²	79.8	22%	0.22	43%	0.429	C	S	.	.			trans	-66.2	101.5	173.8	-60.3	-176.5	0	0	0	111.4	Y925 V929 L930 Q936 G940 V941	Y925-L938 HydrophobicContact CD1-CD1 3.9Å; Y925-L938 HydrophobicContact CD1-CD2 4.2Å; Y925-L938 HydrophobicContact CD2-CD1 4.05Å; Y925-L938 HydrophobicContact CE1-CD1 4.09Å; Y925-L938 HydrophobicContact CE1-CD2 3.8Å; Y925-L938 HydrophobicContact CE2-CD1 4.22Å; Y925-L938 HydrophobicContact CG-CD1 3.89Å; V929-L938 HydrophobicContact CG1-CD1 4.14Å; V929-L938 HydrophobicContact CG1-CD2 4.02Å; V929-L938 HydrophobicContact CG1-CG 4.31Å; L930-L938 HydrophobicContact CD2-CD1 3.91Å; Q936-L938 PolarHBondContact O-N 2.87Å; L938-G940 PolarHBondContact O-N 2.91Å; L938-V941 HydrophobicContact CB-CB 4.01Å; L938-V941 HydrophobicContact CB-CG2 3.49Å; L938-V941 VanDerWaalsContact CB-CG2 3.49Å; L938-V941 HydrophobicContact CD1-CG2 3.94Å; L938-V941 HydrophobicContact CG-CG2 4.38Å; L938-V941 PolarHBondContact O-N 3.08Å
939	K	59.8	Low	69.8	Low	204 Å²	204	75 Å²	75	89%	0.887	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.3	121.2	179.1	-64.2	-179.8	-178.6	177.6	0	110.8	L937	L937-K939 PolarHBondContact O-N 2.96Å; L937-K939 VanDerWaalsContact O-N 3.07Å
940	G	68.1	Low	69.9	Low	69 Å²	69	74 Å²	74	71%	0.711	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	91.1	13.7	-179.7	0	0	0	0	0	115.1	L938 Y949	L938-G940 PolarHBondContact O-N 2.91Å; G940-Y949 PolarHBondContact O-OH 2.91Å; G940-Y949 VanDerWaalsContact O-OH 3.14Å
941	V	70.4	Confident	70.2	Confident	21 Å²	21	74.9 Å²	74.9	13%	0.127	41%	0.406	C	S	.	.			trans	-95	118.3	170.9	176.3	0	0	0	0	109.9	Y925 L930 L938 R943 L946 Y949	Y925-V941 HydrophobicContact CD2-CG2 4.39Å; Y925-V941 HydrophobicContact CE2-CG2 3.91Å; L930-V941 HydrophobicContact CD2-CG1 4.29Å; L938-V941 HydrophobicContact CB-CB 4.01Å; L938-V941 HydrophobicContact CB-CG2 3.49Å; L938-V941 VanDerWaalsContact CB-CG2 3.49Å; L938-V941 HydrophobicContact CD1-CG2 3.94Å; L938-V941 HydrophobicContact CG-CG2 4.38Å; L938-V941 PolarHBondContact O-N 3.08Å; V941-R943 PolarHBondContact O-N 2.81Å; V941-R943 VanDerWaalsContact O-N 3.14Å; V941-L946 HydrophobicContact CG1-CD2 3.55Å; V941-Y949 WeakPolarHBondContact CA-OH 3.29Å; V941-Y949 HydrophobicContact CB-CE1 4.13Å; V941-Y949 HydrophobicContact CG1-CD1 4.14Å; V941-Y949 HydrophobicContact CG1-CD2 3.94Å; V941-Y949 HydrophobicContact CG1-CE1 4.09Å; V941-Y949 HydrophobicContact CG1-CE2 3.89Å; V941-Y949 HydrophobicContact CG1-CG 4.07Å; V941-Y949 HydrophobicContact CG2-CD1 3.92Å; V941-Y949 HydrophobicContact CG2-CE1 3.74Å
942	D	68.6	Low	70.4	Confident	62 Å²	62	77 Å²	77	33%	0.332	42%	0.422	S	S	.	.			trans	-74.4	100.3	179.1	-71.4	-45.2	0	0	0	109.8	K920 T944 Q945 Y949	K920-D942 IonicContact NZ-OD2 2.75Å; K920-D942 PolarHBondContact NZ-OD2 3.13Å; D942-T944 PolarHBondContact O-N 3.14Å; D942-Q945 CarbonylContact O-C 3.55Å; D942-Q945 PolarHBondContact O-N 3.16Å; D942-Y949 HydrophobicContact CB-CE2 4.39Å; D942-Y949 PolarHBondContact N-OH 2.88Å
943	R	70.1	Confident	71.3	Confident	189 Å²	189	77.7 Å²	77.7	71%	0.713	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.8	-20.6	-175.2	-82.3	-176.6	162.4	-177.9	-8.6	115.6	V941	V941-R943 PolarHBondContact O-N 2.81Å; V941-R943 VanDerWaalsContact O-N 3.14Å
944	T	70.3	Confident	72.4	Confident	107 Å²	107	75.4 Å²	75.4	66%	0.656	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.2	-14.1	176.1	50	0	0	0	0	113.6	D942 K978	D942-T944 PolarHBondContact O-N 3.14Å; T944-K978 PolarHBondContact O-NZ 2.97Å
945	Q	74.7	Confident	73.7	Confident	89 Å²	89	73.9 Å²	73.9	42%	0.416	39%	0.39	S	S	.	.			trans	-130.5	35.6	-174.6	-66.3	-172.5	-13.3	0	0	112.1	D942 E947 C948 Y949	D942-Q945 CarbonylContact O-C 3.55Å; D942-Q945 PolarHBondContact O-N 3.16Å; Q945-E947 WeakPolarHBondContact CA-OE2 3.37Å; Q945-E947 PolarHBondContact O-N 3.48Å; Q945-E947 VanDerWaalsContact O-N 3.09Å; Q945-C948 WeakPolarHBondContact O-CB 3.33Å; Q945-C948 PolarHBondContact O-N 3.41Å; Q945-Y949 WeakPolarHBondContact O-CD2 3.39Å
946	L	78.7	Confident	75	Confident	13 Å²	13	70.1 Å²	70.1	7%	0.068	37%	0.366	C	S	.	.	G	3₁₀ helix	trans	-53.3	-30.7	178.7	-70.4	169.1	0	0	0	112.8	L930 V941 C948 Y949 L950 L983	L930-L946 HydrophobicContact CD2-CD2 3.95Å; V941-L946 HydrophobicContact CG1-CD2 3.55Å; L946-C948 PolarHBondContact O-N 3.42Å; L946-Y949 PolarHBondContact O-N 3.47Å; L946-L950 WeakPolarHBondContact O-CD1 3.49Å; L946-L983 HydrophobicContact CB-CD2 4.42Å; L946-L983 HydrophobicContact CD1-CB 4.44Å
