A0A3Q0KMV5_SCHMA Loading...

DM domain-containing protein

AlphaFold DB , UniProt , Accession A0A3Q0KMV5, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,382 aa.

						>A0A3Q0KMV5_SCHMA|A0A3Q0KMV5
MTNSEISSICFKQESINDNSPTTSSSISTIPQFYSDNHHHHYNIHHLNSGTTYLNEQELNFNNFVSTTTVNNKINSMLSISNNLLSKTLHNPFIHFNLTNPLNNNDHHHHHDHHDHDRDHQLIDEMDNSEFIHSMQQNERIQNEMNYSTLTPTSSSASSSSLAVAAAASSLTECLKIKTMNNIPFSTVNVTLNKDIIEQQFNVQKLGNTRNDNNNNNDNNLKNSLISLPSTSLFTSTHASKSSTSKFSHHHQNPRTTMTMGIGTPTATTTTTTTTTTTTRTSTTINRSNGSQDYKEYGNSLRSTVQNRLNNHSHSHPHHHHHHHVHHYRTASICSRASYMCRKCKTHGHNIPVKRHKRTCPYTNCKCIKCHLVDQGRKVVAKQIALYRDQTGNSHQRDTHEQQASLNRVQTSANIHWLQTSTETVSSSPSSSIKKIPTTTTAALPIATTNLGRNRIDEAKMNKNATTTRNTTRLSDTTGIHDPSFCDERINSTLVQLSTHSNSLRSMVTMMDDKQTITSGPHCRRCRNHSIAVTWKGHKKTCPFRNCPCDPCRLINVRKDTEKTLREMVSHNELKPFTNVFKENRNNYSTPKLQSIVQSNSTLNDTNIQADYPYKPSINPYNNSNKINVNHPNGNEKIEETLINQQINESLLLSRPPKSSPCLTQLLHNNLSNNNNTDNTTTNNNDPFMSTTRSQLNPKLNSRSNSIDSILSQNSSENYLNESLLPPSSYQLATTLSNMNHLKEQTNSIQSKSTTQLKNSNLLTIHEINHLSSSDWWIQSTNLLHNIPTTLTSVLSPTTLSMNVNHPIENSLTTMNSIDCIQYDTSLGYIHQKGNDNASTEFDSAITTDFSQLNSIEDYYESPILKNSLTNEANVNFHYNDNYNKNYYYDNGDYFGPTIDFRNTSPYLCRINRSQAYNPTTNNLNSNINIHNNNNNSCANHSNNPMNNKFGSYFTSQLPSETAFYCPERVSAVAAAAAAAAAMVAMTPAINNSPRRCSHHHYHHHHCHAHPHCHINQNFREDIQQRHGQGNIDDDYDDEDDDVVDNDDLLNEANTIDAKRYHHYHHMYNQSASIQHQQHHKPYETLDPELYSNLGQNRTVREGCPSIDGEIHVPSMDKTCVITGNSLPYIDEYPGSPVEHYSRFNRSPRDWINKETDDIRIPQEELTTLIRHTGNNSRKHELPLTTTFQPVSSTNYMSLAFNQLTVGKFHDPNLTTVSSAPSFMPLEINSSLPISFPRLPTNIPSSRTLDYSNPIWRNHSNLKMNHLLSDMHTSINISDNTHVSDDDIDDEDNDKQTNSRVSLNHLMNNSKLEYSRHIINQSEHGSDVNLSAWSLLQFSNDDNQEMIDNNNNSNNDNSNIVLSIGNVESTNRIRDENAILNR
					

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	31.8	Very low	30.7	Very low	241 Å²	241	137.5 Å²	137.5	100%	1.187	76%	0.762	S	S	*	*				0	144.4	0	-60.7	174	110.1	0	0	106.7
2	T	32.7	Very low	30.9	Very low	118 Å²	118	142.3 Å²	142.3	72%	0.724	77%	0.769	S	S	*	*			cis	-126.1	162.1	22.8	47	0	0	0	0	113.2
3	N	32.4	Very low	30.7	Very low	140 Å²	140	139.8 Å²	139.8	75%	0.749	75%	0.75	S	S	*	*			trans	68.5	119.1	162.3	-58.8	5.1	0	0	0	114.7
4	S	29.2	Very low	30.6	Very low	95 Å²	95	140.3 Å²	140.3	66%	0.664	75%	0.745	S	S	*	*			cis	60.7	138.5	23.5	101.2	0	0	0	0	112.9
5	E	32.5	Very low	30.5	Very low	166 Å²	166	137.9 Å²	137.9	78%	0.776	74%	0.744	S	S	*	*			cis	-163.6	-162.3	8	-150.6	155.7	-141.5	0	0	109.1
6	I	32.2	Very low	30.5	Very low	140 Å²	140	137.4 Å²	137.4	72%	0.718	74%	0.739	S	S	*	*			trans	73.9	89.8	155.2	-63.5	151.1	0	0	0	117.4
7	S	29.9	Very low	30.5	Very low	100 Å²	100	136.8 Å²	136.8	70%	0.699	74%	0.736	S	S	*	*				72.6	158.9	116.7	-53.4	0	0	0	0	123
8	S	31.7	Very low	30.9	Very low	106 Å²	106	135.3 Å²	135.3	74%	0.741	73%	0.728	S	S	*	*			trans	75.6	149.8	149.4	-66.5	0	0	0	0	119.2
9	I	28.7	Very low	31.1	Very low	146 Å²	146	135.3 Å²	135.3	75%	0.749	73%	0.727	S	S	*	*			cis	-168.5	148.6	-32.6	-127.6	163.4	0	0	0	107.7
10	C	29.1	Very low	31.4	Very low	98 Å²	98	134.3 Å²	134.3	66%	0.662	73%	0.731	S	S	*	*			trans	58	134.7	159.3	-70.2	0	0	0	0	123.7
11	F	27.2	Very low	31.6	Very low	163 Å²	163	132.7 Å²	132.7	72%	0.715	73%	0.727	S	S	*	*			trans	37.5	121.1	131.2	-67.5	-106.5	0	0	0	121.1	Q13	F11-Q13 HydrophobicContact CD1-CB 4.45Å
12	K	33.8	Very low	31.5	Very low	194 Å²	194	126.9 Å²	126.9	84%	0.843	71%	0.705	S	S	*	*				-159.9	136.1	91.3	-94.2	153.6	-178.7	178.9	0	109.9
13	Q	28.3	Very low	31.3	Very low	111 Å²	111	126.5 Å²	126.5	52%	0.519	70%	0.703	S	S	.	*			cis	89.9	117.5	28.1	-172.7	-178.8	4.4	0	0	113.9	F11	F11-Q13 HydrophobicContact CD1-CB 4.45Å
14	E	29	Very low	31.1	Very low	146 Å²	146	124.9 Å²	124.9	68%	0.682	70%	0.703	S	S	*	*			trans	57.7	159.7	168.2	-71.1	138.4	-142.2	0	0	115.4	I16	E14-I16 HydrophobicContact CB-CD1 4.49Å; E14-I16 HydrophobicContact CG-CD1 4.03Å
15	S	29.3	Very low	31.1	Very low	104 Å²	104	124.6 Å²	124.6	73%	0.727	70%	0.701	S	S	*	*			cis	-136.9	142.9	20.1	40.7	0	0	0	0	109.6
16	I	29.9	Very low	31	Very low	130 Å²	130	121.1 Å²	121.1	67%	0.667	70%	0.695	S	S	*	*				67.3	144.1	69	-62.1	164.1	0	0	0	111.8	E14	E14-I16 HydrophobicContact CB-CD1 4.49Å; E14-I16 HydrophobicContact CG-CD1 4.03Å
17	N	31.2	Very low	31	Very low	128 Å²	128	121.6 Å²	121.6	68%	0.684	70%	0.697	S	S	*	*			trans	72.8	147.9	-179.5	-78.2	29.3	0	0	0	116.5
18	D	36.9	Very low	31.2	Very low	110 Å²	110	122 Å²	122	59%	0.588	70%	0.7	S	S	*	*			cis	-142.6	139.8	0.5	-108.6	-38.2	0	0	0	113.7
19	N	35.8	Very low	31.2	Very low	135 Å²	135	121.9 Å²	121.9	72%	0.722	70%	0.695	S	S	*	*			trans	45.1	107.3	140.3	-55.9	-28.7	0	0	0	121.3
20	S	37.5	Very low	31.4	Very low	115 Å²	115	121.3 Å²	121.3	80%	0.804	69%	0.692	S	S	*	*				-44.9	151.8	129.5	-36.5	0	0	0	0	110.3
21	P	34.4	Very low	31.7	Very low	101 Å²	101	121.5 Å²	121.5	66%	0.656	69%	0.692	S	S	*	*				-156.8	172.4	95.9	39.7	-20.2	0	0	0	116.1
22	T	29.4	Very low	31.9	Very low	118 Å²	118	120 Å²	120	72%	0.724	69%	0.687	S	S	*	*			trans	47.2	153.1	135.1	60.9	0	0	0	0	122
23	T	29	Very low	31.8	Very low	111 Å²	111	117.5 Å²	117.5	68%	0.681	68%	0.677	S	S	*	*			cis	-173.2	157.8	-6.6	26.6	0	0	0	0	108.5
24	S	28.6	Very low	32	Very low	105 Å²	105	121.4 Å²	121.4	73%	0.734	69%	0.688	S	S	*	*			trans	56.4	-174.8	150.5	66.4	0	0	0	0	115.1
25	S	30	Very low	31.9	Very low	90 Å²	90	118.3 Å²	118.3	63%	0.629	68%	0.682	S	S	*	*			cis	-146.5	124.1	1.2	-22.2	0	0	0	0	106.7
26	S	29.8	Very low	31.9	Very low	93 Å²	93	119.3 Å²	119.3	65%	0.65	68%	0.68	S	S	*	*				76.1	148.5	89.8	76.5	0	0	0	0	115.4
27	I	30.8	Very low	31.8	Very low	149 Å²	149	119 Å²	119	76%	0.764	68%	0.68	S	S	*	*			trans	76.2	133.6	170.5	-50.3	153.7	0	0	0	111.3
28	S	34.3	Very low	31.9	Very low	108 Å²	108	120.1 Å²	120.1	76%	0.755	68%	0.68	S	S	*	*			cis	-151.9	178.1	16.7	12.5	0	0	0	0	111.4
29	T	32.7	Very low	31.5	Very low	105 Å²	105	122 Å²	122	64%	0.644	69%	0.685	S	S	*	*			cis	166.3	113.5	-31	-79.6	0	0	0	0	108.4
30	I	33.3	Very low	31.3	Very low	133 Å²	133	122.9 Å²	122.9	68%	0.682	69%	0.685	S	S	*	*			trans	65.1	159.6	154.3	-72.3	172.3	0	0	0	116.2	Q32	I30-Q32 HydrophobicContact CG2-CG 4.34Å
31	P	35.6	Very low	30.8	Very low	103 Å²	103	125.1 Å²	125.1	67%	0.669	68%	0.682	S	S	*	*			cis	-102.5	161.6	3.5	7.9	17.2	0	0	0	114.6
32	Q	31	Very low	30.6	Very low	130 Å²	130	130.2 Å²	130.2	61%	0.607	69%	0.69	S	S	*	*				54.7	140.8	69.3	-42.5	169	-52.6	0	0	112.1	I30	I30-Q32 HydrophobicContact CG2-CG 4.34Å
33	F	30.8	Very low	30.4	Very low	142 Å²	142	130.9 Å²	130.9	62%	0.623	69%	0.689	S	S	*	*			cis	-150.7	177.9	15.9	-81.7	-76.8	0	0	0	107.8
34	Y	32.7	Very low	30.6	Very low	194 Å²	194	133.1 Å²	133.1	76%	0.761	70%	0.695	S	S	*	*			cis	-147.9	161.4	-0.9	-123.9	-61.1	0	0	0	107.3
35	S	28.1	Very low	30.6	Very low	80 Å²	80	134.6 Å²	134.6	56%	0.559	69%	0.69	S	S	*	*			trans	0.7	161.3	138.2	-67	0	0	0	0	121.1
36	D	27.4	Very low	30.6	Very low	125 Å²	125	137.5 Å²	137.5	67%	0.668	69%	0.694	S	S	*	*			cis	-175.6	-177.8	-12.4	-94.8	-35.9	0	0	0	105.8
37	N	29.1	Very low	30.8	Very low	125 Å²	125	139.5 Å²	139.5	67%	0.668	70%	0.696	S	S	*	*			trans	67.6	166.1	154.3	-62	-35.1	0	0	0	116
38	H	33.4	Very low	30.7	Very low	150 Å²	150	139 Å²	139	69%	0.694	70%	0.695	S	S	*	*			cis	-137.3	149.6	-25.3	-104.1	-29.2	0	0	0	105.1
39	H	28.2	Very low	30.5	Very low	150 Å²	150	138.2 Å²	138.2	69%	0.694	69%	0.69	S	S	*	*				62.5	139.5	77.6	-125.5	67	0	0	0	114.6
40	H	31.6	Very low	30.6	Very low	153 Å²	153	134.7 Å²	134.7	71%	0.708	67%	0.674	S	S	*	*			trans	70.7	135.1	-175.5	-51.8	-72.7	0	0	0	116.9
41	H	26.3	Very low	30.6	Very low	163 Å²	163	132.2 Å²	132.2	76%	0.755	67%	0.665	S	S	*	*			cis	84.9	59.2	16.6	-157.7	-71.1	0	0	0	116.7
42	Y	30	Very low	30.4	Very low	207 Å²	207	130.8 Å²	130.8	81%	0.812	65%	0.654	S	S	*	*			trans	-154.6	132.2	152.2	-88.9	-79.4	0	0	0	106.7
43	N	26.4	Very low	30.5	Very low	132 Å²	132	134.2 Å²	134.2	71%	0.706	66%	0.663	S	S	*	*			cis	81.4	64.4	21.8	-153.9	14.7	0	0	0	116.1
44	I	32.4	Very low	30.6	Very low	158 Å²	158	134 Å²	134	81%	0.81	67%	0.668	S	S	*	*			trans	-141.1	111.5	161	-54.1	179.7	0	0	0	104.8
45	H	29.5	Very low	30.5	Very low	137 Å²	137	130.8 Å²	130.8	63%	0.634	66%	0.664	S	S	*	*			cis	96	138.1	36.6	-151	-91.1	0	0	0	112.9
46	H	30.1	Very low	30.7	Very low	151 Å²	151	133.5 Å²	133.5	70%	0.699	67%	0.668	S	S	*	*			trans	71	140.7	179.2	-67.7	-45.9	0	0	0	118.1
47	L	32.7	Very low	30.9	Very low	135 Å²	135	134.7 Å²	134.7	71%	0.707	67%	0.669	S	S	*	*			cis	-154.1	135.3	1.2	-106.6	156.8	0	0	0	113.5
48	N	28.9	Very low	31	Very low	139 Å²	139	135.7 Å²	135.7	74%	0.743	67%	0.67	S	S	*	*			trans	16.5	151.8	134.6	-63.8	1.6	0	0	0	122.6
49	S	31	Very low	30.8	Very low	91 Å²	91	134.7 Å²	134.7	64%	0.636	67%	0.669	S	S	*	*			cis	-178.8	127.4	-6.7	49.5	0	0	0	0	116.5
50	G	33.8	Very low	30.8	Very low	30 Å²	30	132.7 Å²	132.7	31%	0.309	66%	0.663	S	S	.	*			trans	57.7	168.6	152.8	0	0	0	0	0	120.9	L1262 K1263	G50-L1262 VanDerWaalsContact N-CD2 3.32Å; G50-L1262 WeakPolarHBondContact O-CD2 3.4Å; G50-K1263 VanDerWaalsContact C-NZ 3.26Å; G50-K1263 WeakPolarHBondContact O-CB 3.46Å; G50-K1263 VanDerWaalsContact O-CD 3.29Å; G50-K1263 WeakPolarHBondContact O-CD 3.23Å; G50-K1263 VanDerWaalsContact O-CE 3.28Å; G50-K1263 WeakPolarHBondContact O-CE 3.46Å; G50-K1263 PolarHBondContact O-NZ 3.42Å
51	T	32.9	Very low	30.7	Very low	82 Å²	82	133.1 Å²	133.1	50%	0.503	66%	0.663	S	S	.	*			cis	-175.6	179.3	5.7	53	0	0	0	0	109	K1263	T51-K1263 VanDerWaalsContact N-CE 3.25Å; T51-K1263 VanDerWaalsContact O-CB 3.27Å; T51-K1263 WeakPolarHBondContact O-CB 2.88Å; T51-K1263 WeakPolarHBondContact O-CE 3.03Å; T51-K1263 WeakPolarHBondContact OG1-CE 3.27Å; T51-K1263 PolarHBondContact OG1-NZ 3.17Å
52	T	32.3	Very low	31	Very low	72 Å²	72	131.3 Å²	131.3	44%	0.442	66%	0.66	S	S	.	*			trans	58	144.3	146.9	55.9	0	0	0	0	122.2
53	Y	32.5	Very low	31.1	Very low	203 Å²	203	127.9 Å²	127.9	80%	0.796	66%	0.655	S	S	*	*			cis	-173.3	161.5	-20.7	-127.6	-60.8	0	0	0	112
54	L	32.8	Very low	31.2	Very low	136 Å²	136	131 Å²	131	71%	0.712	66%	0.663	S	S	*	*			trans	73.9	128.2	159.4	-66	179.7	0	0	0	118.9
55	N	31.6	Very low	31.2	Very low	127 Å²	127	129 Å²	129	68%	0.679	66%	0.658	S	S	*	*				71.8	144	83.1	-79.7	38	0	0	0	113.9
56	E	32.8	Very low	31.4	Very low	137 Å²	137	127.5 Å²	127.5	64%	0.64	66%	0.662	S	S	*	*			cis	-161.3	-179.1	15.9	-141	162.5	-102.7	0	0	113.7
57	Q	31	Very low	31.5	Very low	150 Å²	150	124.4 Å²	124.4	70%	0.701	66%	0.655	S	S	*	*			trans	68.2	152.2	155.7	-75.4	163.2	36.3	0	0	119.5
58	E	30.2	Very low	31.6	Very low	146 Å²	146	122.2 Å²	122.2	68%	0.682	65%	0.647	S	S	*	*			cis	-169.7	164.1	-26.2	-124.2	-167.7	158.8	0	0	109
59	L	29.5	Very low	31.8	Very low	130 Å²	130	117.6 Å²	117.6	68%	0.681	62%	0.623	S	S	*	*			trans	48.6	140.1	149.7	-56.1	168.9	0	0	0	120.1
60	N	29.5	Very low	31.9	Very low	107 Å²	107	118.6 Å²	118.6	57%	0.572	63%	0.625	S	S	*	*			cis	-172.1	170.8	8.1	-132.5	-22.3	0	0	0	111.9
61	F	28.9	Very low	31.8	Very low	162 Å²	162	121.8 Å²	121.8	71%	0.711	64%	0.635	S	S	*	*			trans	45.1	132.1	150.5	-67.9	-52.6	0	0	0	121.2
62	N	31.9	Very low	31.7	Very low	126 Å²	126	125.3 Å²	125.3	67%	0.674	65%	0.651	S	S	*	*			cis	-167.6	164.1	40.1	-113.3	-24.9	0	0	0	115.1
63	N	32.5	Very low	31.6	Very low	135 Å²	135	131.3 Å²	131.3	72%	0.722	67%	0.671	S	S	*	*			trans	73.9	84.5	151.8	-62.7	-7.9	0	0	0	124.2
64	F	29.3	Very low	31.6	Very low	197 Å²	197	129.7 Å²	129.7	86%	0.864	68%	0.675	S	S	*	*				66.2	129.9	110.1	-102.3	-123.9	0	0	0	125.8
65	V	31.6	Very low	31.3	Very low	116 Å²	116	130.7 Å²	130.7	70%	0.703	68%	0.681	S	S	*	*			trans	70.7	118	156.8	-166.2	0	0	0	0	117.1
66	S	33.1	Very low	31.3	Very low	105 Å²	105	129.7 Å²	129.7	73%	0.734	68%	0.683	S	S	*	*			cis	86.1	139.7	40.2	-47.9	0	0	0	0	114
67	T	33.1	Very low	31.1	Very low	87 Å²	87	130.6 Å²	130.6	53%	0.534	69%	0.69	S	S	.	*			cis	-170.4	169.2	36.8	53.8	0	0	0	0	114.9	A873	T67-A873 CarbonylContact C-O 3.39Å; T67-A873 VanDerWaalsContact C-O 3.25Å; T67-A873 PolarHBondContact O-N 3.47Å
68	T	35	Very low	31.1	Very low	89 Å²	89	130.1 Å²	130.1	55%	0.546	69%	0.691	S	S	.	*			trans	75.9	153	143.1	-60.1	0	0	0	0	123.1	A873 N874	T68-A873 PolarHBondContact N-O 2.89Å; T68-A873 CarbonylContact O-C 3.33Å; T68-A873 WeakPolarHBondContact O-CA 3.03Å; T68-N874 VanDerWaalsContact C-N 3.35Å; T68-N874 PolarHBondContact O-N 3.25Å
69	T	33	Very low	31	Very low	41 Å²	41	127.6 Å²	127.6	25%	0.252	69%	0.689	S	S	.	*				-131.6	-159.4	-123.2	-24.3	0	0	0	0	112.1	N874 V875 N876	T69-N874 HydrophobicContact CG2-CB 4.48Å; T69-V875 WeakPolarHBondContact OG1-CA 3.5Å; T69-V875 PolarHBondContact OG1-N 3.32Å; T69-V875 PolarHBondContact OG1-O 3.17Å; T69-N876 HydrophobicContact CG2-CB 4.43Å; T69-N876 PolarHBondContact OG1-N 2.86Å
70	V	33.5	Very low	31.1	Very low	112 Å²	112	128 Å²	128	68%	0.679	69%	0.691	S	S	*	*			cis	-149.5	159.5	39.1	178.9	0	0	0	0	112.3
71	N	31.6	Very low	31	Very low	97 Å²	97	126.7 Å²	126.7	52%	0.519	69%	0.691	S	S	.	*			trans	-29.1	129.6	174.1	-59.7	-45.2	0	0	0	118.6	N876	N71-N876 PolarHBondContact ND2-OD1 3.35Å; N71-N876 PolarHBondContact OD1-ND2 3.37Å
72	N	29.7	Very low	31	Very low	156 Å²	156	125.6 Å²	125.6	83%	0.834	69%	0.692	S	S	*	*			trans	-115.8	114.8	155.3	-106.8	-38	0	0	0	109.7
73	K	31.4	Very low	30.8	Very low	199 Å²	199	125.8 Å²	125.8	87%	0.865	69%	0.693	S	S	*	*			trans	-152.2	44.9	174.3	-148.3	173.3	-175.7	175.6	0	116
74	I	30.8	Very low	30.8	Very low	168 Å²	168	125.8 Å²	125.8	86%	0.862	69%	0.692	S	S	*	*			trans	-123.9	80.5	153.1	-55	-178.7	0	0	0	107.6
75	N	27.8	Very low	30.7	Very low	158 Å²	158	122.8 Å²	122.8	85%	0.845	69%	0.685	S	S	*	*			trans	-122.5	102.3	170.7	-97.8	-27.6	0	0	0	108.1
76	S	30.8	Very low	30.6	Very low	105 Å²	105	119.6 Å²	119.6	73%	0.734	67%	0.667	S	S	*	*			trans	-150.4	104.9	167.7	-170	0	0	0	0	110.3
77	M	29.1	Very low	30.5	Very low	156 Å²	156	121.7 Å²	121.7	77%	0.768	66%	0.663	S	S	*	*			trans	73.7	126.3	153.7	-60.3	-84	77	0	0	120.2
78	L	31.7	Very low	30.4	Very low	141 Å²	141	121.8 Å²	121.8	74%	0.738	66%	0.664	S	S	*	*			trans	69.4	108.6	151	-56.8	162.8	0	0	0	115.9
79	S	27.3	Very low	30.2	Very low	92 Å²	92	121.4 Å²	121.4	64%	0.643	66%	0.658	S	S	*	*			cis	67.8	139.9	20.2	99.9	0	0	0	0	116.5
80	I	30.6	Very low	30.1	Very low	138 Å²	138	123 Å²	123	71%	0.708	66%	0.663	S	S	*	*			trans	72.6	75.7	174.5	-47.8	173.9	0	0	0	115.5
81	S	27.9	Very low	30.1	Very low	81 Å²	81	121.6 Å²	121.6	57%	0.566	65%	0.651	S	S	*	*				26	152.6	111	-37.7	0	0	0	0	121.7
82	N	28.7	Very low	30.4	Very low	139 Å²	139	119.9 Å²	119.9	74%	0.743	65%	0.645	S	S	*	*			trans	75.6	106.7	146.7	-64.4	-8	0	0	0	119.3
83	N	29.3	Very low	30.4	Very low	129 Å²	129	119.3 Å²	119.3	69%	0.69	64%	0.636	S	S	*	*				122.4	139.2	95.5	-100.7	-16.3	0	0	0	118.9
84	L	31	Very low	30.4	Very low	136 Å²	136	116 Å²	116	71%	0.712	63%	0.626	S	S	*	*			trans	61.3	161	159.6	-81	86.6	0	0	0	118.7
85	L	28.2	Very low	30.3	Very low	134 Å²	134	115.2 Å²	115.2	70%	0.702	62%	0.618	S	S	*	*			cis	-172.2	127.7	-44.4	-156.7	80.1	0	0	0	108
86	S	28.2	Very low	30.5	Very low	49 Å²	49	116.6 Å²	116.6	34%	0.343	62%	0.617	S	S	.	*			trans	59	-176.5	153.6	75.8	0	0	0	0	114.3
87	K	32.6	Very low	30.3	Very low	149 Å²	149	118.1 Å²	118.1	65%	0.648	62%	0.617	S	S	*	*			cis	-92.4	135.6	-14.5	-78.7	-176.7	177.8	174.8	0	108.4	E809	K87-E809 CarbonylContact C-O 3.2Å; K87-E809 VanDerWaalsContact C-O 3.26Å
88	T	30.5	Very low	30.4	Very low	88 Å²	88	116.9 Å²	116.9	54%	0.54	61%	0.613	S	S	.	*				71.9	152.9	73.8	-44	0	0	0	0	110.5	E809	T88-E809 PolarHBondContact O-N 2.77Å
89	L	30.5	Very low	30.3	Very low	82 Å²	82	116 Å²	116	43%	0.429	61%	0.614	S	S	.	*			trans	96.4	154.7	157.6	-38	159.7	0	0	0	113.9	P807 I808	L89-P807 WeakPolarHBondContact CB-O 3.42Å; L89-I808 VanDerWaalsContact C-CA 3.47Å; L89-I808 WeakPolarHBondContact O-CG1 3.36Å
90	H	30.6	Very low	30.4	Very low	75 Å²	75	119.3 Å²	119.3	35%	0.347	62%	0.624	S	S	.	*			cis	171.7	148.5	-27.9	-146.7	47.9	0	0	0	113.5	H806 P807	H90-H806 CarbonylContact C-O 3.52Å; H90-H806 WeakPolarHBondContact CA-ND1 3.04Å; H90-H806 HydrophobicContact CB-CB 3.69Å; H90-H806 WeakPolarHBondContact CB-ND1 3.24Å; H90-H806 VanDerWaalsContact CD2-C 3.45Å; H90-H806 WeakPolarHBondContact CD2-CA 3.41Å; H90-H806 AromaticContact CG-CG 3.3Å; H90-H806 AromaticContact CG-ND1 3Å; H90-H806 WeakPolarHBondContact ND1-CB 3.48Å; H90-H806 AromaticContact ND1-CE1 3.86Å; H90-H806 AromaticContact ND1-CG 3.15Å; H90-H806 AromaticContact ND1-ND1 2.77Å; H90-H806 PolarHBondContact ND1-ND1 3.22Å; H90-P807 VanDerWaalsContact CB-CA 3.48Å; H90-P807 WeakPolarHBondContact CD2-CD 3.26Å; H90-P807 VanDerWaalsContact O-CA 3.23Å; H90-P807 WeakPolarHBondContact O-CA 3.01Å
91	N	33.1	Very low	30.6	Very low	82 Å²	82	117.9 Å²	117.9	44%	0.439	62%	0.624	S	S	.	*			trans	-2.2	-166.3	166.5	-110.6	-2	0	0	0	128.9	H806	N91-H806 CarbonylContact C-O 2.98Å; N91-H806 WeakPolarHBondContact CA-O 3.29Å; N91-H806 HydrophobicContact CB-CB 3.49Å; N91-H806 VanDerWaalsContact CB-CB 3.49Å; N91-H806 VanDerWaalsContact CB-CD2 3.46Å; N91-H806 WeakPolarHBondContact CB-CD2 3.34Å; N91-H806 WeakPolarHBondContact CB-O 3.29Å; N91-H806 VanDerWaalsContact N-CG 3.28Å; N91-H806 PolarHBondContact N-ND1 2.77Å; N91-H806 PolarHBondContact N-O 3.06Å; N91-H806 PolarHBondContact ND2-CD2 3.23Å
92	P	38.4	Very low	30.7	Very low	60 Å²	60	122.1 Å²	122.1	39%	0.39	64%	0.639	S	S	.	*			cis	-138.8	-179.1	-14.5	23.8	2.1	0	0	0	119.9	V804 N805	P92-V804 HydrophobicContact CB-CG1 4.14Å; P92-N805 WeakPolarHBondContact CG-OD1 3.27Å
93	F	30.9	Very low	30.6	Very low	145 Å²	145	121.2 Å²	121.2	64%	0.636	63%	0.634	S	S	*	*			trans	80.7	147.9	158.5	-64.7	-76.4	0	0	0	120.3	V804	F93-V804 HydrophobicContact CE1-CG1 4.15Å; F93-V804 HydrophobicContact CE2-CG1 4.39Å; F93-V804 HydrophobicContact CZ-CG1 3.96Å
94	I	30.3	Very low	30.7	Very low	129 Å²	129	121.6 Å²	121.6	66%	0.662	64%	0.636	S	S	*	*			cis	-154.9	167.3	-37	-130.7	-170.2	0	0	0	111.2
95	H	28.9	Very low	30.5	Very low	151 Å²	151	121.1 Å²	121.1	70%	0.699	63%	0.634	S	S	*	*			trans	-82.9	156.5	-177.3	-136.2	-94	0	0	0	114.2
96	F	30.9	Very low	30.7	Very low	188 Å²	188	121.4 Å²	121.4	83%	0.825	64%	0.637	S	S	*	*			trans	-147.8	142.5	144.2	-108.6	-73.5	0	0	0	111.2	L98	F96-L98 HydrophobicContact CD1-CD1 4.08Å; F96-L98 HydrophobicContact CD1-CG 4.39Å; F96-L98 HydrophobicContact CE1-CD1 4.09Å
97	N	26.8	Very low	30.8	Very low	136 Å²	136	126.5 Å²	126.5	73%	0.727	66%	0.655	S	S	*	*			trans	-156.6	109.3	-177.6	-172	17	0	0	0	109.8
98	L	31.7	Very low	31	Very low	130 Å²	130	127.7 Å²	127.7	68%	0.681	66%	0.662	S	S	*	*			trans	-159.6	146.1	-173.6	-69.7	176.1	0	0	0	107.7	F96	F96-L98 HydrophobicContact CD1-CD1 4.08Å; F96-L98 HydrophobicContact CD1-CG 4.39Å; F96-L98 HydrophobicContact CE1-CD1 4.09Å
99	T	30	Very low	31	Very low	124 Å²	124	130.9 Å²	130.9	76%	0.761	67%	0.671	S	S	*	*			cis	-161.4	149.7	-17.4	9.5	0	0	0	0	108.2
100	N	29.2	Very low	31.2	Very low	160 Å²	160	134.3 Å²	134.3	86%	0.856	68%	0.684	S	S	*	*			trans	-72.4	171	159.7	-94.4	-7.7	0	0	0	110.7
101	P	34.4	Very low	31.4	Very low	108 Å²	108	138.4 Å²	138.4	70%	0.701	70%	0.703	S	S	*	*			cis	-125.8	-174.4	-5.2	41.4	-27.4	0	0	0	112.7
102	L	31	Very low	31.4	Very low	170 Å²	170	138.3 Å²	138.3	89%	0.89	70%	0.703	S	S	*	*				-165.6	152.9	117.6	-107.2	168.4	0	0	0	112.2
103	N	25.7	Very low	31.3	Very low	120 Å²	120	141 Å²	141	64%	0.642	71%	0.71	S	S	*	*			trans	-85.4	139.7	175.1	-177.2	54.8	0	0	0	109.9
104	N	30.7	Very low	31.5	Very low	137 Å²	137	141 Å²	141	73%	0.733	71%	0.712	S	S	*	*				-179.5	155	127.6	-91.1	-9	0	0	0	112.3
105	N	27.4	Very low	31.5	Very low	126 Å²	126	140.2 Å²	140.2	67%	0.674	71%	0.709	S	S	*	*			trans	-50.5	156	164.2	-39.1	-38.2	0	0	0	110.2
106	D	32.4	Very low	31.8	Very low	140 Å²	140	140.2 Å²	140.2	75%	0.749	71%	0.709	S	S	*	*				-161.5	179.6	65.8	-97.6	-46.7	0	0	0	114.8
107	H	31	Very low	32	Very low	156 Å²	156	135.2 Å²	135.2	72%	0.722	69%	0.691	S	S	*	*			trans	-51.4	146.7	173	-55.1	-43.9	0	0	0	112.4
108	H	35.5	Very low	32.5	Very low	174 Å²	174	138.3 Å²	138.3	81%	0.806	69%	0.692	S	S	*	*				-164.1	159.7	70.2	-102.8	-83.6	0	0	0	114.6
109	H	32.2	Very low	32.6	Very low	155 Å²	155	139.6 Å²	139.6	72%	0.718	70%	0.7	S	S	*	*			trans	-60.7	154	156.9	-68.9	-55.1	0	0	0	111