947	E	79	Confident	76.1	Confident	23 Å²	23	72.2 Å²	72.2	11%	0.107	37%	0.369	C	S	.	.	G	3₁₀ helix	trans	-56.5	-29	174.7	67.2	-89.1	-142.3	0	0	114.4	Q945 Y949 F955 F966 K978	Q945-E947 WeakPolarHBondContact CA-OE2 3.37Å; Q945-E947 PolarHBondContact O-N 3.48Å; Q945-E947 VanDerWaalsContact O-N 3.09Å; E947-Y949 PolarHBondContact O-N 3.49Å; E947-F955 HydrophobicContact CB-CD2 4.32Å; E947-F955 HydrophobicContact CB-CE2 3.86Å; E947-F966 HydrophobicContact CB-CE1 4.28Å; E947-F966 HydrophobicContact CG-CD1 4.39Å; E947-F966 HydrophobicContact CG-CE1 3.79Å; E947-K978 VanDerWaalsContact CD-CE 3.43Å; E947-K978 WeakPolarHBondContact OE1-CE 3.43Å; E947-K978 IonicContact OE1-NZ 2.67Å; E947-K978 PolarHBondContact OE1-NZ 3.12Å; E947-K978 WeakPolarHBondContact OE2-CE 3.28Å; E947-K978 IonicContact OE2-NZ 3.12Å; E947-K978 PolarHBondContact OE2-NZ 2.73Å
948	C	80.8	Confident	77.5	Confident	42 Å²	42	67.6 Å²	67.6	28%	0.284	35%	0.345	S	S	.	.	G	3₁₀ helix	trans	-78.6	-6.4	179.9	-63.6	0	0	0	0	113	F922 Q945 L946	F922-C948 WeakPolarHBondContact CB-O 3.49Å; F922-C948 HydrophobicContact CD1-CB 4.02Å; F922-C948 HydrophobicContact CD2-CB 3.83Å; F922-C948 HydrophobicContact CE1-CB 3.95Å; F922-C948 HydrophobicContact CE2-CB 3.77Å; F922-C948 HydrophobicContact CG-CB 3.96Å; F922-C948 WeakPolarHBondContact CG-O 3.47Å; F922-C948 HydrophobicContact CZ-CB 3.82Å; Q945-C948 WeakPolarHBondContact O-CB 3.33Å; Q945-C948 PolarHBondContact O-N 3.41Å; L946-C948 PolarHBondContact O-N 3.42Å
949	Y	81.2	Confident	78.6	Confident	8 Å²	8	66 Å²	66	3%	0.031	34%	0.336	C	S	.	.	G	3₁₀ helix	trans	-105.2	-4.7	179.6	-64	-98.8	0	0	0	113.1	F922 K923 I924 Y925 G940 V941 D942 Q945 L946 E947	F922-Y949 HydrophobicContact CB-CD1 4.43Å; F922-Y949 HydrophobicContact CD1-CD1 4.29Å; F922-Y949 HydrophobicContact CD1-CD2 4.14Å; F922-Y949 AromaticContact CD1-CE1 3.83Å; F922-Y949 HydrophobicContact CD1-CE1 3.83Å; F922-Y949 AromaticContact CD1-CE2 3.65Å; F922-Y949 HydrophobicContact CD1-CE2 3.65Å; F922-Y949 HydrophobicContact CD1-CG 4.44Å; F922-Y949 AromaticContact CD1-CZ 3.49Å; F922-Y949 VanDerWaalsContact CD1-CZ 3.49Å; F922-Y949 AromaticContact CE1-CE2 3.87Å; F922-Y949 HydrophobicContact CE1-CE2 3.87Å; F922-Y949 AromaticContact CE1-CZ 3.9Å; K923-Y949 WeakPolarHBondContact O-CD1 3.48Å; I924-Y949 CarbonylContact C-O 3.53Å; I924-Y949 WeakPolarHBondContact CA-O 3.36Å; Y925-Y949 HydrophobicContact CD2-CD1 4.16Å; Y925-Y949 HydrophobicContact CE2-CD1 4.27Å; Y925-Y949 PolarHBondContact N-O 2.9Å; G940-Y949 PolarHBondContact O-OH 2.91Å; G940-Y949 VanDerWaalsContact O-OH 3.14Å; V941-Y949 WeakPolarHBondContact CA-OH 3.29Å; V941-Y949 HydrophobicContact CB-CE1 4.13Å; V941-Y949 HydrophobicContact CG1-CD1 4.14Å; V941-Y949 HydrophobicContact CG1-CD2 3.94Å; V941-Y949 HydrophobicContact CG1-CE1 4.09Å; V941-Y949 HydrophobicContact CG1-CE2 3.89Å; V941-Y949 HydrophobicContact CG1-CG 4.07Å; V941-Y949 HydrophobicContact CG2-CD1 3.92Å; V941-Y949 HydrophobicContact CG2-CE1 3.74Å; D942-Y949 HydrophobicContact CB-CE2 4.39Å; D942-Y949 PolarHBondContact N-OH 2.88Å; Q945-Y949 WeakPolarHBondContact O-CD2 3.39Å; L946-Y949 PolarHBondContact O-N 3.47Å; E947-Y949 PolarHBondContact O-N 3.49Å
950	L	81.7	Confident	79.8	Confident	12 Å²	12	63.2 Å²	63.2	6%	0.063	33%	0.331	C	S	.	.	S	Bend	trans	-78.9	158.3	169.8	-75.8	92.8	0	0	0	110.9	L930 L946 E954 F955 L958 L983	L930-L950 HydrophobicContact CD1-CD1 3.63Å; L930-L950 HydrophobicContact CD1-CG 3.77Å; L946-L950 WeakPolarHBondContact O-CD1 3.49Å; L950-E954 HydrophobicContact CB-CB 4.5Å; L950-E954 HydrophobicContact CD2-CB 4.02Å; L950-F955 HydrophobicContact CB-CB 4.49Å; L950-L958 HydrophobicContact CD2-CD1 3.46Å; L950-L958 VanDerWaalsContact CD2-CD1 3.46Å; L950-L983 HydrophobicContact CD1-CD1 4.12Å
951	S	82.8	Confident	80.6	Confident	22 Å²	22	62.2 Å²	62.2	15%	0.154	31%	0.308	C	S	.	.			trans	-67.8	157.3	164	65.6	0	0	0	0	111.1	D953 E954 F955	S951-D953 VanDerWaalsContact C-N 3.25Å; S951-D953 PolarHBondContact O-N 3.45Å; S951-E954 WeakPolarHBondContact CB-OE2 3.29Å; S951-E954 PolarHBondContact N-OE2 2.97Å; S951-E954 PolarHBondContact O-N 2.89Å; S951-E954 WeakPolarHBondContact OG-CB 3.41Å; S951-E954 WeakPolarHBondContact OG-CG 3.18Å; S951-E954 PolarHBondContact OG-N 2.64Å; S951-E954 VanDerWaalsContact OG-N 3.17Å; S951-E954 PolarHBondContact OG-OE2 2.91Å; S951-F955 VanDerWaalsContact O-CB 3.3Å; S951-F955 WeakPolarHBondContact O-CB 3.43Å; S951-F955 PolarHBondContact O-N 3.16Å
952	T	82.6	Confident	81.4	Confident	88 Å²	88	64.3 Å²	64.3	54%	0.54	32%	0.323	S	S	.	.	H	α-helix	trans	-54.5	-44.1	174	42.3	0	0	0	0	111.9	F955 E956	T952-F955 WeakPolarHBondContact O-CB 3.49Å; T952-F955 PolarHBondContact O-N 3.39Å; T952-E956 WeakPolarHBondContact O-CG 3.38Å; T952-E956 PolarHBondContact O-N 3.32Å