110	H	34.8	Very low	32.9	Very low	155 Å²	155	140.5 Å²	140.5	72%	0.718	70%	0.695	S	S	*	*				-141.9	129.4	109.4	-114.4	-80.3	0	0	0	110.7	D112	H110-D112 IonicContact CE1-OD2 2.65Å; H110-D112 PolarHBondContact CE1-OD2 2.8Å; H110-D112 VanDerWaalsContact CE1-OD2 3.22Å; H110-D112 IonicContact ND1-OD2 3.75Å; H110-D112 PolarHBondContact ND1-OD2 3.22Å
111	H	34.4	Very low	33	Very low	160 Å²	160	140.7 Å²	140.7	74%	0.741	69%	0.691	S	S	*	*			trans	-70.2	-171.2	152.1	-100	-88.2	0	0	0	108.4
112	D	32.3	Very low	32.8	Very low	80 Å²	80	141.6 Å²	141.6	43%	0.428	69%	0.689	S	S	.	*			trans	135.5	129	137.8	-63.2	-19.5	0	0	0	112.1	H110 L1184	H110-D112 IonicContact CE1-OD2 2.65Å; H110-D112 PolarHBondContact CE1-OD2 2.8Å; H110-D112 VanDerWaalsContact CE1-OD2 3.22Å; H110-D112 IonicContact ND1-OD2 3.75Å; H110-D112 PolarHBondContact ND1-OD2 3.22Å; D112-L1184 HydrophobicContact CB-CD2 3.82Å
113	H	36.5	Very low	32.7	Very low	116 Å²	116	139.9 Å²	139.9	54%	0.537	68%	0.679	S	S	.	*			cis	-158	166.1	-5	-152.4	-79	0	0	0	112.3	L1182 L1184	H113-L1182 HydrophobicContact CB-CD2 3.43Å; H113-L1182 VanDerWaalsContact CB-CD2 3.43Å; H113-L1182 WeakPolarHBondContact ND1-CD2 3.25Å; H113-L1184 HydrophobicContact CB-CD2 4.03Å; H113-L1184 HydrophobicContact CB-CG 4.28Å
114	H	35.1	Very low	33.1	Very low	146 Å²	146	139.8 Å²	139.8	68%	0.676	68%	0.679	S	S	*	*			trans	-82.3	122.7	176.8	-89.7	-90.5	0	0	0	113.7	H116 L1182	H114-H116 HydrophobicContact CB-CB 4.5Å; H114-H116 PolarHBondContact O-N 2.85Å; H114-L1182 VanDerWaalsContact C-CD2 3.47Å; H114-L1182 WeakPolarHBondContact O-CD2 3Å; H114-L1182 VanDerWaalsContact O-CG 3.31Å; H114-L1182 WeakPolarHBondContact O-CG 3.44Å
115	D	29.5	Very low	33.3	Very low	112 Å²	112	140.8 Å²	140.8	60%	0.599	68%	0.679	S	S	*	*			trans	-77.6	113.6	153.5	-107.3	-44.3	0	0	0	108.5	L1182	D115-L1182 HydrophobicContact CB-CD1 4.18Å; D115-L1182 HydrophobicContact CB-CG 4.12Å; D115-L1182 WeakPolarHBondContact OD1-CB 3.44Å; D115-L1182 PolarHBondContact OD1-N 2.62Å
116	H	36.3	Very low	33.7	Very low	152 Å²	152	142 Å²	142	70%	0.704	68%	0.682	S	S	*	*			trans	-138.9	92.3	-175.5	-155.1	-22.6	0	0	0	110.6	H114	H114-H116 HydrophobicContact CB-CB 4.5Å; H114-H116 PolarHBondContact O-N 2.85Å
117	D	34.5	Very low	34	Very low	83 Å²	83	140.7 Å²	140.7	44%	0.444	68%	0.675	S	S	.	*			trans	-75.4	132.8	-174.7	-112.9	-49	0	0	0	112.9	K1179 H1180	D117-K1179 WeakPolarHBondContact OD2-CA 2.77Å; D117-K1179 PolarHBondContact OD2-N 2.86Å; D117-H1180 PolarHBondContact OD1-N 3.33Å; D117-H1180 PolarHBondContact OD2-N 3.03Å
118	R	36.8	Very low	34	Very low	200 Å²	200	141.1 Å²	141.1	76%	0.755	68%	0.683	S	S	*	*			trans	-124.7	152.4	163.6	-74.3	-174.6	178.1	-172.2	1.8	107.7
119	D	35.2	Very low	33.8	Very low	157 Å²	157	137.4 Å²	137.4	84%	0.84	68%	0.677	S	S	*	*			trans	-141.3	163	140.6	-141.3	-25.2	0	0	0	111.3
120	H	35.7	Very low	34	Very low	143 Å²	143	137.7 Å²	137.7	66%	0.662	68%	0.678	S	S	*	*			trans	-98	-171.3	-160.7	-93	-97.1	0	0	0	114.3
121	Q	30.9	Very low	34.1	Very low	164 Å²	164	137.7 Å²	137.7	77%	0.766	68%	0.677	S	S	*	*			trans	92.4	135.6	157.8	-53.8	-171.2	18.1	0	0	116
122	L	31.6	Very low	34.2	Very low	128 Å²	128	136 Å²	136	67%	0.67	67%	0.671	S	S	*	*			cis	-164.8	162.9	-3.2	-109.4	166.1	0	0	0	108.7
123	I	28.9	Very low	34.3	Very low	133 Å²	133	141 Å²	141	68%	0.682	69%	0.692	S	S	*	*			trans	66.3	132	146.9	-77.2	163.7	0	0	0	117
124	D	33.5	Very low	34.1	Very low	118 Å²	118	140.2 Å²	140.2	63%	0.631	70%	0.7	S	S	*	*			cis	-148	137.3	9.9	-87.1	-24.7	0	0	0	109.5
125	E	34	Very low	33.7	Very low	159 Å²	159	141.1 Å²	141.1	74%	0.743	71%	0.706	S	S	*	*				84.4	133.5	91.5	-63.3	-162.4	141.7	0	0	118.2
126	M	36.4	Very low	33.9	Very low	151 Å²	151	143.8 Å²	143.8	74%	0.744	72%	0.715	S	S	*	*			trans	61.8	143.9	155.1	-64.4	166	75.1	0	0	119.2
127	D	38	Very low	33.8	Very low	112 Å²	112	144.7 Å²	144.7	60%	0.599	72%	0.72	S	S	*	*			cis	-151.7	154.5	4.1	-123.6	-23.7	0	0	0	111.6
128	N	32.5	Very low	33.6	Very low	165 Å²	165	147 Å²	147	88%	0.882	73%	0.732	S	S	*	*			trans	165.1	71.6	150.9	-89.4	-26.3	0	0	0	111.6
129	S	31.2	Very low	33.4	Very low	96 Å²	96	143.7 Å²	143.7	67%	0.671	73%	0.725	S	S	*	*			trans	-67.7	134.7	146.1	49.3	0	0	0	0	108.3
130	E	36.4	Very low	33.2	Very low	162 Å²	162	145.1 Å²	145.1	76%	0.757	72%	0.719	S	S	*	*				178.8	158.4	92.4	-88.1	-174.3	162.2	0	0	106.8
131	F	35.6	Very low	32.9	Very low	155 Å²	155	144.1 Å²	144.1	68%	0.68	72%	0.717	S	S	*	*			cis	-150	127.9	16	-145.9	-124.3	0	0	0	106.1
132	I	36.7	Very low	32.7	Very low	123 Å²	123	143.9 Å²	143.9	63%	0.631	72%	0.716	S	S	*	*				60.1	130.1	99.4	-62	-176.9	0	0	0	113.6
133	H	36	Very low	32.6	Very low	185 Å²	185	143.2 Å²	143.2	86%	0.856	71%	0.713	S	S	*	*			cis	-139.1	165.1	29.2	-144.4	-75.7	0	0	0	114.3
134	S	31.1	Very low	32.9	Very low	100 Å²	100	143.3 Å²	143.3	70%	0.699	71%	0.711	S	S	*	*			trans	-96.9	160.1	-168.8	-168	0	0	0	0	116.7
135	M	26.3	Very low	33.1	Very low	165 Å²	165	144.6 Å²	144.6	81%	0.813	71%	0.714	S	S	*	*			trans	-64.7	145.5	151.2	-73.6	175.1	60.6	0	0	111
136	Q	34.9	Very low	33.1	Very low	169 Å²	169	142.8 Å²	142.8	79%	0.79	71%	0.71	S	S	*	*				172.2	169.5	126.7	-100.5	-176	-7.7	0	0	111.7
137	Q	34.5	Very low	33	Very low	171 Å²	171	145 Å²	145	80%	0.799	71%	0.711	S	S	*	*			trans	70.2	146.8	165.6	-70.5	167.9	26.8	0	0	117.4
138	N	28.6	Very low	32.9	Very low	130 Å²	130	143.9 Å²	143.9	70%	0.695	71%	0.712	S	S	*	*			cis	-167.3	155.1	-30.9	-134.2	10	0	0	0	109.1
139	E	33.9	Very low	33	Very low	132 Å²	132	141.1 Å²	141.1	62%	0.617	70%	0.702	S	S	*	*			trans	63.5	166.6	155.6	-64.5	-168.8	138.3	0	0	116.1
140	R	30.5	Very low	33.1	Very low	187 Å²	187	143.4 Å²	143.4	71%	0.706	71%	0.705	S	S	*	*			cis	-161.2	154.2	-20.3	-113.9	175.9	-161.2	-144	17.9	109.9
141	I	28.9	Very low	32.9	Very low	121 Å²	121	141 Å²	141	62%	0.621	70%	0.702	S	S	*	*			trans	63.3	110.7	138.7	-68.5	173.6	0	0	0	120.1
142	Q	28.4	Very low	32.9	Very low	160 Å²	160	138.6 Å²	138.6	75%	0.748	70%	0.702	S	S	*	*			trans	77.1	141.7	133.9	-78.6	-178.8	-20.6	0	0	124
143	N	28	Very low	32.5	Very low	113 Å²	113	138.1 Å²	138.1	60%	0.604	71%	0.705	S	S	*	*			trans	70	148.3	139	-65	19.3	0	0	0	118
144	E	35.7	Very low	32.1	Very low	136 Å²	136	134.5 Å²	134.5	64%	0.636	70%	0.701	S	S	*	*			cis	-161.2	153.2	2.8	-126.3	159.9	-143.4	0	0	110.6
145	M	36.7	Very low	32	Very low	144 Å²	144	134.5 Å²	134.5	71%	0.709	70%	0.7	S	S	*	*			trans	63.4	160.7	155.9	-66.4	-174	-74	0	0	117.4
146	N	34.2	Very low	32.1	Very low	121 Å²	121	131.5 Å²	131.5	65%	0.647	70%	0.696	S	S	*	*			cis	-165.3	161.6	-18.4	-101.9	-6	0	0	0	106.6
147	Y	35.1	Very low	31.9	Very low	197 Å²	197	128 Å²	128	77%	0.773	70%	0.696	S	S	*	*			cis	-160.2	170.4	1.1	-144.5	-146	0	0	0	109.4
148	S	35.7	Very low	31.6	Very low	89 Å²	89	124.7 Å²	124.7	62%	0.622	69%	0.691	S	S	*	*			trans	65.2	146.8	148.7	-77.7	0	0	0	0	121
149	T	33.7	Very low	31.7	Very low	108 Å²	108	123 Å²	123	66%	0.663	69%	0.69	S	S	*	*			cis	-166	132.6	-5.9	-106.6	0	0	0	0	111.1
150	L	34.7	Very low	31.5	Very low	143 Å²	143	121.8 Å²	121.8	75%	0.749	70%	0.696	S	S	*	*			trans	52.5	131.8	157.5	-53	171.3	0	0	0	119.9
151	T	31.5	Very low	31.6	Very low	113 Å²	113	117.6 Å²	117.6	69%	0.693	70%	0.696	S	S	*	*			cis	78.8	151.3	27.5	79	0	0	0	0	116.2
152	P	36.5	Very low	31.9	Very low	103 Å²	103	119.8 Å²	119.8	67%	0.669	71%	0.707	S	S	*	*			cis	-148.4	-161.6	-37.8	39.6	-18.7	0	0	0	114.6
153	T	28.2	Very low	32.3	Very low	114 Å²	114	115.7 Å²	115.7	70%	0.699	70%	0.701	S	S	*	*			trans	70.2	135.7	146.3	48.6	0	0	0	0	123.8
154	S	27.8	Very low	32.6	Very low	109 Å²	109	117.3 Å²	117.3	76%	0.762	72%	0.715	S	S	*	*			trans	66.8	149.2	140.3	57.2	0	0	0	0	120.4
155	S	28.4	Very low	32.6	Very low	99 Å²	99	114.8 Å²	114.8	69%	0.692	72%	0.717	S	S	*	*			cis	-169.8	163.7	-12	47.3	0	0	0	0	111.8
156	S	27.8	Very low	32.5	Very low	102 Å²	102	112.8 Å²	112.8	71%	0.713	72%	0.724	S	S	*	*			trans	61.6	139.8	142.5	62.5	0	0	0	0	122.3
157	A	31.8	Very low	32.6	Very low	97 Å²	97	111.2 Å²	111.2	80%	0.802	73%	0.727	S	S	*	*			trans	67.6	158.5	150.7	0	0	0	0	0	118.7
158	S	27.9	Very low	32.7	Very low	100 Å²	100	106.3 Å²	106.3	70%	0.699	73%	0.727	S	S	*	*			cis	-171.9	174.7	-39.7	56.7	0	0	0	0	108.5
159	S	29.7	Very low	32.8	Very low	96 Å²	96	107 Å²	107	67%	0.671	73%	0.732	S	S	*	*			trans	57.4	97	148.7	54.1	0	0	0	0	120.4
160	S	31.4	Very low	33	Very low	106 Å²	106	107 Å²	107	74%	0.741	74%	0.737	S	S	*	*				79.7	131.4	114.8	70.6	0	0	0	0	123.7
161	S	32.3	Very low	33.2	Very low	99 Å²	99	106.8 Å²	106.8	69%	0.692	74%	0.736	S	S	*	*				112.4	132.6	126.1	79.7	0	0	0	0	119.7
162	L	34.7	Very low	33.5	Very low	166 Å²	166	106.7 Å²	106.7	87%	0.869	74%	0.735	S	S	*	*			trans	54	141.9	131.9	-64.3	170.8	0	0	0	120.3
163	A	35.8	Very low	33.5	Very low	75 Å²	75	109.5 Å²	109.5	62%	0.62	74%	0.739	S	S	*	*			cis	-171.8	-175.7	-6.9	0	0	0	0	0	111.5
164	V	34.3	Very low	33.8	Very low	147 Å²	147	107.8 Å²	107.8	89%	0.891	73%	0.731	S	S	*	*			trans	73.3	143.1	149.3	159.2	0	0	0	0	118.3
165	A	35.8	Very low	34.2	Very low	83 Å²	83	108.8 Å²	108.8	69%	0.686	73%	0.727	S	S	*	*			cis	-171	164.4	-28.1	0	0	0	0	0	111.5
166	A	34.7	Very low	34.5	Very low	102 Å²	102	112 Å²	112	84%	0.843	73%	0.729	S	S	*	*			trans	68.3	163.4	151.8	0	0	0	0	0	118.3
167	A	37	Very low	34.7	Very low	87 Å²	87	114 Å²	114	72%	0.719	73%	0.73	S	S	*	*			cis	-155.4	155.1	0.1	0	0	0	0	0	113
168	A	37.9	Very low	34.7	Very low	94 Å²	94	116.7 Å²	116.7	78%	0.777	72%	0.723	S	S	*	*			trans	56	156	138.9	0	0	0	0	0	122.9
169	S	37.9	Very low	34.8	Very low	103 Å²	103	116.7 Å²	116.7	72%	0.72	72%	0.72	S	S	*	*			cis	-173.4	134.9	-24	-91.8	0	0	0	0	112.7
170	S	36.8	Very low	34.8	Very low	110 Å²	110	119.2 Å²	119.2	77%	0.769	72%	0.723	S	S	*	*			trans	68.1	176.6	145.6	80.3	0	0	0	0	119.5
171	L	38.9	Very low	34.6	Very low	138 Å²	138	119.7 Å²	119.7	72%	0.723	72%	0.717	S	S	*	*			cis	-159.5	143.4	13.1	-134.2	-169.1	0	0	0	112.2
172	T	38.1	Very low	34.3	Very low	110 Å²	110	121.3 Å²	121.3	68%	0.675	72%	0.717	S	S	*	*			trans	61.8	165.6	155.3	31.6	0	0	0	0	120.2
173	E	36.8	Very low	34	Very low	163 Å²	163	117.9 Å²	117.9	76%	0.762	70%	0.699	S	S	*	*			cis	-147.5	133.7	18.2	-170.5	145.5	-158.6	0	0	116.6
174	C	34.4	Very low	33.9	Very low	78 Å²	78	117.1 Å²	117.1	53%	0.527	69%	0.688	S	S	.	*			trans	25.8	160.2	137.9	-58.9	0	0	0	0	124.4
175	L	36.6	Very low	33.5	Very low	130 Å²	130	117.2 Å²	117.2	68%	0.681	68%	0.676	S	S	*	*			cis	-170.9	-172.9	-6.6	-112.8	172.3	0	0	0	112.2
176	K	34.8	Very low	33.1	Very low	167 Å²	167	117.6 Å²	117.6	73%	0.726	67%	0.674	S	S	*	*			trans	80.9	161.8	163.8	-48.1	172.2	-168.6	167.9	0	115	R1372	K176-R1372 PolarHBondContact O-NH1 2.7Å
177	I	31.7	Very low	32.8	Very low	144 Å²	144	118.3 Å²	118.3	74%	0.738	67%	0.668	S	S	*	*				-163	147.6	-59.9	-105.2	157.3	0	0	0	106.2
178	K	32.4	Very low	32.4	Very low	152 Å²	152	120.4 Å²	120.4	66%	0.661	67%	0.672	S	S	*	*			cis	-116.2	-146.4	-19.8	-110.7	-177.8	170.2	-177.1	0	106.7	R1372	K178-R1372 PolarHBondContact O-NH2 2.98Å
179	T	29.1	Very low	31.9	Very low	101 Å²	101	122.7 Å²	122.7	62%	0.62	67%	0.671	S	S	*	*			cis	77.5	151.5	3.1	105	0	0	0	0	118.3
180	M	29	Very low	31.5	Very low	149 Å²	149	123.9 Å²	123.9	73%	0.734	67%	0.673	S	S	*	*			cis	-145	149.1	1.1	-107.1	-156.9	172.3	0	0	112.5
181	N	27.9	Very low	31.1	Very low	115 Å²	115	124.2 Å²	124.2	62%	0.615	67%	0.671	S	S	*	*			trans	38.2	136.3	131.8	-50.5	7.4	0	0	0	123.5
182	N	26.9	Very low	30.7	Very low	133 Å²	133	125 Å²	125	71%	0.711	68%	0.675	S	S	*	*				80.4	134.8	126.1	-78.2	12.5	0	0	0	124
183	I	27	Very low	30.2	Very low	95 Å²	95	125 Å²	125	49%	0.487	67%	0.671	S	S	.	*			trans	83.2	133.4	140.8	-72	162.2	0	0	0	116.5	Y829	I183-Y829 HydrophobicContact CD1-CE2 3.96Å; I183-Y829 VanDerWaalsContact CD1-OH 3.31Å; I183-Y829 WeakPolarHBondContact CD1-OH 3.44Å; I183-Y829 HydrophobicContact CG1-CE2 4.07Å; I183-Y829 HydrophobicContact CG2-CD2 4.14Å; I183-Y829 HydrophobicContact CG2-CE2 3.83Å
184	P	34.2	Very low	29.8	Very low	58 Å²	58	121.8 Å²	121.8	38%	0.377	65%	0.654	S	S	.	*			trans	-101	177.4	-168	42.2	-38.2	0	0	0	112.7	L827	P184-L827 HydrophobicContact CG-CB 3.82Å; P184-L827 HydrophobicContact CG-CD1 3.95Å; P184-L827 HydrophobicContact CG-CD2 4.46Å; P184-L827 HydrophobicContact CG-CG 4.28Å
185	F	26.6	Very low	29.5	Very low	149 Å²	149	121.8 Å²	121.8	65%	0.654	65%	0.65	S	S	*	*			trans	-153.3	164	137.6	-114.8	-73.3	0	0	0	112.8	Y829	F185-Y829 VanDerWaalsContact CE2-CB 3.45Å; F185-Y829 HydrophobicContact CE2-CG 4.38Å; F185-Y829 WeakPolarHBondContact CZ-O 3.36Å
186	S	27.6	Very low	29	Very low	91 Å²	91	119.6 Å²	119.6	64%	0.636	64%	0.637	S	S	*	*			trans	-47.3	149.2	-178.7	-54	0	0	0	0	118.2
187	T	27.3	Very low	28.6	Very low	117 Å²	117	117.9 Å²	117.9	72%	0.718	64%	0.635	S	S	*	*				51.3	107.2	128.4	-49.1	0	0	0	0	119.4
188	V	28.7	Very low	28.4	Very low	131 Å²	131	115.3 Å²	115.3	79%	0.794	62%	0.62	S	S	*	*			trans	-132.2	122.8	135.9	-179.8	0	0	0	0	108.4	V190	V188-V190 HydrophobicContact CG1-CG2 4.2Å
189	N	26.4	Very low	28.3	Very low	143 Å²	143	114.6 Å²	114.6	77%	0.765	62%	0.619	S	S	*	*			trans	-76.4	129.4	166	-77.7	-21.4	0	0	0	109.1
190	V	31	Very low	28.3	Very low	127 Å²	127	117.4 Å²	117.4	77%	0.77	63%	0.625	S	S	*	*			trans	-131.6	90.3	153	-174.6	0	0	0	0	108.7	V188	V188-V190 HydrophobicContact CG1-CG2 4.2Å
191	T	28.2	Very low	28.2	Very low	118 Å²	118	118 Å²	118	72%	0.724	62%	0.624	S	S	*	*			trans	-71.6	119.2	162.2	40.2	0	0	0	0	110.1
192	L	29.5	Very low	28.1	Very low	155 Å²	155	118.4 Å²	118.4	81%	0.812	63%	0.626	S	S	*	*			trans	-137.7	102.4	141.8	-81.6	174.9	0	0	0	105.7
193	N	28.1	Very low	28.1	Very low	109 Å²	109	116.7 Å²	116.7	58%	0.583	62%	0.62	S	S	*	*				51.1	115.6	81.9	-87.7	-8.9	0	0	0	113.9
194	K	29	Very low	28	Very low	95 Å²	95	118.6 Å²	118.6	41%	0.413	63%	0.627	S	S	.	*				69.1	140.9	126.6	-55.9	-179	90.6	157	0	117.4	I846 T847 T848	K194-I846 PolarHBondContact NZ-O 2.88Å; K194-T847 VanDerWaalsContact NZ-CA 3.25Å; K194-T848 PolarHBondContact NZ-OG1 3.02Å
195	D	27.2	Very low	27.8	Very low	79 Å²	79	122.3 Å²	122.3	42%	0.422	64%	0.637	S	S	.	*			cis	-152.1	150.8	-10.3	-107	-26.5	0	0	0	111.6	T848 D849	D195-T848 VanDerWaalsContact OD2-C 3.23Å; D195-T848 WeakPolarHBondContact OD2-CA 2.91Å; D195-T848 PolarHBondContact OD2-N 2.7Å; D195-D849 PolarHBondContact OD2-N 3.46Å; D195-D849 VanDerWaalsContact OD2-N 3.08Å
196	I	27	Very low	27.7	Very low	83 Å²	83	121.2 Å²	121.2	43%	0.426	64%	0.637	S	S	.	*			trans	-9.9	128.1	155.2	8.5	177.2	0	0	0	117.9	D849 F850	I196-D849 CarbonylContact O-C 2.7Å; I196-F850 CarbonylContact C-O 3.53Å; I196-F850 VanDerWaalsContact C-O 3.29Å; I196-F850 VanDerWaalsContact CB-O 3.29Å; I196-F850 WeakPolarHBondContact CB-O 3.39Å; I196-F850 PolarHBondContact O-N 2.79Å
197	I	25.4	Very low	27.7	Very low	131 Å²	131	118.9 Å²	118.9	67%	0.672	63%	0.627	S	S	*	*			trans	-162.1	144.6	145.8	-108.2	163.3	0	0	0	114.7	F850	I197-F850 VanDerWaalsContact CA-O 3.23Å; I197-F850 WeakPolarHBondContact CA-O 3.13Å; I197-F850 HydrophobicContact CD1-CD2 4.33Å; I197-F850 HydrophobicContact CG1-CB 4.36Å; I197-F850 PolarHBondContact N-O 3.04Å
198	E	27.1	Very low	27.8	Very low	91 Å²	91	121.2 Å²	121.2	43%	0.425	64%	0.636	S	S	.	*			trans	-29.1	136.3	170.3	-88.7	158.2	-149.2	0	0	120.5	S851 Q852	E198-S851 VanDerWaalsContact CG-OG 3.27Å; E198-S851 WeakPolarHBondContact CG-OG 3.47Å; E198-S851 WeakPolarHBondContact OE1-CB 3.27Å; E198-S851 PolarHBondContact OE1-OG 2.81Å; E198-Q852 HydrophobicContact CG-CB 3.75Å; E198-Q852 HydrophobicContact CG-CG 4.22Å; E198-Q852 PolarHBondContact OE1-NE2 3.46Å; E198-Q852 PolarHBondContact OE2-NE2 2.87Å
199	Q	31.8	Very low	27.7	Very low	137 Å²	137	121.2 Å²	121.2	64%	0.64	64%	0.636	S	S	*	*			trans	34	115.3	132.1	-58.6	-178.3	9.4	0	0	119.8
200	Q	27.9	Very low	27.8	Very low	160 Å²	160	126 Å²	126	75%	0.748	64%	0.643	S	S	*	*			trans	-167.4	138.2	137.8	-111.9	163.6	63.2	0	0	114
201	F	26.5	Very low	27.6	Very low	161 Å²	161	124.7 Å²	124.7	71%	0.706	63%	0.632	S	S	*	*			trans	64.1	153.1	145.9	-63.1	-32.1	0	0	0	120.2
202	N	26.1	Very low	27.9	Very low	124 Å²	124	123.7 Å²	123.7	66%	0.663	62%	0.622	S	S	*	*			cis	-169	149.3	-17.7	-115.6	-12.6	0	0	0	113.7
203	V	26.8	Very low	27.9	Very low	97 Å²	97	120.4 Å²	120.4	59%	0.588	61%	0.606	S	S	*	*			trans	72.2	135.2	131.3	171.9	0	0	0	0	123.8
204	Q	26.1	Very low	28.1	Very low	134 Å²	134	120 Å²	120	63%	0.626	60%	0.604	S	S	*	*	B	Isolated β-bridge	trans	70.9	156.4	158.7	-79.8	164.6	51.3	0	0	118.6	N759 S760	Q204-N759 CarbonylContact C-O 3.54Å; Q204-N759 VanDerWaalsContact CA-O 3.28Å; Q204-N759 WeakPolarHBondContact CA-O 3.29Å; Q204-S760 VanDerWaalsContact C-N 3.3Å; Q204-S760 CarbonylContact C-O 3.54Å; Q204-S760 VanDerWaalsContact C-O 3.29Å; Q204-S760 VanDerWaalsContact O-O 3.07Å
205	K	28.5	Very low	28.2	Very low	137 Å²	137	120.6 Å²	120.6	60%	0.596	61%	0.611	S	S	*	*			cis	-152.2	113.7	9.9	-164.4	171.1	179.9	176.1	0	118.1	N759 S760 N761	K205-N759 CarbonylContact C-O 2.82Å; K205-N759 WeakPolarHBondContact CA-O 3.43Å; K205-N759 PolarHBondContact N-O 3.25Å; K205-S760 PolarHBondContact N-O 3.02Å; K205-N761 PolarHBondContact O-ND2 3.1Å; K205-N761 PolarHBondContact O-OD1 3.35Å; K205-N761 VanDerWaalsContact O-OD1 3.09Å
206	L	26.5	Very low	28.5	Very low	125 Å²	125	123.2 Å²	123.2	65%	0.654	63%	0.625	S	S	*	*			trans	61.9	139.3	160.8	-83.1	82.1	0	0	0	122.1	N759 S760 N761	L206-N759 PolarHBondContact N-O 3.34Å; L206-S760 VanDerWaalsContact CA-OG 3.32Å; L206-S760 WeakPolarHBondContact CA-OG 3.33Å; L206-S760 PolarHBondContact N-OG 3.45Å; L206-S760 VanDerWaalsContact N-OG 3.08Å; L206-S760 PolarHBondContact O-OG 3.09Å; L206-N761 PolarHBondContact O-OD1 3.49Å
207	G	27.5	Very low	28.8	Very low	42 Å²	42	125.2 Å²	125.2	43%	0.433	64%	0.637	S	S	.	*			trans	-170.4	12.1	179.1	0	0	0	0	0	124.2
208	N	27.6	Very low	29.3	Very low	167 Å²	167	125 Å²	125	89%	0.893	64%	0.637	S	S	*	*			trans	64.6	132.3	169.5	-71.2	-0	0	0	0	122.5
209	T	27.9	Very low	29.6	Very low	131 Å²	131	126.3 Å²	126.3	80%	0.804	65%	0.647	S	S	*	*			trans	-115.4	150.2	178.9	51.4	0	0	0	0	112.7
210	R	27.3	Very low	29.5	Very low	242 Å²	242	125.7 Å²	125.7	91%	0.913	65%	0.648	S	S	*	*			trans	-170.6	114.5	135.2	-106.1	159.9	175.3	160.6	-2.7	108.4
211	N	28.1	Very low	29.7	Very low	100 Å²	100	123.6 Å²	123.6	54%	0.535	64%	0.642	S	S	.	*			cis	77.9	103.8	49.6	-175.5	97.3	0	0	0	113.4	N213	N211-N213 PolarHBondContact ND2-ND2 3.04Å
212	D	33.6	Very low	30	Very low	97 Å²	97	123.8 Å²	123.8	52%	0.519	64%	0.642	S	S	.	*			trans	-130.9	135.7	135.6	-98	-47	0	0	0	110.6	N450 L451	D212-N450 PolarHBondContact OD1-ND2 3.1Å; D212-N450 PolarHBondContact OD2-ND2 2.92Å; D212-L451 HydrophobicContact CB-CD2 3.95Å; D212-L451 WeakPolarHBondContact OD1-CD2 3.38Å; D212-L451 WeakPolarHBondContact OD1-CG 3.28Å
213	N	30.4	Very low	30.2	Very low	87 Å²	87	124.8 Å²	124.8	47%	0.465	65%	0.647	S	S	.	*			trans	-71.9	178.7	-177.4	-76.8	-57.7	0	0	0	111.4	N211 L451	N211-N213 PolarHBondContact ND2-ND2 3.04Å; N213-L451 HydrophobicContact CB-CD1 4.27Å; N213-L451 HydrophobicContact CB-CD2 3.84Å; N213-L451 VanDerWaalsContact N-CD2 3.34Å; N213-L451 WeakPolarHBondContact O-CD2 3.16Å
214	N	31.4	Very low	30.4	Very low	100 Å²	100	124.1 Å²	124.1	54%	0.535	65%	0.647	S	S	.	*			cis	-156.1	157.1	28.1	-149.1	-8.5	0	0	0	113.9	R453	N214-R453 VanDerWaalsContact O-CZ 3.29Å; N214-R453 PolarHBondContact O-NH1 2.92Å; N214-R453 PolarHBondContact O-NH2 3.2Å
215	N	31.7	Very low	30.6	Very low	107 Å²	107	124.5 Å²	124.5	57%	0.572	65%	0.653	S	S	*	*			trans	-70.6	169.7	174.2	-64.4	-53.7	0	0	0	111.2	R453	N215-R453 PolarHBondContact O-NH1 3.07Å
216	N	34.3	Very low	30.5	Very low	134 Å²	134	124.5 Å²	124.5	72%	0.717	66%	0.658	S	S	*	*				-179.4	115	102.8	-92.1	-1.3	0	0	0	110.6
217	N	33.4	Very low	30.6	Very low	126 Å²	126	123.5 Å²	123.5	67%	0.674	66%	0.661	S	S	*	*			trans	-17.8	153.2	135.2	-44.2	-8.7	0	0	0	113.4
218	D	35	Very low	30.7	Very low	126 Å²	126	128.8 Å²	128.8	67%	0.674	68%	0.679	S	S	*	*				-160.9	141.9	72.5	-99.3	-22	0	0	0	113.2
219	N	32.7	Very low	30.8	Very low	119 Å²	119	126.8 Å²	126.8	64%	0.636	68%	0.675	S	S	*	*				44.6	136.4	124.7	-51.2	-26.2	0	0	0	118.4