953	D	86	Confident	82.1	Confident	84 Å²	84	63.5 Å²	63.5	45%	0.449	32%	0.321	S	S	.	.	H	α-helix	trans	-64.6	-44.6	-179.7	-74.9	48.2	0	0	0	113.1	S951 R957	S951-D953 VanDerWaalsContact C-N 3.25Å; S951-D953 PolarHBondContact O-N 3.45Å; D953-R957 WeakPolarHBondContact O-CB 3.39Å; D953-R957 VanDerWaalsContact O-CD 3.3Å; D953-R957 WeakPolarHBondContact O-CD 3.4Å; D953-R957 WeakPolarHBondContact O-CG 3.14Å; D953-R957 PolarHBondContact O-N 2.93Å; D953-R957 VanDerWaalsContact O-N 3.07Å; D953-R957 IonicContact OD2-NH2 3.6Å; D953-R957 PolarHBondContact OD2-NH2 2.86Å; D953-R957 VanDerWaalsContact OD2-NH2 3.07Å
954	E	84.8	Confident	82.8	Confident	36 Å²	36	60 Å²	60	17%	0.168	31%	0.313	C	S	.	.	H	α-helix	trans	-69.3	-39	175.1	-69.9	167	106.2	0	0	111.3	P926 Y927 L950 S951 E956 R957 L958	P926-E954 VanDerWaalsContact CA-OE1 3.23Å; P926-E954 WeakPolarHBondContact CA-OE1 3.48Å; Y927-E954 PolarHBondContact N-OE1 2.94Å; L950-E954 HydrophobicContact CB-CB 4.5Å; L950-E954 HydrophobicContact CD2-CB 4.02Å; S951-E954 WeakPolarHBondContact CB-OE2 3.29Å; S951-E954 PolarHBondContact N-OE2 2.97Å; S951-E954 PolarHBondContact O-N 2.89Å; S951-E954 WeakPolarHBondContact OG-CB 3.41Å; S951-E954 WeakPolarHBondContact OG-CG 3.18Å; S951-E954 PolarHBondContact OG-N 2.64Å; S951-E954 VanDerWaalsContact OG-N 3.17Å; S951-E954 PolarHBondContact OG-OE2 2.91Å; E954-E956 PolarHBondContact O-N 3.23Å; E954-R957 PolarHBondContact O-N 3.21Å; E954-L958 HydrophobicContact CB-CD1 4.49Å; E954-L958 WeakPolarHBondContact O-CB 3.48Å; E954-L958 WeakPolarHBondContact O-CD1 3.49Å; E954-L958 VanDerWaalsContact O-CG 3.23Å; E954-L958 WeakPolarHBondContact O-CG 3.28Å; E954-L958 PolarHBondContact O-N 3.29Å
955	F	87.5	Confident	83.6	Confident	6 Å²	6	56.6 Å²	56.6	3%	0.026	30%	0.296	C	S	.	.	H	α-helix	trans	-57.8	-50.1	176	-174	-84.2	0	0	0	110.9	E947 L950 S951 T952 R957 L958 F959 M961 P963 F966	E947-F955 HydrophobicContact CB-CD2 4.32Å; E947-F955 HydrophobicContact CB-CE2 3.86Å; L950-F955 HydrophobicContact CB-CB 4.49Å; S951-F955 VanDerWaalsContact O-CB 3.3Å; S951-F955 WeakPolarHBondContact O-CB 3.43Å; S951-F955 PolarHBondContact O-N 3.16Å; T952-F955 WeakPolarHBondContact O-CB 3.49Å; T952-F955 PolarHBondContact O-N 3.39Å; F955-R957 PolarHBondContact O-N 3Å; F955-L958 PolarHBondContact O-N 2.82Å; F955-F959 HydrophobicContact CD1-CB 4.47Å; F955-F959 HydrophobicContact CD1-CD2 4.29Å; F955-F959 AromaticContact CD2-CD2 3.48Å; F955-F959 HydrophobicContact CD2-CD2 3.48Å; F955-F959 VanDerWaalsContact CD2-CD2 3.48Å; F955-F959 AromaticContact CD2-CE2 3.62Å; F955-F959 HydrophobicContact CD2-CE2 3.62Å; F955-F959 HydrophobicContact CD2-CG 4.39Å; F955-F959 HydrophobicContact CE1-CB 3.9Å; F955-F959 HydrophobicContact CE1-CD2 4.08Å; F955-F959 HydrophobicContact CE1-CG 4.11Å; F955-F959 HydrophobicContact CE2-CB 4.44Å; F955-F959 HydrophobicContact CE2-CD1 4.33Å; F955-F959 AromaticContact CE2-CD2 3.2Å; F955-F959 HydrophobicContact CE2-CD2 3.2Å; F955-F959 HydrophobicContact CE2-CE1 4.42Å; F955-F959 AromaticContact CE2-CE2 3.31Å; F955-F959 HydrophobicContact CE2-CE2 3.31Å; F955-F959 AromaticContact CE2-CG 3.76Å; F955-F959 HydrophobicContact CE2-CG 3.76Å; F955-F959 AromaticContact CE2-CZ 3.94Å; F955-F959 HydrophobicContact CE2-CZ 3.94Å; F955-F959 AromaticContact CG-CD2 4Å; F955-F959 HydrophobicContact CG-CD2 4Å; F955-F959 HydrophobicContact CZ-CB 3.86Å; F955-F959 HydrophobicContact CZ-CD1 4.16Å; F955-F959 AromaticContact CZ-CD2 3.51Å; F955-F959 HydrophobicContact CZ-CD2 3.51Å; F955-F959 HydrophobicContact CZ-CE2 4.03Å; F955-F959 AromaticContact CZ-CG 3.58Å; F955-F959 HydrophobicContact CZ-CG 3.58Å; F955-F959 WeakPolarHBondContact O-CB 3.49Å; F955-F959 WeakPolarHBondContact O-CD2 3.35Å; F955-F959 PolarHBondContact O-N 2.87Å; F955-M961 WeakPolarHBondContact CD1-O 3.42Å; F955-M961 HydrophobicContact CE1-CG 4.35Å; F955-M961 WeakPolarHBondContact CE1-O 3.19Å; F955-P963 HydrophobicContact CB-CG 4.5Å; F955-P963 HydrophobicContact CD1-CB 4.26Å; F955-P963 HydrophobicContact CD1-CG 3.66Å; F955-P963 HydrophobicContact CE1-CB 4.34Å; F955-P963 HydrophobicContact CE1-CG 4.2Å; F955-P963 HydrophobicContact CG-CG 4.05Å; F955-F966 HydrophobicContact CE1-CB 3.95Å; F955-F966 HydrophobicContact CE1-CG 4.5Å; F955-F966 HydrophobicContact CE2-CD1 4.38Å; F955-F966 HydrophobicContact CE2-CG 4.33Å; F955-F966 HydrophobicContact CZ-CB 3.47Å; F955-F966 VanDerWaalsContact CZ-CB 3.47Å; F955-F966 AromaticContact CZ-CD1 4Å; F955-F966 HydrophobicContact CZ-CD1 4Å; F955-F966 AromaticContact CZ-CD2 3.96Å; F955-F966 HydrophobicContact CZ-CD2 3.96Å; F955-F966 AromaticContact CZ-CG 3.57Å; F955-F966 HydrophobicContact CZ-CG 3.57Å