220	N	29.6	Very low	30.9	Very low	123 Å²	123	126.2 Å²	126.2	66%	0.658	68%	0.676	S	S	*	*			cis	-173.6	144	29.4	-130.7	-13.1	0	0	0	112.3
221	L	33.3	Very low	31	Very low	117 Å²	117	120.7 Å²	120.7	61%	0.613	67%	0.67	S	S	*	*			trans	54.7	143.1	134.4	-78.4	170.3	0	0	0	122.9
222	K	33.3	Very low	31	Very low	164 Å²	164	120.8 Å²	120.8	71%	0.713	68%	0.678	S	S	*	*			trans	78.3	134.5	146.3	-71.6	159.6	-175.1	174.1	0	115.9
223	N	29.7	Very low	30.6	Very low	145 Å²	145	123.1 Å²	123.1	78%	0.775	69%	0.69	S	S	*	*			cis	-162.7	165.8	1.9	-133.5	4.5	0	0	0	115.1
224	S	31.7	Very low	30.5	Very low	84 Å²	84	127.2 Å²	127.2	59%	0.587	70%	0.704	S	S	*	*			trans	81.2	98.1	132.7	-175.5	0	0	0	0	121.9
225	L	28.7	Very low	30.3	Very low	142 Å²	142	128.1 Å²	128.1	74%	0.743	71%	0.713	S	S	*	*				77.1	120	122	-57.9	-179.1	0	0	0	122.2
226	I	27.9	Very low	30.2	Very low	137 Å²	137	127.4 Å²	127.4	70%	0.703	72%	0.717	S	S	*	*				65.7	120.4	120.9	-60	-178.4	0	0	0	120.1
227	S	27.2	Very low	30	Very low	103 Å²	103	125.9 Å²	125.9	72%	0.72	71%	0.712	S	S	*	*			trans	-18.7	135.6	161.7	57.3	0	0	0	0	120.6
228	L	30.6	Very low	30	Very low	154 Å²	154	128.3 Å²	128.3	81%	0.806	72%	0.719	S	S	*	*			trans	-136.4	145.2	140.4	-81.7	98.5	0	0	0	110.6
229	P	28.3	Very low	29.9	Very low	124 Å²	124	126.1 Å²	126.1	81%	0.805	72%	0.719	S	S	*	*			trans	-92.4	108.9	168.9	33.6	-28.4	0	0	0	110.8	T231	P229-T231 PolarHBondContact O-N 3.35Å
230	S	31.6	Very low	30	Very low	120 Å²	120	125 Å²	125	84%	0.839	72%	0.72	S	S	*	*			trans	-89.9	96.7	-174.2	-58.2	0	0	0	0	113.6
231	T	28.4	Very low	30.2	Very low	126 Å²	126	128 Å²	128	77%	0.773	73%	0.727	S	S	*	*			trans	-90.5	156.2	160	43.1	0	0	0	0	111.6	P229	P229-T231 PolarHBondContact O-N 3.35Å
232	S	27.4	Very low	30.3	Very low	102 Å²	102	126.8 Å²	126.8	71%	0.713	73%	0.728	S	S	*	*			trans	77.1	115.5	164	76.1	0	0	0	0	121.1
233	L	27.1	Very low	30.5	Very low	145 Å²	145	124.1 Å²	124.1	76%	0.759	73%	0.73	S	S	*	*				70.1	147.1	119.4	-61.5	172.4	0	0	0	124.3
234	F	27.9	Very low	31	Very low	173 Å²	173	123 Å²	123	76%	0.759	73%	0.729	S	S	*	*			trans	74	118.6	157.6	-64.7	-60.9	0	0	0	124.1
235	T	26.3	Very low	31.4	Very low	120 Å²	120	121.5 Å²	121.5	74%	0.736	72%	0.718	S	S	*	*			trans	-3	152.1	135.8	54.8	0	0	0	0	119.2
236	S	29.1	Very low	31.9	Very low	92 Å²	92	121 Å²	121	64%	0.643	71%	0.71	S	S	*	*			cis	-173.3	143.8	41.5	-154.9	0	0	0	0	116.9
237	T	31	Very low	32.4	Very low	102 Å²	102	119.7 Å²	119.7	63%	0.626	70%	0.7	S	S	*	*			trans	47.5	147.6	138.1	55.7	0	0	0	0	126.7
238	H	33.7	Very low	33	Very low	177 Å²	177	119 Å²	119	82%	0.819	69%	0.694	S	S	*	*			trans	91.2	145.3	153.2	-58.7	-56.4	0	0	0	119.9
239	A	32.9	Very low	33.5	Very low	80 Å²	80	118.5 Å²	118.5	66%	0.661	69%	0.688	S	S	*	*			cis	-171.8	165	-21.2	0	0	0	0	0	113.7
240	S	33.7	Very low	33.9	Very low	96 Å²	96	120 Å²	120	67%	0.671	68%	0.684	S	S	*	*			trans	77	154.4	159.1	-60.2	0	0	0	0	119.6
241	K	34.5	Very low	34.2	Very low	186 Å²	186	120.6 Å²	120.6	81%	0.809	67%	0.673	S	S	*	*			cis	-174.4	175.4	-10.2	-99.4	165.5	-165.6	164.4	0	109
242	S	35.8	Very low	34.5	Very low	90 Å²	90	122.6 Å²	122.6	63%	0.629	67%	0.674	S	S	*	*				-179.1	136.5	-50.4	57	0	0	0	0	114.2
243	S	38.2	Very low	34.6	Very low	108 Å²	108	125.2 Å²	125.2	76%	0.755	68%	0.679	S	S	*	*			trans	70	163.8	154.7	81.6	0	0	0	0	119.9
244	T	39	Very low	35.1	Very low	122 Å²	122	123.4 Å²	123.4	75%	0.748	68%	0.676	S	S	*	*			cis	-172.3	-174.6	-22.2	27.6	0	0	0	0	109.7
245	S	40.2	Very low	35.1	Very low	52 Å²	52	126 Å²	126	36%	0.364	68%	0.681	S	S	.	*				-173.3	151	-84.2	66.9	0	0	0	0	114.4
246	K	40	Very low	35.4	Very low	133 Å²	133	127 Å²	127	58%	0.578	69%	0.688	S	S	*	*			trans	81.1	154.7	156	-54.2	158.7	-176.8	171.8	0	122.2	S1315	K246-S1315 VanDerWaalsContact C-OG 3.26Å; K246-S1315 PolarHBondContact O-OG 3.42Å
247	F	37.4	Very low	35.4	Very low	109 Å²	109	127.3 Å²	127.3	48%	0.478	69%	0.686	S	S	.	*			trans	130.7	149.9	141.1	-88.6	-102.4	0	0	0	116.3	E1313 S1315	F247-E1313 HydrophobicContact CB-CB 4.38Å; F247-E1313 HydrophobicContact CB-CG 4.32Å; F247-E1313 HydrophobicContact CD1-CG 3.68Å; F247-E1313 WeakPolarHBondContact CD1-OE1 3.42Å; F247-E1313 HydrophobicContact CD2-CB 4.23Å; F247-E1313 HydrophobicContact CD2-CG 3.89Å; F247-E1313 HydrophobicContact CE1-CG 3.93Å; F247-E1313 HydrophobicContact CE2-CG 4.11Å; F247-E1313 HydrophobicContact CG-CB 4.17Å; F247-E1313 HydrophobicContact CG-CG 3.71Å; F247-E1313 WeakPolarHBondContact CG-OE1 3.48Å; F247-E1313 HydrophobicContact CZ-CG 4.15Å; F247-S1315 PolarHBondContact N-OG 3.26Å; F247-S1315 PolarHBondContact O-OG 2.88Å
248	S	40.1	Very low	35.4	Very low	87 Å²	87	130.1 Å²	130.1	61%	0.608	69%	0.694	S	S	*	*			cis	-177.4	177.5	-31.4	-167.1	0	0	0	0	112.6
249	H	40.4	Very low	35.5	Very low	145 Å²	145	127.2 Å²	127.2	67%	0.671	69%	0.688	S	S	*	*			trans	87.2	105.2	153	-73	-61.5	0	0	0	125.2
250	H	38.4	Very low	35.4	Very low	154 Å²	154	132.4 Å²	132.4	71%	0.713	70%	0.701	S	S	*	*				67.6	109.3	103.5	-143.4	6	0	0	0	121.9
251	H	36	Very low	35.5	Very low	134 Å²	134	131.1 Å²	131.1	62%	0.62	70%	0.703	S	S	*	*				175.4	140.6	114.6	-110.6	-111.9	0	0	0	116.9
252	Q	36.2	Very low	35.5	Very low	168 Å²	168	130.3 Å²	130.3	79%	0.785	71%	0.706	S	S	*	*			trans	42.3	129.6	146.8	-74.8	166.9	-24.9	0	0	126.1
253	N	29.8	Very low	35.5	Very low	156 Å²	156	126.9 Å²	126.9	83%	0.834	68%	0.684	S	S	*	*			trans	-40.9	170.4	149.2	-111.8	-27.7	0	0	0	116.3
254	P	37.5	Very low	35.4	Very low	107 Å²	107	126.1 Å²	126.1	70%	0.695	68%	0.675	S	S	*	*			cis	-137	-162.9	-8.8	40.9	-22.1	0	0	0	114.2
255	R	27.7	Very low	35.4	Very low	227 Å²	227	123.7 Å²	123.7	86%	0.857	66%	0.661	S	S	*	*			trans	74.2	86.9	153.6	-168.7	-174.2	-174.5	172	2.2	117.4
256	T	31.5	Very low	34.9	Very low	142 Å²	142	127.5 Å²	127.5	87%	0.871	68%	0.683	S	S	*	*			trans	-82.1	118.1	169.4	-45	0	0	0	0	112.2
257	T	30.1	Very low	34.4	Very low	99 Å²	99	125.5 Å²	125.5	61%	0.607	69%	0.691	S	S	*	*			trans	-101.5	124.2	157.4	-63.8	0	0	0	0	108
258	M	30.9	Very low	34.1	Very low	161 Å²	161	125.6 Å²	125.6	79%	0.793	70%	0.701	S	S	*	*			trans	-152.5	140.3	147.9	-75.8	-49.2	154.8	0	0	107
259	T	35.9	Very low	33.6	Very low	115 Å²	115	127.2 Å²	127.2	71%	0.706	71%	0.707	S	S	*	*			cis	82.5	127.5	35.9	-51.9	0	0	0	0	112.6
260	M	31	Very low	33.2	Very low	190 Å²	190	125.2 Å²	125.2	94%	0.936	71%	0.705	S	S	*	*			trans	-69.9	139.8	178.7	-58.5	-139.7	-59.5	0	0	111.5
261	G	35.8	Very low	33	Very low	68 Å²	68	123.7 Å²	123.7	70%	0.701	71%	0.707	S	S	*	*			trans	-149.2	-4.4	-160	0	0	0	0	0	122
262	I	33.7	Very low	32.9	Very low	170 Å²	170	122.4 Å²	122.4	87%	0.872	71%	0.709	S	S	*	*			trans	69.3	144.2	163.9	-56	167.7	0	0	0	118.7	S1326	I262-S1326 WeakPolarHBondContact O-CB 3.48Å
263	G	36.2	Very low	32.8	Very low	17 Å²	17	119.5 Å²	119.5	18%	0.175	70%	0.703	C	S	.	*			trans	116.4	-172.7	148.5	0	0	0	0	0	116.6	S1326 D1327 V1328	G263-S1326 WeakPolarHBondContact CA-OG 3Å; G263-D1327 VanDerWaalsContact C-N 3.26Å; G263-D1327 CarbonylContact O-C 3.45Å; G263-D1327 WeakPolarHBondContact O-CA 2.87Å; G263-D1327 PolarHBondContact O-N 3.07Å; G263-V1328 WeakPolarHBondContact O-CG2 3.17Å; G263-V1328 PolarHBondContact O-N 3.09Å; G263-V1328 VanDerWaalsContact O-N 3.07Å
264	T	36.2	Very low	33	Very low	93 Å²	93	117.7 Å²	117.7	57%	0.571	70%	0.697	S	S	*	*			trans	-123	141	-153.9	52.7	0	0	0	0	118.5	S1326 V1328	T264-S1326 CarbonylContact C-O 3.25Å; T264-S1326 PolarHBondContact N-OG 3.31Å; T264-S1326 CarbonylContact O-C 2.96Å; T264-V1328 HydrophobicContact CG2-CB 4.13Å; T264-V1328 HydrophobicContact CG2-CG2 3.96Å
265	P	37.8	Very low	32.8	Very low	70 Å²	70	117.7 Å²	117.7	46%	0.455	70%	0.695	S	S	.	*			trans	-81.7	-177.1	-151.9	38.5	-39.4	0	0	0	115.9	S1326 D1327	P265-S1326 WeakPolarHBondContact CA-O 3.18Å; P265-D1327 HydrophobicContact CB-CB 4.04Å
266	T	31	Very low	33	Very low	132 Å²	132	110.9 Å²	110.9	81%	0.81	68%	0.679	S	S	*	*			trans	165.8	152.1	139.3	-74.1	0	0	0	0	115.5
267	A	29.7	Very low	33	Very low	92 Å²	92	109.3 Å²	109.3	76%	0.76	67%	0.67	S	S	*	*			trans	-64.8	-162	-179.2	0	0	0	0	0	118.6
268	T	30.5	Very low	33.1	Very low	110 Å²	110	110.4 Å²	110.4	68%	0.675	68%	0.676	S	S	*	*			trans	110.5	88.7	154.9	-40	0	0	0	0	117.4
269	T	29.6	Very low	33.1	Very low	121 Å²	121	108.6 Å²	108.6	74%	0.742	68%	0.675	S	S	*	*				50.7	154.9	116.4	-34.3	0	0	0	0	121.8
270	T	31.5	Very low	32.8	Very low	103 Å²	103	113.3 Å²	113.3	63%	0.632	68%	0.679	S	S	*	*			trans	77.5	101.8	150.3	16.7	0	0	0	0	119.3
271	T	34	Very low	32.8	Very low	122 Å²	122	109.5 Å²	109.5	75%	0.748	67%	0.667	S	S	*	*				71.4	160.2	126.9	55.6	0	0	0	0	119.3
272	T	34.1	Very low	32.6	Very low	107 Å²	107	111.2 Å²	111.2	66%	0.656	67%	0.668	S	S	*	*			cis	-148.7	154.4	9.5	-13.9	0	0	0	0	113.2
273	T	34.4	Very low	32.3	Very low	107 Å²	107	108.4 Å²	108.4	66%	0.656	66%	0.659	S	S	*	*			trans	62	125.1	142.3	51.4	0	0	0	0	123.9
274	T	33.8	Very low	32.1	Very low	118 Å²	118	114.1 Å²	114.1	72%	0.724	69%	0.691	S	S	*	*				76.9	142.6	126.2	65.9	0	0	0	0	120.2
275	T	33.8	Very low	31.8	Very low	107 Å²	107	115.5 Å²	115.5	66%	0.656	69%	0.693	S	S	*	*			cis	-166.4	171.7	-3.6	17.7	0	0	0	0	112.7
276	T	31.7	Very low	31.5	Very low	85 Å²	85	118.7 Å²	118.7	52%	0.521	71%	0.707	S	S	.	*			trans	72.9	98.3	145.5	42.9	0	0	0	0	120.6
277	T	32.3	Very low	31.4	Very low	109 Å²	109	123.1 Å²	123.1	67%	0.669	71%	0.709	S	S	*	*				42.6	129.3	114.4	61.1	0	0	0	0	120.5
278	T	31.4	Very low	31.3	Very low	121 Å²	121	123.4 Å²	123.4	74%	0.742	71%	0.705	S	S	*	*				167.2	159.1	102.7	36.3	0	0	0	0	113.2
279	T	31.6	Very low	31.2	Very low	124 Å²	124	126.1 Å²	126.1	76%	0.761	72%	0.715	S	S	*	*			trans	64.3	131.3	166	50.5	0	0	0	0	117.9
280	R	28.4	Very low	31.4	Very low	213 Å²	213	123.7 Å²	123.7	80%	0.804	71%	0.714	S	S	*	*			cis	71.1	142.7	44	-83.9	179.4	54.8	179.7	-4.5	115.3
281	T	30.7	Very low	31.4	Very low	111 Å²	111	122 Å²	122	68%	0.681	71%	0.707	S	S	*	*			trans	66.8	144.7	159.5	44.5	0	0	0	0	116.8
282	S	31.8	Very low	31.6	Very low	103 Å²	103	122.5 Å²	122.5	72%	0.72	70%	0.701	S	S	*	*			cis	-154.9	158.3	-1	-118.7	0	0	0	0	112.9
283	T	28.6	Very low	31.8	Very low	112 Å²	112	121 Å²	121	69%	0.687	69%	0.689	S	S	*	*			trans	-71.2	126.8	162.9	45.4	0	0	0	0	111.9	I285	T283-I285 WeakPolarHBondContact O-CD1 3.31Å
284	T	32.2	Very low	31.6	Very low	136 Å²	136	125.2 Å²	125.2	83%	0.834	69%	0.694	S	S	*	*			trans	-91.2	133.7	143.4	30.6	0	0	0	0	107.5
285	I	29.9	Very low	31.7	Very low	122 Å²	122	129 Å²	129	63%	0.626	70%	0.701	S	S	*	*			cis	63	100.8	23.5	-43.9	174.3	0	0	0	109.8	T283	T283-I285 WeakPolarHBondContact O-CD1 3.31Å
286	N	31	Very low	31.8	Very low	138 Å²	138	131 Å²	131	74%	0.738	70%	0.702	S	S	*	*			cis	-131.2	156.6	22.9	-83.2	-57.2	0	0	0	111.5
287	R	28.2	Very low	31.9	Very low	224 Å²	224	136.9 Å²	136.9	85%	0.845	72%	0.716	S	S	*	*			cis	92.1	125.2	43	-141.1	-177.5	-161.7	-150.1	4.8	113.6
288	S	28.3	Very low	32	Very low	99 Å²	99	134.6 Å²	134.6	69%	0.692	72%	0.715	S	S	*	*			trans	66.5	104.6	160.6	47.3	0	0	0	0	122.1
289	N	28.1	Very low	32.2	Very low	166 Å²	166	136.9 Å²	136.9	89%	0.888	72%	0.723	S	S	*	*				48.4	115	128.1	-54.6	14.3	0	0	0	121.2
290	G	32.8	Very low	32.4	Very low	70 Å²	70	135.8 Å²	135.8	72%	0.722	72%	0.72	S	S	*	*			trans	-120.7	151.1	151.1	0	0	0	0	0	110.2
291	S	31.7	Very low	32.8	Very low	68 Å²	68	133.6 Å²	133.6	48%	0.476	72%	0.723	S	S	.	*			trans	-156.2	113	-163.3	-170	0	0	0	0	113	R308 L309	S291-R308 PolarHBondContact OG-O 2.76Å; S291-R308 VanDerWaalsContact OG-O 3.08Å; S291-L309 WeakPolarHBondContact CB-O 3.47Å; S291-L309 PolarHBondContact OG-O 3.26Å
292	Q	38	Very low	32.9	Very low	133 Å²	133	139.2 Å²	139.2	62%	0.621	73%	0.732	S	S	*	*			trans	-157.7	157.9	-174.1	-76	-172.3	-99.4	0	0	109.8	L309 N310	Q292-L309 WeakPolarHBondContact O-CB 3.31Å; Q292-N310 PolarHBondContact O-ND2 3.05Å; Q292-N310 VanDerWaalsContact O-ND2 3.09Å
293	D	39.1	Very low	33	Very low	76 Å²	76	139.1 Å²	139.1	41%	0.406	73%	0.731	S	S	.	*			cis	-153.7	-173.4	-8.7	-110.6	-2.6	0	0	0	111.1	L309	D293-L309 WeakPolarHBondContact O-CD1 3.2Å
294	Y	30.4	Very low	33.6	Very low	194 Å²	194	139.2 Å²	139.2	76%	0.761	73%	0.732	S	S	*	*			trans	-95.7	151.7	-158.7	-23.5	-87.1	0	0	0	116.7
295	K	36.6	Very low	34.1	Very low	198 Å²	198	138.7 Å²	138.7	86%	0.861	73%	0.728	S	S	*	*			trans	-162.5	93.3	139.7	-116	173.4	-176.5	-180	0	114.6
296	E	34.6	Very low	34.6	Very low	149 Å²	149	140.6 Å²	140.6	70%	0.696	73%	0.734	S	S	*	*				49.7	141.9	125.7	-137.1	173.3	-161.1	0	0	124.1
297	Y	33.8	Very low	34.6	Very low	208 Å²	208	139.6 Å²	139.6	82%	0.816	73%	0.729	S	S	*	*			trans	97.2	116.4	164.8	-72.8	-83.9	0	0	0	121.1
298	G	35.8	Very low	35.1	Very low	62 Å²	62	138.9 Å²	138.9	64%	0.639	73%	0.726	S	S	*	*			trans	112.5	88.1	145.8	0	0	0	0	0	119.3
299	N	35.2	Very low	35.4	Very low	169 Å²	169	137.9 Å²	137.9	90%	0.904	71%	0.713	S	S	*	*			trans	60.4	141.9	151.5	-54.2	-21.1	0	0	0	119.7
300	S	35.5	Very low	35.8	Very low	100 Å²	100	133.8 Å²	133.8	70%	0.699	69%	0.691	S	S	*	*			cis	-163.1	153.3	-20.7	-168.8	0	0	0	0	109.4
301	L	37.1	Very low	36	Very low	167 Å²	167	136.6 Å²	136.6	87%	0.874	69%	0.689	S	S	*	*			trans	66.3	145.4	175.3	-52.5	179.8	0	0	0	118
302	R	31.6	Very low	36.4	Very low	230 Å²	230	141.5 Å²	141.5	87%	0.868	70%	0.704	S	S	*	*				-152.2	155.6	-92.3	-173.4	175.5	-172.5	-136.8	3.7	110.5
303	S	34.6	Very low	36.4	Very low	100 Å²	100	139 Å²	139	70%	0.699	70%	0.702	S	S	*	*			trans	73.3	124.8	172.6	-63.4	0	0	0	0	116.5
304	T	41.1	Very low	36.5	Very low	114 Å²	114	143.3 Å²	143.3	70%	0.699	72%	0.719	S	S	*	*			cis	-157.3	119.8	-2.6	-68.2	0	0	0	0	110.6
305	V	42.6	Very low	36.9	Very low	126 Å²	126	138.8 Å²	138.8	76%	0.764	72%	0.716	S	S	*	*			trans	59	111.7	154.3	176.9	0	0	0	0	117.1
306	Q	40.6	Very low	37	Very low	161 Å²	161	138.1 Å²	138.1	75%	0.752	72%	0.715	S	S	*	*			cis	64.3	138.3	10.6	-74.6	170.8	-60.8	0	0	116.4
307	N	31.7	Very low	37.2	Very low	118 Å²	118	135.9 Å²	135.9	63%	0.631	71%	0.714	S	S	*	*			cis	-132.9	177.8	10.4	-95.1	-28.9	0	0	0	111
308	R	37.8	Very low	37.6	Very low	208 Å²	208	134.7 Å²	134.7	79%	0.785	72%	0.715	S	S	*	*			cis	86.7	152.8	24.1	-71.5	-178.9	159.4	-144.5	-3.4	116.7	S291	S291-R308 PolarHBondContact OG-O 2.76Å; S291-R308 VanDerWaalsContact OG-O 3.08Å
309	L	34.9	Very low	37.7	Very low	78 Å²	78	141.1 Å²	141.1	41%	0.408	73%	0.728	S	S	.	*			trans	86	153.2	-172.1	-52.3	180	0	0	0	114	S291 Q292 D293	S291-L309 WeakPolarHBondContact CB-O 3.47Å; S291-L309 PolarHBondContact OG-O 3.26Å; Q292-L309 WeakPolarHBondContact O-CB 3.31Å; D293-L309 WeakPolarHBondContact O-CD1 3.2Å
310	N	36	Very low	38.1	Very low	81 Å²	81	141.8 Å²	141.8	43%	0.433	73%	0.726	S	S	.	*			cis	-153.1	160.9	-15.9	-101.2	-21.8	0	0	0	107.9	Q292	Q292-N310 PolarHBondContact O-ND2 3.05Å; Q292-N310 VanDerWaalsContact O-ND2 3.09Å
311	N	37.1	Very low	38.4	Very low	128 Å²	128	145.7 Å²	145.7	68%	0.684	73%	0.732	S	S	*	*			cis	90.9	112.6	18.4	-54.1	-36.6	0	0	0	116.6
312	H	41.3	Very low	38.7	Very low	171 Å²	171	146.9 Å²	146.9	79%	0.792	73%	0.733	S	S	*	*			trans	-178.2	106.9	145.2	-96.6	-62.2	0	0	0	110.3
313	S	37.2	Very low	39.3	Very low	80 Å²	80	143.4 Å²	143.4	56%	0.559	73%	0.726	S	S	*	*				73.3	135.6	93.2	67.8	0	0	0	0	114.7
314	H	41.6	Very low	39.7	Very low	168 Å²	168	147 Å²	147	78%	0.778	73%	0.732	S	S	*	*			cis	-147.9	167.7	42.8	-83	-94.8	0	0	0	116.6
315	S	37.4	Very low	39.9	Very low	99 Å²	99	145.7 Å²	145.7	69%	0.692	72%	0.724	S	S	*	*			trans	1.3	150.6	156.6	53.7	0	0	0	0	121.3
316	H	39	Very low	40	Very low	183 Å²	183	144.4 Å²	144.4	85%	0.847	71%	0.709	S	S	*	*			cis	-149.7	179.6	30.8	-125.1	-6.1	0	0	0	111.9
317	P	39.8	Very low	40.3	Very low	102 Å²	102	145.2 Å²	145.2	66%	0.662	71%	0.712	S	S	*	*			trans	-102.1	147.5	-156.3	38.6	-36.2	0	0	0	116
318	H	42.2	Very low	40.6	Very low	183 Å²	183	148.3 Å²	148.3	85%	0.847	72%	0.717	S	S	*	*			trans	-130.7	143.2	157.7	-96.2	-93.4	0	0	0	110.5	H320	H318-H320 PolarHBondContact O-N 3.03Å
319	H	38.2	Very low	40.9	Very low	198 Å²	198	145.9 Å²	145.9	92%	0.917	71%	0.707	S	S	*	*			trans	-67.1	96.8	177.2	-85.7	-71.9	0	0	0	111.4	H321	H319-H321 PolarHBondContact O-N 3.31Å
320	H	43.7	Very low	41.6	Very low	183 Å²	183	147.4 Å²	147.4	85%	0.847	72%	0.72	S	S	*	*			trans	-74.2	110.2	158.1	-80.6	-51.6	0	0	0	109.5	H318 H322	H318-H320 PolarHBondContact O-N 3.03Å; H320-H322 PolarHBondContact O-N 3.09Å
321	H	41.2	Very low	42.1	Very low	181 Å²	181	146.4 Å²	146.4	84%	0.838	72%	0.723	S	S	*	*			trans	-51.2	136.7	160.1	-95.9	-12.7	0	0	0	109.4	H319 H323	H319-H321 PolarHBondContact O-N 3.31Å; H321-H323 PolarHBondContact O-N 3.16Å
322	H	43	Very low	42.5	Very low	192 Å²	192	143.3 Å²	143.3	89%	0.889	71%	0.711	S	S	*	*			trans	-75.4	68.3	-178.2	-148.1	-44.7	0	0	0	110.3	H320 H324	H320-H322 PolarHBondContact O-N 3.09Å; H322-H324 PolarHBondContact O-N 3.22Å
323	H	44.4	Very low	42.9	Very low	157 Å²	157	141.8 Å²	141.8	73%	0.727	71%	0.707	S	S	*	*			trans	-66	110.5	-171.8	-155.4	-23.5	0	0	0	108.9	H321 V325	H321-H323 PolarHBondContact O-N 3.16Å; H323-V325 HydrophobicContact CB-CG2 3.8Å; H323-V325 WeakPolarHBondContact ND1-CG2 3.45Å; H323-V325 PolarHBondContact O-N 3.43Å
324	H	42.9	Very low	43.3	Very low	177 Å²	177	143.4 Å²	143.4	82%	0.819	72%	0.718	S	S	*	*			trans	-77.2	58.3	-175.1	-164.7	-69.4	0	0	0	111	H322 H326	H322-H324 PolarHBondContact O-N 3.22Å; H324-H326 PolarHBondContact O-N 3.35Å
325	V	45.2	Very low	43.3	Very low	86 Å²	86	139.9 Å²	139.9	52%	0.521	71%	0.712	S	S	.	*			trans	-70.9	90.6	-165.6	-176.8	0	0	0	0	111.8	H323 H327	H323-V325 HydrophobicContact CB-CG2 3.8Å; H323-V325 WeakPolarHBondContact ND1-CG2 3.45Å; H323-V325 PolarHBondContact O-N 3.43Å; V325-H327 PolarHBondContact O-N 3.36Å
326	H	45.6	Very low	44.1	Very low	98 Å²	98	146.3 Å²	146.3	45%	0.454	72%	0.721	S	S	.	*			trans	50.6	54.6	135.2	-93.2	-74.8	0	0	0	117.5	H324 Y328 R329	H324-H326 PolarHBondContact O-N 3.35Å; H326-Y328 PolarHBondContact O-N 2.91Å; H326-R329 HydrophobicContact CB-CB 4.08Å; H326-R329 HydrophobicContact CB-CG 3.73Å; H326-R329 WeakPolarHBondContact O-CB 3.48Å; H326-R329 PolarHBondContact O-N 3.02Å
327	H	45.6	Very low	45.3	Very low	179 Å²	179	142.2 Å²	142.2	83%	0.829	72%	0.719	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.8	-11	153	-91.6	-75.4	0	0	0	112.9	V325 T330	V325-H327 PolarHBondContact O-N 3.36Å; H327-T330 PolarHBondContact O-OG1 2.99Å
328	Y	39.1	Very low	47.2	Very low	183 Å²	183	141 Å²	141	72%	0.718	71%	0.712	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.2	-13.5	165.8	-68	-75.6	0	0	0	115.4	H326 T330 A331 S332	H326-Y328 PolarHBondContact O-N 2.91Å; Y328-T330 PolarHBondContact O-N 3.22Å; Y328-A331 PolarHBondContact O-N 3.34Å; Y328-S332 PolarHBondContact O-N 3.09Å; Y328-S332 VanDerWaalsContact O-N 3.1Å
329	R	44.3	Very low	49.4	Very low	157 Å²	157	139.3 Å²	139.3	59%	0.592	70%	0.7	S	S	*	*	H	α-helix	trans	-70.1	-30	-177.3	-95.5	175.9	-172.5	-158.4	0.7	113.7	H326 S332 I333	H326-R329 HydrophobicContact CB-CB 4.08Å; H326-R329 HydrophobicContact CB-CG 3.73Å; H326-R329 WeakPolarHBondContact O-CB 3.48Å; H326-R329 PolarHBondContact O-N 3.02Å; R329-S332 WeakPolarHBondContact CA-OG 3.49Å; R329-S332 PolarHBondContact O-N 3.35Å; R329-S332 PolarHBondContact O-OG 3.04Å; R329-I333 WeakPolarHBondContact O-CG1 3.45Å; R329-I333 PolarHBondContact O-N 2.79Å
330	T	49.6	Very low	52	Low	110 Å²	110	132.4 Å²	132.4	68%	0.675	67%	0.668	S	S	*	*	H	α-helix	trans	-70.3	-34	173.4	44.8	0	0	0	0	112.1	H327 Y328	H327-T330 PolarHBondContact O-OG1 2.99Å; Y328-T330 PolarHBondContact O-N 3.22Å
331	A	45.2	Very low	54.5	Low	60 Å²	60	123.9 Å²	123.9	50%	0.496	63%	0.629	S	S	.	*	H	α-helix	trans	-66.7	-42.6	171.8	0	0	0	0	0	112	Y328 I333 C334	Y328-A331 PolarHBondContact O-N 3.34Å; A331-I333 PolarHBondContact O-N 2.81Å; A331-C334 WeakPolarHBondContact O-CB 3.34Å; A331-C334 PolarHBondContact O-N 2.94Å; A331-C334 VanDerWaalsContact O-N 3.09Å