956	E	86.8	Confident	84.2	Confident	88 Å²	88	52.5 Å²	52.5	41%	0.411	28%	0.277	S	S	.	.	H	α-helix	trans	-65.1	-38.8	178.7	-72.9	-174	178.1	0	0	112.3	T952 E954 L958 N960 C962	T952-E956 WeakPolarHBondContact O-CG 3.38Å; T952-E956 PolarHBondContact O-N 3.32Å; E954-E956 PolarHBondContact O-N 3.23Å; E956-L958 VanDerWaalsContact C-N 3.34Å; E956-L958 PolarHBondContact O-N 3.22Å; E956-N960 WeakPolarHBondContact O-CA 3.12Å; E956-N960 PolarHBondContact O-N 3.17Å; E956-C962 WeakPolarHBondContact OE1-CA 3.29Å; E956-C962 WeakPolarHBondContact OE1-CB 3.17Å; E956-C962 PolarHBondContact OE1-SG 2.95Å
957	R	85.9	Confident	84.5	Confident	169 Å²	169	58.1 Å²	58.1	64%	0.638	30%	0.303	S	S	*	.	H	α-helix	trans	-65.6	-30.6	175.9	-72.3	166.2	-164.4	152.4	13.9	114	D953 E954 F955	D953-R957 WeakPolarHBondContact O-CB 3.39Å; D953-R957 VanDerWaalsContact O-CD 3.3Å; D953-R957 WeakPolarHBondContact O-CD 3.4Å; D953-R957 WeakPolarHBondContact O-CG 3.14Å; D953-R957 PolarHBondContact O-N 2.93Å; D953-R957 VanDerWaalsContact O-N 3.07Å; D953-R957 IonicContact OD2-NH2 3.6Å; D953-R957 PolarHBondContact OD2-NH2 2.86Å; D953-R957 VanDerWaalsContact OD2-NH2 3.07Å; E954-R957 PolarHBondContact O-N 3.21Å; F955-R957 PolarHBondContact O-N 3Å
958	L	85.5	Confident	85	Confident	45 Å²	45	65.5 Å²	65.5	24%	0.236	33%	0.33	C	S	.	.	H	α-helix	trans	-95.6	-38.5	-175.2	-66.6	167.4	0	0	0	113	Y927 L950 E954 F955 E956 L981	Y927-L958 HydrophobicContact CD1-CD1 3.67Å; Y927-L958 HydrophobicContact CD1-CD2 3.72Å; Y927-L958 HydrophobicContact CD1-CG 4.36Å; Y927-L958 HydrophobicContact CD2-CD1 3.67Å; Y927-L958 HydrophobicContact CE1-CD1 4.03Å; Y927-L958 HydrophobicContact CE1-CD2 3.43Å; Y927-L958 VanDerWaalsContact CE1-CD2 3.43Å; Y927-L958 HydrophobicContact CE1-CG 4.4Å; Y927-L958 HydrophobicContact CE2-CD1 4.05Å; Y927-L958 HydrophobicContact CG-CD1 3.47Å; Y927-L958 VanDerWaalsContact CG-CD1 3.47Å; Y927-L958 HydrophobicContact CG-CD2 4.37Å; L950-L958 HydrophobicContact CD2-CD1 3.46Å; L950-L958 VanDerWaalsContact CD2-CD1 3.46Å; E954-L958 HydrophobicContact CB-CD1 4.49Å; E954-L958 WeakPolarHBondContact O-CB 3.48Å; E954-L958 WeakPolarHBondContact O-CD1 3.49Å; E954-L958 VanDerWaalsContact O-CG 3.23Å; E954-L958 WeakPolarHBondContact O-CG 3.28Å; E954-L958 PolarHBondContact O-N 3.29Å; F955-L958 PolarHBondContact O-N 2.82Å; E956-L958 VanDerWaalsContact C-N 3.34Å; E956-L958 PolarHBondContact O-N 3.22Å; L958-L981 HydrophobicContact CB-CD1 3.94Å; L958-L981 HydrophobicContact CB-CD2 4.19Å; L958-L981 HydrophobicContact CD2-CD2 4.23Å
959	F	86	Confident	85.2	Confident	8 Å²	8	65 Å²	65	4%	0.035	32%	0.324	C	S	.	.	H	α-helix	trans	-94.6	-11.5	179.8	-67.9	-91.3	0	0	0	113.3	F955 M961 F966 L977 L981 L983	F955-F959 HydrophobicContact CD1-CB 4.47Å; F955-F959 HydrophobicContact CD1-CD2 4.29Å; F955-F959 AromaticContact CD2-CD2 3.48Å; F955-F959 HydrophobicContact CD2-CD2 3.48Å; F955-F959 VanDerWaalsContact CD2-CD2 3.48Å; F955-F959 AromaticContact CD2-CE2 3.62Å; F955-F959 HydrophobicContact CD2-CE2 3.62Å; F955-F959 HydrophobicContact CD2-CG 4.39Å; F955-F959 HydrophobicContact CE1-CB 3.9Å; F955-F959 HydrophobicContact CE1-CD2 4.08Å; F955-F959 HydrophobicContact CE1-CG 4.11Å; F955-F959 HydrophobicContact CE2-CB 4.44Å; F955-F959 HydrophobicContact CE2-CD1 4.33Å; F955-F959 AromaticContact CE2-CD2 3.2Å; F955-F959 HydrophobicContact CE2-CD2 3.2Å; F955-F959 HydrophobicContact CE2-CE1 4.42Å; F955-F959 AromaticContact CE2-CE2 3.31Å; F955-F959 HydrophobicContact CE2-CE2 3.31Å; F955-F959 AromaticContact CE2-CG 3.76Å; F955-F959 HydrophobicContact CE2-CG 3.76Å; F955-F959 AromaticContact CE2-CZ 3.94Å; F955-F959 HydrophobicContact CE2-CZ 3.94Å; F955-F959 AromaticContact CG-CD2 4Å; F955-F959 HydrophobicContact CG-CD2 4Å; F955-F959 HydrophobicContact CZ-CB 3.86Å; F955-F959 HydrophobicContact CZ-CD1 4.16Å; F955-F959 AromaticContact CZ-CD2 3.51Å; F955-F959 HydrophobicContact CZ-CD2 3.51Å; F955-F959 HydrophobicContact CZ-CE2 4.03Å; F955-F959 AromaticContact CZ-CG 3.58Å; F955-F959 HydrophobicContact CZ-CG 3.58Å; F955-F959 WeakPolarHBondContact O-CB 3.49Å; F955-F959 WeakPolarHBondContact O-CD2 3.35Å; F955-F959 PolarHBondContact O-N 2.87Å; F959-M961 HydrophobicContact CB-CG 4.04Å; F959-M961 WeakPolarHBondContact O-CE 3.35Å; F959-M961 PolarHBondContact O-N 3.05Å; F959-F966 AromaticContact CD1-CD2 3.77Å; F959-F966 HydrophobicContact CD1-CD2 3.77Å; F959-F966 AromaticContact CD1-CE2 3.62Å; F959-F966 HydrophobicContact CD1-CE2 3.62Å; F959-F966 HydrophobicContact CE1-CD2 4.02Å; F959-F966 AromaticContact CE1-CE2 3.41Å; F959-F966 HydrophobicContact CE1-CE2 3.41Å; F959-F966 VanDerWaalsContact CE1-CE2 