332	S	46.8	Very low	57.1	Low	63 Å²	63	121.6 Å²	121.6	44%	0.441	61%	0.614	S	S	.	*	H	α-helix	trans	-69	-17.5	-178.9	65.4	0	0	0	0	114.9	Y328 R329 C334 S335	Y328-S332 PolarHBondContact O-N 3.09Å; Y328-S332 VanDerWaalsContact O-N 3.1Å; R329-S332 WeakPolarHBondContact CA-OG 3.49Å; R329-S332 PolarHBondContact O-N 3.35Å; R329-S332 PolarHBondContact O-OG 3.04Å; S332-C334 PolarHBondContact O-N 2.96Å; S332-S335 WeakPolarHBondContact O-CB 3.15Å; S332-S335 PolarHBondContact O-N 3.19Å; S332-S335 VanDerWaalsContact O-N 3.1Å
333	I	49.1	Very low	59.6	Low	138 Å²	138	112.8 Å²	112.8	71%	0.708	57%	0.573	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.1	-22.6	173	-72.2	165.1	0	0	0	111.1	R329 A331 S335	R329-I333 WeakPolarHBondContact O-CG1 3.45Å; R329-I333 PolarHBondContact O-N 2.79Å; A331-I333 PolarHBondContact O-N 2.81Å; I333-S335 VanDerWaalsContact C-N 3.33Å
334	C	45	Very low	62.1	Low	115 Å²	115	105.3 Å²	105.3	78%	0.777	54%	0.538	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.4	-5.2	173.3	-152.3	0	0	0	0	113.6	A331 S332	A331-C334 WeakPolarHBondContact O-CB 3.34Å; A331-C334 PolarHBondContact O-N 2.94Å; A331-C334 VanDerWaalsContact O-N 3.09Å; S332-C334 PolarHBondContact O-N 2.96Å
335	S	42.7	Very low	64.6	Low	94 Å²	94	102.1 Å²	102.1	66%	0.657	52%	0.522	S	S	*	.	S	Bend	trans	-95	-12.3	-168.6	-50.8	0	0	0	0	115.6	S332 I333 A337	S332-S335 WeakPolarHBondContact O-CB 3.15Å; S332-S335 PolarHBondContact O-N 3.19Å; S332-S335 VanDerWaalsContact O-N 3.1Å; I333-S335 VanDerWaalsContact C-N 3.33Å; S335-A337 PolarHBondContact O-N 3.32Å
336	R	53.1	Low	67	Low	234 Å²	234	99.9 Å²	99.9	88%	0.883	51%	0.508	S	S	*	.	S	Bend	trans	-92.1	91.5	162.4	-85.3	-171.5	173.1	-176.8	-1.1	108.5	S338	R336-S338 PolarHBondContact O-N 3.41Å
337	A	65.4	Low	69.4	Low	97 Å²	97	98.1 Å²	98.1	80%	0.802	50%	0.5	S	S	*	.			trans	-48.6	116.3	175.3	0	0	0	0	0	110.2	S335 Y339	S335-A337 PolarHBondContact O-N 3.32Å; A337-Y339 PolarHBondContact O-N 2.72Å
338	S	78.3	Confident	71.8	Confident	75 Å²	75	92.4 Å²	92.4	52%	0.524	49%	0.489	S	S	.	.			trans	-65.8	122.3	-173.2	46.4	0	0	0	0	109.7	R336 M340	R336-S338 PolarHBondContact O-N 3.41Å; S338-M340 WeakPolarHBondContact O-CE 3.42Å; S338-M340 PolarHBondContact O-N 2.85Å; S338-M340 WeakPolarHBondContact OG-CE 3.42Å
339	Y	89.2	Confident	74.4	Confident	148 Å²	148	88.2 Å²	88.2	58%	0.58	48%	0.476	S	S	*	.			trans	-63.6	111.7	-174	-178.5	-111.8	0	0	0	110.2	A337 V353	A337-Y339 PolarHBondContact O-N 2.72Å; Y339-V353 HydrophobicContact CD1-CB 3.84Å; Y339-V353 HydrophobicContact CD1-CG1 4.25Å; Y339-V353 HydrophobicContact CD1-CG2 3.54Å; Y339-V353 HydrophobicContact CE1-CB 4.47Å; Y339-V353 HydrophobicContact CE1-CG2 3.83Å; Y339-V353 WeakPolarHBondContact O-CB 3.48Å; Y339-V353 WeakPolarHBondContact O-CG2 3.37Å; Y339-V353 PolarHBondContact O-N 2.76Å
340	M	93.4	Very high	76.8	Confident	53 Å²	53	85.7 Å²	85.7	26%	0.261	47%	0.474	S	S	.	.	B	Isolated β-bridge	trans	-79.3	142.4	-175.6	-70.1	-67.1	132.4	0	0	112.2	S338 R342 N350 I351 P352	S338-M340 WeakPolarHBondContact O-CE 3.42Å; S338-M340 PolarHBondContact O-N 2.85Å; S338-M340 WeakPolarHBondContact OG-CE 3.42Å; M340-R342 PolarHBondContact O-N 3.5Å; M340-N350 HydrophobicContact SD-CB 4.45Å; M340-I351 VanDerWaalsContact SD-C 3.58Å; M340-P352 HydrophobicContact CE-CB 3.8Å; M340-P352 HydrophobicContact CE-CG 4.49Å
341	C	95.9	Very high	78.8	Confident	4 Å²	4	83.1 Å²	83.1	3%	0.027	46%	0.456	C	S	.	.			trans	-67.2	107.4	-179.2	-175.9	0	0	0	0	110.3	K343 C344 K345 I351 V353	C341-K343 VanDerWaalsContact C-N 3.27Å; C341-K343 PolarHBondContact O-N 2.84Å; C341-C344 HydrophobicContact CB-CB 3.97Å; C341-C344 PolarHBondContact O-N 3.31Å; C341-C344 VanDerWaalsContact SG-SG 3.63Å; C341-K345 WeakPolarHBondContact O-CB 3.45Å; C341-K345 PolarHBondContact O-N 3.06Å; C341-I351 VanDerWaalsContact CB-O 3.29Å; C341-I351 WeakPolarHBondContact CB-O 3.24Å; C341-I351 PolarHBondContact N-O 3.45Å; C341-V353 VanDerWaalsContact CA-CG2 3.42Å; C341-V353 HydrophobicContact CB-CG2 3.86Å
342	R	94.6	Very high	81.2	Confident	134 Å²	134	82.9 Å²	82.9	51%	0.506	45%	0.45	S	S	.	.	H	α-helix	trans	-62	-33.8	-173.1	-166.9	65	61.4	152.6	1.8	112.8	M340 T346 V373	M340-R342 PolarHBondContact O-N 3.5Å; R342-T346 PolarHBondContact O-N 2.78Å; R342-T346 PolarHBondContact O-OG1 3Å; R342-V373 HydrophobicContact CB-CG1 3.84Å; R342-V373 HydrophobicContact CB-CG2 4.35Å; R342-V373 HydrophobicContact CG-CB 4.39Å; R342-V373 HydrophobicContact CG-CG1 3.88Å; R342-V373 HydrophobicContact CG-CG2 3.58Å
343	K	96.3	Very high	83.3	Confident	6 Å²	6	81.8 Å²	81.8	3%	0.026	44%	0.44	C	S	.	.	H	α-helix	trans	-65.1	-51.8	173.7	-72.2	-153.6	173.4	-166.1	0	111.9	C341 K345 T346 H347 Y362 T363 C370 V373 D374	C341-K343 VanDerWaalsContact C-N 3.27Å; C341-K343 PolarHBondContact O-N 2.84Å; K343-K345 VanDerWaalsContact C-N 3.29Å; K343-K345 PolarHBondContact O-N 3.18Å; K343-T346 WeakPolarHBondContact CA-OG1 3.07Å; K343-T346 PolarHBondContact O-N 3.36Å; K343-T346 VanDerWaalsContact O-N 3.09Å; K343-T346 PolarHBondContact O-OG1 3.43Å; K343-H347 PolarHBondContact O-CD2 2.83Å; K343-H347 PolarHBondContact O-N 2.74Å; K343-Y362 WeakPolarHBondContact CD-O 3.4Å; K343-T363 PolarHBondContact NZ-O 3.42Å; K343-C370 HydrophobicContact CD-CB 4.16Å; K343-C370 HydrophobicContact CG-CB 4.48Å; K343-V373 HydrophobicContact CG-CB 4.42Å; K343-V373 HydrophobicContact CG-CG1 3.87Å; K343-D374 WeakPolarHBondContact CE-OD1 3.45Å; K343-D374 WeakPolarHBondContact CE-OD2 3.05Å; K343-D374 IonicContact NZ-OD1 3.09Å; K343-D374 IonicContact NZ-OD2 2.75Å; K343-D374 PolarHBondContact NZ-OD2 3.09Å
344	C	96.9	Very high	85.3	Confident	0 Å²	0	84 Å²	84	0%	0	45%	0.445	C	S	.	.	H	α-helix	trans	-59.1	-41.4	175.6	-62.9	0	0	0	0	111.7	C341 T346 H347 G348 H349 I351 H356 C360 Y362	C341-C344 HydrophobicContact CB-CB 3.97Å; C341-C344 PolarHBondContact O-N 3.31Å; C341-C344 VanDerWaalsContact SG-SG 3.63Å; C344-T346 VanDerWaalsContact C-N 3.32Å; C344-T346 PolarHBondContact O-N 3.12Å; C344-H347 CarbonylContact O-C 3.34Å; C344-H347 VanDerWaalsContact O-C 3.28Å; C344-H347 WeakPolarHBondContact O-CA 3.34Å; C344-H347 PolarHBondContact O-N 3.4Å; C344-G348 PolarHBondContact O-N 3.39Å; C344-G348 VanDerWaalsContact O-N 3.11Å; C344-H349 CarbonylContact C-O 3.57Å; C344-H349 HydrophobicContact CB-CB 3.89Å; C344-H349 WeakPolarHBondContact CB-O 3.49Å; C344-H349 PolarHBondContact O-N 3.29Å; C344-I351 HydrophobicContact CB-CD1 4.46Å; C344-H356 PolarHBondContact SG-NE2 2.82Å; C344-C360 VanDerWaalsContact SG-SG 3.66Å; C344-Y362 HydrophobicContact CB-CD2 4.26Å
345	K	95.2	Very high	87.3	Confident	111 Å²	111	87.4 Å²	87.4	48%	0.483	44%	0.441	S	S	.	.	H	α-helix	trans	-62.5	-33.3	175.3	-175.7	160.7	-176.5	157.7	0	113.3	C341 K343 H347 G348 H349	C341-K345 WeakPolarHBondContact O-CB 3.45Å; C341-K345 PolarHBondContact O-N 3.06Å; K343-K345 VanDerWaalsContact C-N 3.29Å; K343-K345 PolarHBondContact O-N 3.18Å; K345-H347 PolarHBondContact O-N 2.97Å; K345-G348 PolarHBondContact O-N 3.02Å; K345-H349 PolarHBondContact N-O 3.38Å
346	T	95.4	Very high	89.7	Confident	39 Å²	39	83.7 Å²	83.7	24%	0.239	41%	0.413	C	S	.	.	H	α-helix	trans	-69.5	-13.2	172	40.9	0	0	0	0	114.4	R342 K343 C344 K369 V373	R342-T346 PolarHBondContact O-N 2.78Å; R342-T346 PolarHBondContact O-OG1 3Å; K343-T346 WeakPolarHBondContact CA-OG1 3.07Å; K343-T346 PolarHBondContact O-N 3.36Å; K343-T346 VanDerWaalsContact O-N 3.09Å; K343-T346 PolarHBondContact O-OG1 3.43Å; C344-T346 VanDerWaalsContact C-N 3.32Å; C344-T346 PolarHBondContact O-N 3.12Å; T346-K369 HydrophobicContact CG2-CB 3.99Å; T346-V373 HydrophobicContact CG2-CG2 4Å
347	H	96.9	Very high	91.4	Very high	61 Å²	61	80.9 Å²	80.9	28%	0.282	41%	0.407	S	S	.	.	T	Hydrogen-bonded Turn	trans	-112	16.5	173.1	-67.7	-83.3	0	0	0	112.9	K343 C344 K345 H349 Y362 C365 C367 C370	K343-H347 PolarHBondContact O-CD2 2.83Å; K343-H347 PolarHBondContact O-N 2.74Å; C344-H347 CarbonylContact O-C 3.34Å; C344-H347 VanDerWaalsContact O-C 3.28Å; C344-H347 WeakPolarHBondContact O-CA 3.34Å; C344-H347 PolarHBondContact O-N 3.4Å; K345-H347 PolarHBondContact O-N 2.97Å; H347-H349 PolarHBondContact O-CD2 3.5Å; H347-H349 VanDerWaalsContact O-CD2 3.29Å; H347-H349 PolarHBondContact O-N 2.78Å; H347-Y362 HydrophobicContact CB-CD1 4.18Å; H347-Y362 HydrophobicContact CB-CD2 4.04Å; H347-Y362 HydrophobicContact CB-CE1 3.74Å; H347-Y362 HydrophobicContact CB-CE2 3.58Å; H347-Y362 HydrophobicContact CB-CG 4.32Å; H347-Y362 VanDerWaalsContact CB-CZ 3.43Å; H347-Y362 AromaticContact CD2-CD1 3.34Å; H347-Y362 WeakPolarHBondContact CD2-CD1 3.42Å; H347-Y362 AromaticContact CD2-CD2 3.87Å; H347-Y362 AromaticContact CD2-CE1 3.79Å; H347-Y362 AromaticContact CD2-CG 3.39Å; H347-Y362 AromaticContact CE1-CD1 3.96Å; H347-Y362 AromaticContact CG-CD1 3.59Å; H347-Y362 AromaticContact CG-CE1 3.51Å; H347-Y362 AromaticContact CG-CG 3.92Å; H347-Y362 AromaticContact CG-CZ 3.76Å; H347-Y362 AromaticContact ND1-CD1 3.95Å; H347-Y362 AromaticContact ND1-CE1 3.77Å; H347-Y362 AromaticContact NE2-CD1 3.63Å; H347-Y362 AromaticContact NE2-CG 3.99Å; H347-C365 PolarHBondContact NE2-SG 2.7Å; H347-C367 PolarHBondContact CE1-SG 3.01Å; H347-C367 PolarHBondContact NE2-SG 3.44Å; H347-C370 PolarHBondContact NE2-SG 3.4Å
348	G	95.7	Very high	92.6	Very high	58 Å²	58	85 Å²	85	60%	0.598	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	88.1	-13.3	176.8	0	0	0	0	0	116.3	C344 K345 N350	C344-G348 PolarHBondContact O-N 3.39Å; C344-G348 VanDerWaalsContact O-N 3.11Å; K345-G348 PolarHBondContact O-N 3.02Å; G348-N350 PolarHBondContact O-N 3.35Å
349	H	94	Very high	93.3	Very high	95 Å²	95	86.1 Å²	86.1	44%	0.44	41%	0.406	S	S	.	.			trans	-88.7	107.7	-175.8	-65.9	-88.6	0	0	0	112.5	C344 K345 H347 I351 Y362	C344-H349 CarbonylContact C-O 3.57Å; C344-H349 HydrophobicContact CB-CB 3.89Å; C344-H349 WeakPolarHBondContact CB-O 3.49Å; C344-H349 PolarHBondContact O-N 3.29Å; K345-H349 PolarHBondContact N-O 3.38Å; H347-H349 PolarHBondContact O-CD2 3.5Å; H347-H349 VanDerWaalsContact O-CD2 3.29Å; H347-H349 PolarHBondContact O-N 2.78Å; H349-I351 HydrophobicContact CB-CD1 4.16Å; H349-I351 HydrophobicContact CB-CG1 4.22Å; H349-I351 PolarHBondContact O-N 3.28Å; H349-I351 VanDerWaalsContact O-N 3.08Å; H349-Y362 AromaticContact CD2-CE2 3.83Å; H349-Y362 AromaticContact CD2-CZ 3.94Å; H349-Y362 PolarHBondContact CD2-OH 3.12Å; H349-Y362 PolarHBondContact NE2-OH 3.02Å