3.41Å; F959-F966 AromaticContact CE1-CZ 3.96Å; F959-F966 HydrophobicContact CE1-CZ 3.96Å; F959-F966 HydrophobicContact CG-CD2 4.48Å; F959-F966 HydrophobicContact CZ-CE2 4.31Å; F959-F966 HydrophobicContact CZ-CZ 4.49Å; F959-L977 HydrophobicContact CD1-CB 3.91Å; F959-L977 HydrophobicContact CD1-CD1 4.47Å; F959-L977 HydrophobicContact CE1-CB 3.88Å; F959-L981 HydrophobicContact CD1-CD1 3.94Å; F959-L981 HydrophobicContact CD2-CD1 3.92Å; F959-L981 HydrophobicContact CE1-CD1 3.65Å; F959-L981 HydrophobicContact CE2-CD1 3.63Å; F959-L981 HydrophobicContact CG-CD1 4.09Å; F959-L981 HydrophobicContact CZ-CD1 3.5Å; F959-L983 HydrophobicContact CE2-CD1 4.12Å; F959-L983 HydrophobicContact CZ-CD1 3.94Å
960	N	85	Confident	85.5	Confident	146 Å²	146	66.3 Å²	66.3	78%	0.781	33%	0.333	S	S	*	.	S	Bend	trans	54.4	32.8	-174.1	-65.7	-60.8	0	0	0	113.5	E956	E956-N960 WeakPolarHBondContact O-CA 3.12Å; E956-N960 PolarHBondContact O-N 3.17Å
961	M	84.6	Confident	85.7	Confident	49 Å²	49	71.7 Å²	71.7	24%	0.241	36%	0.358	C	S	.	.	S	Bend	trans	-159.7	153.6	177.8	68	-171.3	78.4	0	0	110.8	F955 F959 A965 F966 L969 L977	F955-M961 WeakPolarHBondContact CD1-O 3.42Å; F955-M961 HydrophobicContact CE1-CG 4.35Å; F955-M961 WeakPolarHBondContact CE1-O 3.19Å; F959-M961 HydrophobicContact CB-CG 4.04Å; F959-M961 WeakPolarHBondContact O-CE 3.35Å; F959-M961 PolarHBondContact O-N 3.05Å; M961-A965 HydrophobicContact CB-CB 4.09Å; M961-A965 HydrophobicContact CG-CB 4.44Å; M961-F966 HydrophobicContact CG-CB 4.25Å; M961-F966 HydrophobicContact SD-CB 3.93Å; M961-F966 HydrophobicContact SD-CD2 4.3Å; M961-L969 HydrophobicContact CE-CD1 4.1Å; M961-L969 HydrophobicContact SD-CD1 3.74Å; M961-L977 HydrophobicContact CE-CD1 3.79Å; M961-L977 HydrophobicContact SD-CD1 4.48Å
962	C	85.9	Confident	85.8	Confident	64 Å²	64	78.7 Å²	78.7	43%	0.432	38%	0.381	S	S	.	.			trans	-65.5	153.9	174.9	-49.1	0	0	0	0	111.8	E956 E964 A965 F966	E956-C962 WeakPolarHBondContact OE1-CA 3.29Å; E956-C962 WeakPolarHBondContact OE1-CB 3.17Å; E956-C962 PolarHBondContact OE1-SG 2.95Å; C962-E964 VanDerWaalsContact C-N 3.28Å; C962-E964 PolarHBondContact O-N 3.29Å; C962-E964 VanDerWaalsContact O-N 3.17Å; C962-A965 WeakPolarHBondContact O-CB 3.48Å; C962-A965 PolarHBondContact O-N 3.46Å; C962-F966 PolarHBondContact O-N 2.94Å
963	P	85	Confident	86.1	Confident	45 Å²	45	78.9 Å²	78.9	29%	0.292	37%	0.374	S	S	.	.	H	α-helix	trans	-53.3	-38.2	179.6	-28.4	34.9	0	0	0	114.7	F955 A965 F966 Q967	F955-P963 HydrophobicContact CB-CG 4.5Å; F955-P963 HydrophobicContact CD1-CB 4.26Å; F955-P963 HydrophobicContact CD1-CG 3.66Å; F955-P963 HydrophobicContact CE1-CB 4.34Å; F955-P963 HydrophobicContact CE1-CG 4.2Å; F955-P963 HydrophobicContact CG-CG 4.05Å; P963-A965 PolarHBondContact O-N 3.35Å; P963-F966 WeakPolarHBondContact O-CB 3.13Å; P963-F966 PolarHBondContact O-N 3.48Å; P963-Q967 WeakPolarHBondContact O-CG 3.34Å; P963-Q967 PolarHBondContact O-N 3.26Å
964	E	84.7	Confident	86.3	Confident	115 Å²	115	77.5 Å²	77.5	54%	0.537	36%	0.363	S	S	.	.	H	α-helix	trans	-64.1	-38.7	175.7	-54.2	-175	173.1	0	0	113	C962 F966 Q967 R968	C962-E964 VanDerWaalsContact C-N 3.28Å; C962-E964 PolarHBondContact O-N 3.29Å; C962-E964 VanDerWaalsContact O-N 3.17Å; E964-F966 VanDerWaalsContact C-N 3.28Å; E964-F966 PolarHBondContact O-N 3.31Å; E964-Q967 PolarHBondContact O-N 2.82Å; E964-R968 VanDerWaalsContact O-CG 3.3Å; E964-R968 WeakPolarHBondContact O-CG 3.22Å; E964-R968 PolarHBondContact O-N 2.84Å; E964-R968 IonicContact OE2-CZ 2.65Å; E964-R968 IonicContact OE2-NH1 2.65Å; E964-R968 PolarHBondContact OE2-NH1 3.08Å; E964-R968 IonicContact OE2-NH2 2.73Å; E964-R968 PolarHBondContact OE2-NH2 2.89Å
965	A	85.8	Confident	86.4	Confident	37 Å²	37	79.1 Å²	79.1	31%	0.306	37%	0.373	S	S	.	.	H	α-helix	trans	-66.8	-35.4	-179.9	0	0	0	0	0	110.5	M961 C962 P963 R968	M961-A965 HydrophobicContact CB-CB 4.09Å; M961-A965 HydrophobicContact CG-CB 4.44Å; C962-A965 WeakPolarHBondContact O-CB 3.48Å; C962-A965 PolarHBondContact O-N 3.46Å; P963-A965 PolarHBondContact O-N 3.35Å; A965-R968 PolarHBondContact O-N 3.15Å
966	F	88.4	Confident	86.5	Confident	3 Å²	3	82.4 Å²	82.4	1%	0.013	39%	0.391	C	S	.	.	H	α-helix	trans	-66.2	-44.4	170.9	-179.8	-97.2	0	0	0	112.5	E947 F955 F959 M961 C962 P963 E964 R968 L969 R974 L977 K978	E947-F966 HydrophobicContact CB-CE1 4.28Å; E947-F966 HydrophobicContact CG-CD1 4.39Å; E947-F966 HydrophobicContact CG-CE1 3.79Å; F955-F966 HydrophobicContact CE1-CB 3.95Å; F955-F966 HydrophobicContact CE1-CG 4.5Å; F955-F966 HydrophobicContact CE2-CD1 4.38Å; F955-F966 HydrophobicContact CE2-CG 4.33Å; F955-F966 HydrophobicContact CZ-CB 3.47Å; F955-F966 VanDerWaalsContact CZ-CB 3.47Å; F955-F966 AromaticContact CZ-CD1 4Å; F955-F966 HydrophobicContact CZ-CD1 4Å; F955-F966 AromaticContact CZ-CD2 3.96Å; F955-F966 HydrophobicContact CZ-CD2 3.96Å; F955-F966 AromaticContact CZ-CG 3.57Å; F955-F966 HydrophobicContact CZ-CG 3.57Å; F959-F966 AromaticContact CD1-CD2 3.77Å; F959-F966 HydrophobicContact CD1-CD2 3.77Å; F959-F966 AromaticContact CD1-CE2 3.62Å; F959-F966 HydrophobicContact CD1-CE2 3.62Å; F959-F966 HydrophobicContact CE1-CD2 4.02Å; F959-F966 AromaticContact CE1-CE2 3.41Å; F959-F966 HydrophobicContact CE1-CE2 3.41Å; F959-F966 VanDerWaalsContact CE1-CE2 3.41Å; F959-F966 AromaticContact CE1-CZ 3.96Å; F959-F966 HydrophobicContact CE1-CZ 3.96Å; F959-F966 HydrophobicContact CG-CD2 4.48Å; F959-F966 HydrophobicContact CZ-CE2 4.31Å; F959-F966 HydrophobicContact CZ-CZ 4.49Å; M961-F966 HydrophobicContact CG-CB 4.25Å; M961-F966 HydrophobicContact SD-CB 3.93Å; M961-F966 HydrophobicContact SD-CD2 4.3Å; C962-F966 PolarHBondContact O-N 2.94Å; P963-F966 WeakPolarHBondContact O-CB 3.13Å; P963-F966 PolarHBondContact O-N 3.48Å; E964-F966 VanDerWaalsContact C-N 3.28Å; E964-F966 PolarHBondContact O-N 3.31Å; F966-R968 PolarHBondContact O-N 3.25Å; F966-L969 HydrophobicContact CD2-CD1 4.42Å; F966-L969 VanDerWaalsContact O-CB 3.3Å; F966-L969 WeakPolarHBondContact O-CB 3.38Å; F966-L969 PolarHBondContact O-N 2.05Å; F966-R974 HydrophobicContact CD1-CG 4Å; F966-R974 HydrophobicContact CD2-CG 4.15Å; F966-R974 HydrophobicContact CE1-CB 4.02Å; F966-R974 VanDerWaalsContact CE1-CD 3.42Å; F966-R974 HydrophobicContact CE1-CG 3.67Å; F966-R974 HydrophobicContact CE2-CB 3.96Å; F966-R974 HydrophobicContact CE2-CG 3.83Å; F966-R974 HydrophobicContact CG-CG 4.23Å; F966-R974 HydrophobicContact CZ-CB 3.55Å; F966-R974 HydrophobicContact CZ-CG 3.59Å; F966-R974 VanDerWaalsContact O-CD 3.25Å; F966-R974 WeakPolarHBondContact O-CD 3.34Å; F966-R974 WeakPolarHBondContact O-CG 3.47Å; F966-L977 HydrophobicContact CD2-CD1 4.02Å; F966-L977 HydrophobicContact CE2-CB 4.01Å; F966-L977 HydrophobicContact CE2-CD1 4.03Å; F966-K978 HydrophobicContact CZ-CG 4.23Å
967	Q	85.3	Confident	86.5	Confident	131 Å²	131	79.7 Å²	79.7	61%	0.612	38%	0.379	S	S	*	.	H	α-helix	trans	-60.8	-30.8	176.3	-71.7	-179.5	12.2	0	0	112.9	P963 E964 L969	P963-Q967 WeakPolarHBondContact O-CG 3.34Å; P963-Q967 PolarHBondContact O-N 3.26Å; E964-Q967 PolarHBondContact O-N 2.82Å; Q967-L969 PolarHBondContact O-N 3.36Å
968	R	87.9	Confident	86.6	Confident	178 Å²	178	72 Å²	72	67%	0.672	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71	-8.7	172.7	-68	165.6	-175.3	123.7	8	113.9	E964 A965 F966	E964-R968 VanDerWaalsContact O-CG 3.3Å; E964-R968 WeakPolarHBondContact O-CG 3.22Å; E964-R968 PolarHBondContact O-N 2.84Å; E964-R968 IonicContact OE2-CZ 2.65Å; E964-R968 IonicContact OE2-NH1 2.65Å; E964-R968 PolarHBondContact OE2-NH1 3.08Å; E964-R968 IonicContact OE2-NH2 2.73Å; E964-R968 PolarHBondContact OE2-NH2 2.89Å; A965-R968 PolarHBondContact O-N 3.15Å; F966-R968 PolarHBondContact O-N 3.25Å
969	L	86.8	Confident	86.6	Confident	31 Å²	31	76.8 Å²	76.8	16%	0.162	37%	0.369	C	S	.	.	S	Bend	trans	-83.8	144.3	176.3	-60.6	179.8	0	0	0	112.4	M961 F966 Q967 K973 R974 L977	M961-L969 HydrophobicContact CE-CD1 4.1Å; M961-L969 HydrophobicContact SD-CD1 3.74Å; F966-L969 HydrophobicContact CD2-CD1 4.42Å; F966-L969 VanDerWaalsContact O-CB 3.3Å; F966-L969 WeakPolarHBondContact O-CB 3.38Å; F966-L969 PolarHBondContact O-N 2.05Å; Q967-L969 PolarHBondContact O-N 3.36Å; L969-K973 HydrophobicContact CD1-CD 4.4Å; L969-K973 HydrophobicContact CD1-CG 4.31Å; L969-K973 HydrophobicContact CD2-CD 4.14Å; L969-R974 HydrophobicContact CB-CG 3.94Å; L969-R974 PolarHBondContact O-NE 2.76Å; L969-L977 HydrophobicContact CD1-CD1 3.53Å
970	P	86.3	Confident	86.6	Confident	35 Å²	35	84.2 Å²	84.2	23%	0.227	40%	0.401	C	S	.	.			trans	-54.4	148.1	170.4	-26.7	35.3	0	0	0	112.9	W908 W972 K973 R974	W908-P970 HydrophobicContact CH2-CB 4.4Å; W908-P970 HydrophobicContact CZ3-CB 4.05Å; W908-P970 HydrophobicContact CZ3-CG 4.25Å; P970-W972 VanDerWaalsContact C-N 3.32Å; P970-W972 HydrophobicContact CB-CG 4.49Å; P970-W972 PolarHBondContact O-N 2.96Å; P970-K973 WeakPolarHBondContact O-CA 3.16Å; P970-K973 PolarHBondContact O-N 2.66Å; P970-R974 PolarHBondContact O-N 3.44Å
971	E	85.1	Confident	86.5	Confident	125 Å²	125	78.3 Å²	78.3	58%	0.584	37%	0.369	S	S	*	.	H	α-helix	trans	-56.9	-40.4	-174.3	-71	-175.8	159.8	0	0	113.8	K973 R974 N975	E971-K973 VanDerWaalsContact C-N 3.28Å; E971-K973 PolarHBondContact O-N 3.32Å; E971-R974 VanDerWaalsContact CG-NH2 3.32Å; E971-R974 PolarHBondContact O-N 3.4Å; E971-R974 IonicContact OE1-NH2 3.49Å; E971-N975 WeakPolarHBondContact O-CB 3.3Å; E971-N975 PolarHBondContact O-N 3.47Å; E971-N975 PolarHBondContact O-ND2 3.44Å
972	W	86.8	Confident	86.3	Confident	169 Å²	169	80.2 Å²	80.2	64%	0.64	38%	0.381	S	S	*	.	H	α-helix	trans	-59.5	-40.5	175.3	66.8	-97.5	0	0	0	111.8	P970 N975 D976	P970-W972 VanDerWaalsContact C-N 3.32Å; P970-W972 HydrophobicContact CB-CG 4.49Å; P970-W972 PolarHBondContact O-N 2.96Å; W972-N975 PolarHBondContact O-N 2.85Å; W972-D976 PolarHBondContact O-N 3.34Å
973	K	88.4	Confident	86	Confident	92 Å²	92	77.1 Å²	77.1	40%	0.4	36%	0.36	S	S	.	.	H	α-helix	trans	-76.4	-33.5	-179.8	-170.9	172.8	171.8	-177.6	0	112.2	L969 P970 E971 L977	L969-K973 HydrophobicContact CD1-CD 4.4Å; L969-K973 HydrophobicContact CD1-CG 4.31Å; L969-K973 HydrophobicContact CD2-CD 4.14Å; P970-K973 WeakPolarHBondContact O-CA 3.16Å; P970-K973 PolarHBondContact O-N 2.66Å; E971-K973 VanDerWaalsContact C-N 3.28Å; E971-K973 PolarHBondContact O-N 3.32Å; K973-L977 VanDerWaalsContact O-CG 3.32Å; K973-L977 WeakPolarHBondContact O-CG 3.39Å; K973-L977 PolarHBondContact O-N 3.17Å; K973-L977 VanDerWaalsContact O-N 3.13Å
974	R	89.7	Confident	85.2	Confident	56 Å²	56	80.7 Å²	80.7	21%	0.211	38%	0.376	C	S	.	.	H	α-helix	trans	-60.8	-46.7	167.2	-76.8	-166	-91.5	136.9	-2.1	110.7	F966 L969 P970 E971 L977 K978	F966-R974 HydrophobicContact CD1-CG 4Å; F966-R974 HydrophobicContact CD2-CG 4.15Å; F966-R974 HydrophobicContact CE1-CB 4.02Å; F966-R974 VanDerWaalsContact CE1-CD 3.42Å; F966-R974 HydrophobicContact CE1-CG 3.67Å; F966-R974 HydrophobicContact CE2-CB 3.96Å; F966-R974 HydrophobicContact CE2-CG 3.83Å; F966-R974 HydrophobicContact CG-CG 4.23Å; F966-R974 HydrophobicContact CZ-CB 3.55Å; F966-R974 HydrophobicContact CZ-CG 3.59Å; F966-R974 VanDerWaalsContact O-CD 3.25Å; F966-R974 WeakPolarHBondContact O-CD 3.34Å; F966-R974 WeakPolarHBondContact O-CG 3.47Å; L969-R974 HydrophobicContact CB-CG 3.94Å; L969-R974 PolarHBondContact O-NE 2.76Å; P970-R974 PolarHBondContact O-N 3.44Å; E971-R974 VanDerWaalsContact CG-NH2 3.32Å; E971-R974 PolarHBondContact O-N 3.4Å; E971-R974 IonicContact OE1-NH2 3.49Å; R974-L977 PolarHBondContact O-N 2.91Å; R974-K978 WeakPolarHBondContact O-CG 3.28Å; R974-K978 PolarHBondContact O-N 3.44Å
975	N	87	Confident	85.2	Confident	69 Å²	69	79 Å²	79	37%	0.369	37%	0.368	S	S	.	.	H	α-helix	trans	-66.7	-39.8	179.5	-68.1	-15.7	0	0	0	112.4	E971 W972 L977 K978 K979 L984	E971-N975 WeakPolarHBondContact O-CB 3.3Å; E971-N975 PolarHBondContact O-N 3.47Å; E971-N975 PolarHBondContact O-ND2 3.44Å; W972-N975 PolarHBondContact O-N 2.85Å; N975-L977 VanDerWaalsContact C-N 3.28Å; N975-L977 PolarHBondContact O-N 3.25Å; N975-K978 PolarHBondContact O-N 3.32Å; N975-K979 VanDerWaalsContact O-CB 3.24Å; N975-K979 WeakPolarHBondContact O-CB 3.46Å; N975-K979 PolarHBondContact O-N 3.03Å; N975-L984 HydrophobicContact CB-CD1 4.06Å; N975-L984 WeakPolarHBondContact O-CD1 3.47Å
976	D	88.6	Confident	85.2	Confident	75 Å²	75	81.2 Å²	81.2	40%	0.401	37%	0.371	S	S	.	.	H	α-helix	trans	-60.7	-35.7	172.4	-79.7	-21.7	0	0	0	112.7	W972 K980	W972-D976 PolarHBondContact O-N 3.34Å; D976-K980 WeakPolarHBondContact O-CG 3.35Å; D976-K980 PolarHBondContact O-N 3.18Å
977	L	88.1	Confident	85	Confident	32 Å²	32	85.6 Å²	85.6	17%	0.168	39%	0.391	C	S	.	.	H	α-helix	trans	-72.1	-44.4	175.1	-73.2	169.5	0	0	0	111.8	F959 M961 F966 L969 K973 R974 N975 K979 K980	F959-L977 HydrophobicContact CD1-CB 3.91Å; F959-L977 HydrophobicContact CD1-CD1 4.47Å; F959-L977 HydrophobicContact CE1-CB 3.88Å; M961-L977 HydrophobicContact CE-CD1 3.79Å; M961-L977 HydrophobicContact SD-CD1 4.48Å; F966-L977 HydrophobicContact CD2-CD1 4.02Å; F966-L977 HydrophobicContact CE2-CB 4.01Å; F966-L977 HydrophobicContact CE2-CD1 4.03Å; L969-L977 HydrophobicContact CD1-CD1 3.53Å; K973-L977 VanDerWaalsContact O-CG 3.32Å; K973-L977 WeakPolarHBondContact O-CG 3.39Å; K973-L977 PolarHBondContact O-N 3.17Å; K973-L977 VanDerWaalsContact O-N 3.13Å; R974-L977 PolarHBondContact O-N 2.91Å; N975-L977 VanDerWaalsContact C-N 3.28Å; N975-L977 PolarHBondContact O-N 3.25Å; L977-K979 VanDerWaalsContact C-N 3.28Å; L977-K979 PolarHBondContact O-N 3.12Å; L977-K980 PolarHBondContact O-N 2.84Å; L977-K980 VanDerWaalsContact O-N 3.16Å
978	K	86.8	Confident	85	Confident	6 Å²	6	82.9 Å²	82.9	3%	0.026	38%	0.378	C	S	.	.	H	α-helix	trans	-57.5	-42.7	172.3	-66	-179.7	-158	-156.5	0	111.8	T944 E947 F966 R974 N975 K980 L981 D982 L983 L984	T944-K978 PolarHBondContact O-NZ 2.97Å; E947-K978 VanDerWaalsContact CD-CE 3.43Å; E947-K978 WeakPolarHBondContact OE1-CE 3.43Å; E947-K978 IonicContact OE1-NZ 2.67Å; E947-K978 PolarHBondContact OE1-NZ 3.12Å; E947-K978 WeakPolarHBondContact OE2-CE 3.28Å; E947-K978 IonicContact OE2-NZ 3.12Å; E947-K978 PolarHBondContact OE2-NZ 2.73Å; F966-K978 HydrophobicContact CZ-CG 4.23Å; R974-K978 WeakPolarHBondContact O-CG 3.28Å; R974-K978 PolarHBondContact O-N 3.44Å; N975-K978 PolarHBondContact O-N 3.32Å; K978-K980 VanDerWaalsContact C-N 3.26Å; K978-K980 PolarHBondContact O-N 3.42Å; K978-L981 CarbonylContact O-C 3.55Å; K978-L981 PolarHBondContact O-N 3.14Å; K978-D982 PolarHBondContact O-N 3.16Å; K978-L983 HydrophobicContact CB-CB 4.1Å; K978-L983 HydrophobicContact CG-CB 4.49Å; K978-L983 PolarHBondContact O-N 3.02Å; K978-L984 HydrophobicContact CB-CD1 3.9Å; K978-L984 HydrophobicContact CB-CG 3.84Å; K978-L984 HydrophobicContact CD-CD2 4.47Å; K978-L984 HydrophobicContact CD-CG 4.21Å
979	K	86.4	Confident	84.8	Confident	146 Å²	146	76.9 Å²	76.9	64%	0.635	36%	0.36	S	S	*	.	H	α-helix	trans	-66	-23.3	179	-171.7	175.4	178.2	-177	0	113.6	N975 L977 L981 L984	N975-K979 VanDerWaalsContact O-CB 3.24Å; N975-K979 WeakPolarHBondContact O-CB 3.46Å; N975-K979 PolarHBondContact O-N 3.03Å; L977-K979 VanDerWaalsContact C-N 3.28Å; L977-K979 PolarHBondContact O-N 3.12Å; K979-L981 VanDerWaalsContact C-N 3.27Å; K979-L984 HydrophobicContact CB-CD1 4.21Å
980	K	87.1	Confident	84.6	Confident	164 Å²	164	80 Å²	80	71%	0.713	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79	-9	172.1	-74.8	170	-177.5	-179.4	0	113.7	D976 L977 K978	D976-K980 WeakPolarHBondContact O-CG 3.35Å; D976-K980 PolarHBondContact O-N 3.18Å; L977-K980 PolarHBondContact O-N 2.84Å; L977-K980 VanDerWaalsContact O-N 3.16Å; K978-K980 VanDerWaalsContact C-N 3.26Å; K978-K980 PolarHBondContact O-N 3.42Å
981	L	81.7	Confident	84.5	Confident	22 Å²	22	83.2 Å²	83.2	12%	0.115	38%	0.383	C	S	.	.	T	Hydrogen-bonded Turn	trans	-121.8	10.6	-176	-62.1	172.3	0	0	0	112	Y927 L958 F959 K978 K979 L983	Y927-L981 HydrophobicContact CE2-CB 4.17Å; Y927-L981 WeakPolarHBondContact CE2-O 3.16Å; Y927-L981 WeakPolarHBondContact OH-CA 3.42Å; Y927-L981 PolarHBondContact OH-O 3.31Å; L958-L981 HydrophobicContact CB-CD1 3.94Å; L958-L981 HydrophobicContact CB-CD2 4.19Å; L958-L981 HydrophobicContact CD2-CD2 4.23Å; F959-L981 HydrophobicContact CD1-CD1 3.94Å; F959-L981 HydrophobicContact CD2-CD1 3.92Å; F959-L981 HydrophobicContact CE1-CD1 3.65Å; F959-L981 HydrophobicContact CE2-CD1 3.63Å; F959-L981 HydrophobicContact CG-CD1 4.09Å; F959-L981 HydrophobicContact CZ-CD1 3.5Å; K978-L981 CarbonylContact O-C 3.55Å; K978-L981 PolarHBondContact O-N 3.14Å; K979-L981 VanDerWaalsContact C-N 3.27Å; L981-L983 HydrophobicContact CB-CD1 4Å; L981-L983 HydrophobicContact CB-CG 4.03Å; L981-L983 HydrophobicContact CD1-CD1 4.29Å; L981-L983 PolarHBondContact O-N 2.82Å
982	D	81.5	Confident	84.5	Confident	89 Å²	89	80 Å²	80	48%	0.476	37%	0.368	S	S	.	.	T	Hydrogen-bonded Turn	trans	49.5	39.6	-171.8	-58.8	-25.5	0	0	0	113.2	K931 S932 K978	K931-D982 CarbonylContact C-O 3.49Å; K931-D982 WeakPolarHBondContact CA-O 3.5Å; S932-D982 PolarHBondContact N-O 3.22Å; S932-D982 PolarHBondContact OG-O 3.03Å; K978-D982 PolarHBondContact O-N 3.16Å
983	L	78	Confident	84.3	Confident	0 Å²	0	72.6 Å²	72.6	0%	0	35%	0.345	C	S	.	.			trans	-102.9	34.9	176	-64.1	175.3	0	0	0	112.2	Y927 L930 L946 L950 F959 K978 L981	Y927-L983 HydrophobicContact CD2-CD2 4.3Å; Y927-L983 HydrophobicContact CE2-CD1 4.41Å; Y927-L983 HydrophobicContact CE2-CD2 4.27Å; Y927-L983 HydrophobicContact CE2-CG 4.29Å; L930-L983 HydrophobicContact CB-CD2 3.92Å; L946-L983 HydrophobicContact CB-CD2 4.42Å; L946-L983 HydrophobicContact CD1-CB 4.44Å; L950-L983 HydrophobicContact CD1-CD1 4.12Å; F959-L983 HydrophobicContact CE2-CD1 4.12Å; F959-L983 HydrophobicContact CZ-CD1 3.94Å; K978-L983 HydrophobicContact CB-CB 4.1Å; K978-L983 HydrophobicContact CG-CB 4.49Å; K978-L983 PolarHBondContact O-N 3.02Å; L981-L983 HydrophobicContact CB-CD1 4Å; L981-L983 HydrophobicContact CB-CG 4.03Å; L981-L983 HydrophobicContact CD1-CD1 4.29Å; L981-L983 PolarHBondContact O-N 2.82Å
984	L	68.2	Low	83.9	Confident	120 Å²	120	70.8 Å²	70.8	63%	0.628	34%	0.34	S	S	*	.			trans	-144.2	0	174.3	-88.3	171.4	0	0	0	110.6	S932 N975 K978 K979	S932-L984 WeakPolarHBondContact CB-O 3.46Å; S932-L984 PolarHBondContact OG-O 3.05Å; N975-L984 HydrophobicContact CB-CD1 4.06Å; N975-L984 WeakPolarHBondContact O-CD1 3.47Å; K978-L984 HydrophobicContact CB-CD1 3.9Å; K978-L984 HydrophobicContact CB-CG 3.84Å; K978-L984 HydrophobicContact CD-CD2 4.47Å; K978-L984 HydrophobicContact CD-CG 4.21Å; K979-L984 HydrophobicContact CB-CD1 4.21Å

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