350	N	93.9	Very high	93.6	Very high	104 Å²	104	79.4 Å²	79.4	56%	0.556	38%	0.381	S	S	*	.			trans	-84.8	70.2	179	-69.7	-56.4	0	0	0	112.5	M340 G348	M340-N350 HydrophobicContact SD-CB 4.45Å; G348-N350 PolarHBondContact O-N 3.35Å
351	I	91.9	Very high	93.7	Very high	57 Å²	57	81.3 Å²	81.3	29%	0.292	40%	0.397	S	S	.	.			trans	-98.7	132.7	-179.2	-51.5	172.6	0	0	0	110.4	M340 C341 C344 H349 H356	M340-I351 VanDerWaalsContact SD-C 3.58Å; C341-I351 VanDerWaalsContact CB-O 3.29Å; C341-I351 WeakPolarHBondContact CB-O 3.24Å; C341-I351 PolarHBondContact N-O 3.45Å; C344-I351 HydrophobicContact CB-CD1 4.46Å; H349-I351 HydrophobicContact CB-CD1 4.16Å; H349-I351 HydrophobicContact CB-CG1 4.22Å; H349-I351 PolarHBondContact O-N 3.28Å; H349-I351 VanDerWaalsContact O-N 3.08Å; I351-H356 HydrophobicContact CG2-CB 4.28Å
352	P	94.6	Very high	93.7	Very high	55 Å²	55	83.6 Å²	83.6	36%	0.357	41%	0.405	S	S	.	.	B	Isolated β-bridge	trans	-66.3	143	174.6	27.3	-35	0	0	0	112.1	M340 K354 H356	M340-P352 HydrophobicContact CE-CB 3.8Å; M340-P352 HydrophobicContact CE-CG 4.49Å; P352-K354 VanDerWaalsContact C-N 3.3Å; P352-K354 PolarHBondContact O-N 3.02Å; P352-H356 WeakPolarHBondContact O-CB 3Å
353	V	92.7	Very high	93.7	Very high	39 Å²	39	80.3 Å²	80.3	24%	0.236	40%	0.4	C	S	.	.	S	Bend	trans	-68.5	-24.2	-178.7	172	0	0	0	0	113.6	Y339 C341 R355 H356 K357	Y339-V353 HydrophobicContact CD1-CB 3.84Å; Y339-V353 HydrophobicContact CD1-CG1 4.25Å; Y339-V353 HydrophobicContact CD1-CG2 3.54Å; Y339-V353 HydrophobicContact CE1-CB 4.47Å; Y339-V353 HydrophobicContact CE1-CG2 3.83Å; Y339-V353 WeakPolarHBondContact O-CB 3.48Å; Y339-V353 WeakPolarHBondContact O-CG2 3.37Å; Y339-V353 PolarHBondContact O-N 2.76Å; C341-V353 VanDerWaalsContact CA-CG2 3.42Å; C341-V353 HydrophobicContact CB-CG2 3.86Å; V353-R355 PolarHBondContact O-N 2.98Å; V353-H356 PolarHBondContact O-N 3.38Å; V353-K357 PolarHBondContact O-N 2.72Å
354	K	89.4	Confident	93.6	Very high	186 Å²	186	86.7 Å²	86.7	81%	0.809	44%	0.435	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.9	121.8	179.3	-169.8	-178.4	-179.1	-173.1	0	109.2	P352 H356	P352-K354 VanDerWaalsContact C-N 3.3Å; P352-K354 PolarHBondContact O-N 3.02Å; K354-H356 PolarHBondContact O-N 3.25Å
355	R	88.1	Confident	93.6	Very high	186 Å²	186	88.3 Å²	88.3	70%	0.702	45%	0.446	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.8	7.6	-170.8	-64.6	-177	165.1	-139.4	-14.2	116.3	V353 T359 D1047	V353-R355 PolarHBondContact O-N 2.98Å; R355-T359 PolarHBondContact O-OG1 3.15Å; R355-T359 VanDerWaalsContact O-OG1 3.09Å; R355-D1047 IonicContact CZ-OD1 2.73Å; R355-D1047 IonicContact CZ-OD2 3.03Å; R355-D1047 IonicContact NH1-OD1 3.55Å; R355-D1047 IonicContact NH1-OD2 3.6Å; R355-D1047 PolarHBondContact NH1-OD2 3.09Å; R355-D1047 VanDerWaalsContact NH2-CG 3.3Å; R355-D1047 IonicContact NH2-OD1 3.65Å; R355-D1047 PolarHBondContact NH2-OD1 3.27Å; R355-D1047 IonicContact NH2-OD2 2.62Å; R355-D1047 PolarHBondContact NH2-OD2 2.98Å
356	H	93.4	Very high	93.6	Very high	15 Å²	15	92.6 Å²	92.6	7%	0.069	46%	0.464	C	S	.	.	T	Hydrogen-bonded Turn	trans	-113	-0.2	-176.2	-173.7	67.5	0	0	0	114.7	C344 I351 P352 V353 K354 T359 C360	C344-H356 PolarHBondContact SG-NE2 2.82Å; I351-H356 HydrophobicContact CG2-CB 4.28Å; P352-H356 WeakPolarHBondContact O-CB 3Å; V353-H356 PolarHBondContact O-N 3.38Å; K354-H356 PolarHBondContact O-N 3.25Å; H356-T359 WeakPolarHBondContact CA-OG1 3.45Å; H356-T359 PolarHBondContact CE1-O 3.28Å; H356-T359 VanDerWaalsContact CE1-O 3.24Å; H356-T359 PolarHBondContact ND1-O 3.06Å; H356-C360 WeakPolarHBondContact O-CB 3.35Å; H356-C360 PolarHBondContact O-N 3.12Å
357	K	89.4	Confident	93.7	Very high	176 Å²	176	92.9 Å²	92.9	77%	0.765	47%	0.467	S	S	*	.	S	Bend	trans	-60.8	-47.6	179	-173.4	-165	171.3	-163	0	112.1	V353	V353-K357 PolarHBondContact O-N 2.72Å
358	R	89.8	Confident	93.7	Very high	183 Å²	183	96.5 Å²	96.5	69%	0.691	49%	0.487	S	S	*	.	S	Bend	trans	-75.2	-48.5	177.4	-71.2	-180	174.1	151.4	-5.7	111	C360 D1045	R358-C360 PolarHBondContact O-N 3.4Å; R358-D1045 IonicContact CZ-OD1 2.66Å; R358-D1045 IonicContact CZ-OD2 2.75Å; R358-D1045 IonicContact NH1-OD1 2.75Å; R358-D1045 PolarHBondContact NH1-OD1 2.81Å; R358-D1045 IonicContact NH1-OD2 3.7Å; R358-D1045 PolarHBondContact NH1-OD2 3.07Å
359	T	92.4	Very high	93.7	Very high	98 Å²	98	100 Å²	100	60%	0.601	49%	0.486	S	S	*	.	S	Bend	trans	-81.7	29.4	-176.3	55.1	0	0	0	0	114.6	R355 H356 P361	R355-T359 PolarHBondContact O-OG1 3.15Å; R355-T359 VanDerWaalsContact O-OG1 3.09Å; H356-T359 WeakPolarHBondContact CA-OG1 3.45Å; H356-T359 PolarHBondContact CE1-O 3.28Å; H356-T359 VanDerWaalsContact CE1-O 3.24Å; H356-T359 PolarHBondContact ND1-O 3.06Å; T359-P361 WeakPolarHBondContact O-CD 3.41Å
360	C	95.7	Very high	93.9	Very high	8 Å²	8	95.4 Å²	95.4	5%	0.054	47%	0.465	C	S	.	.			trans	-84.7	113	177.6	169.4	0	0	0	0	109.6	C344 H356 R358 Y362 T363	C344-C360 VanDerWaalsContact SG-SG 3.66Å; H356-C360 WeakPolarHBondContact O-CB 3.35Å; H356-C360 PolarHBondContact O-N 3.12Å; R358-C360 PolarHBondContact O-N 3.4Å; C360-Y362 PolarHBondContact O-N 3.19Å; C360-Y362 VanDerWaalsContact O-N 3.09Å; C360-T363 WeakPolarHBondContact O-CB 3.33Å; C360-T363 VanDerWaalsContact O-CG2 3.26Å; C360-T363 WeakPolarHBondContact O-CG2 3.06Å; C360-T363 PolarHBondContact O-N 2.94Å; C360-T363 PolarHBondContact SG-N 2.9Å
361	P	95	Very high	94	Very high	93 Å²	93	95.5 Å²	95.5	60%	0.604	46%	0.462	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.6	-27.6	-177.3	23.4	-33.3	0	0	0	112.6	T359 T363	T359-P361 WeakPolarHBondContact O-CD 3.41Å; P361-T363 VanDerWaalsContact C-N 3.34Å
362	Y	96.6	Very high	94.3	Very high	51 Å²	51	97.5 Å²	97.5	20%	0.2	47%	0.473	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91	14.1	175.5	-50.7	-71.5	0	0	0	113.8	K343 C344 H347 H349 C360 N364 C365	K343-Y362 WeakPolarHBondContact CD-O 3.4Å; C344-Y362 HydrophobicContact CB-CD2 4.26Å; H347-Y362 HydrophobicContact CB-CD1 4.18Å; H347-Y362 HydrophobicContact CB-CD2 4.04Å; H347-Y362 HydrophobicContact CB-CE1 3.74Å; H347-Y362 HydrophobicContact CB-CE2 3.58Å; H347-Y362 HydrophobicContact CB-CG 4.32Å; H347-Y362 VanDerWaalsContact CB-CZ 3.43Å; H347-Y362 AromaticContact CD2-CD1 3.34Å; H347-Y362 WeakPolarHBondContact CD2-CD1 3.42Å; H347-Y362 AromaticContact CD2-CD2 3.87Å; H347-Y362 AromaticContact CD2-CE1 3.79Å; H347-Y362 AromaticContact CD2-CG 3.39Å; H347-Y362 AromaticContact CE1-CD1 3.96Å; H347-Y362 AromaticContact CG-CD1 3.59Å; H347-Y362 AromaticContact CG-CE1 3.51Å; H347-Y362 AromaticContact CG-CG 3.92Å; H347-Y362 AromaticContact CG-CZ 3.76Å; H347-Y362 AromaticContact ND1-CD1 3.95Å; H347-Y362 AromaticContact ND1-CE1 3.77Å; H347-Y362 AromaticContact NE2-CD1 3.63Å; H347-Y362 AromaticContact NE2-CG 3.99Å; H349-Y362 AromaticContact CD2-CE2 3.83Å; H349-Y362 AromaticContact CD2-CZ 3.94Å; H349-Y362 PolarHBondContact CD2-OH 3.12Å; H349-Y362 PolarHBondContact NE2-OH 3.02Å; C360-Y362 PolarHBondContact O-N 3.19Å; C360-Y362 VanDerWaalsContact O-N 3.09Å; Y362-N364 VanDerWaalsContact C-N 3.28Å; Y362-N364 PolarHBondContact O-N 2.92Å; Y362-C365 HydrophobicContact CD1-CB 4.27Å; Y362-C365 VanDerWaalsContact O-CB 3.29Å; Y362-C365 WeakPolarHBondContact O-CB 3.37Å; Y362-C365 PolarHBondContact O-N 3.3Å
363	T	94.4	Very high	94.3	Very high	65 Å²	65	95.8 Å²	95.8	40%	0.399	46%	0.461	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.4	-46.3	-175.9	-172.6	0	0	0	0	111.5	K343 C360 P361	K343-T363 PolarHBondContact NZ-O 3.42Å; C360-T363 WeakPolarHBondContact O-CB 3.33Å; C360-T363 VanDerWaalsContact O-CG2 3.26Å; C360-T363 WeakPolarHBondContact O-CG2 3.06Å; C360-T363 PolarHBondContact O-N 2.94Å; C360-T363 PolarHBondContact SG-N 2.9Å; P361-T363 VanDerWaalsContact C-N 3.34Å
364	N	94.5	Very high	94.5	Very high	140 Å²	140	96.3 Å²	96.3	75%	0.749	46%	0.462	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.2	14.2	178.3	-63	-6.2	0	0	0	113.2	Y362 K366	Y362-N364 VanDerWaalsContact C-N 3.28Å; Y362-N364 PolarHBondContact O-N 2.92Å; N364-K366 PolarHBondContact O-N 3.3Å
365	C	96.7	Very high	94.8	Very high	34 Å²	34	92.1 Å²	92.1	23%	0.23	45%	0.446	C	S	.	.			trans	-68.5	119.5	-178.6	-174.9	0	0	0	0	111.4	H347 Y362 C367 C370	H347-C365 PolarHBondContact NE2-SG 2.7Å; Y362-C365 HydrophobicContact CD1-CB 4.27Å; Y362-C365 VanDerWaalsContact O-CB 3.29Å; Y362-C365 WeakPolarHBondContact O-CB 3.37Å; Y362-C365 PolarHBondContact O-N 3.3Å; C365-C367 VanDerWaalsContact C-N 3.34Å; C365-C367 PolarHBondContact O-N 3.37Å; C365-C367 VanDerWaalsContact SG-SG 3.67Å; C365-C370 HydrophobicContact CB-CB 4.21Å; C365-C370 VanDerWaalsContact O-CB 3.28Å; C365-C370 WeakPolarHBondContact O-CB 3.48Å
366	K	95.8	Very high	95.2	Very high	202 Å²	202	84.9 Å²	84.9	88%	0.878	43%	0.429	S	S	*	.			trans	-84.4	3.8	-178.5	-60.6	-175.6	179.8	-179.7	0	114.4	N364	N364-K366 PolarHBondContact O-N 3.3Å
367	C	97.5	Very high	95.2	Very high	44 Å²	44	89 Å²	89	30%	0.297	44%	0.444	S	S	.	.	S	Bend	trans	-65.9	153.2	-178	82.5	0	0	0	0	112.3	H347 C365 K369 C370 H371	H347-C367 PolarHBondContact CE1-SG 3.01Å; H347-C367 PolarHBondContact NE2-SG 3.44Å; C365-C367 VanDerWaalsContact C-N 3.34Å; C365-C367 PolarHBondContact O-N 3.37Å; C365-C367 VanDerWaalsContact SG-SG 3.67Å; C367-K369 PolarHBondContact O-N 3.43Å; C367-K369 VanDerWaalsContact O-N 3.14Å; C367-C370 PolarHBondContact O-N 3.43Å; C367-C370 PolarHBondContact SG-N 3.43Å; C367-C370 VanDerWaalsContact SG-N 3.43Å; C367-H371 PolarHBondContact O-N 2.8Å
368	I	96.2	Very high	95.5	Very high	138 Å²	138	88 Å²	88	71%	0.708	44%	0.44	S	S	*	.	H	α-helix	trans	-52.2	-41.5	-177.2	-58.4	170.6	0	0	0	111.7	H371 L372	I368-H371 PolarHBondContact O-N 3.43Å; I368-L372 HydrophobicContact CG2-CD1 4.13Å; I368-L372 HydrophobicContact CG2-CG 4.48Å; I368-L372 WeakPolarHBondContact O-CG 3.25Å; I368-L372 PolarHBondContact O-N 2.77Å
369	K	96.5	Very high	95.8	Very high	130 Å²	130	83.1 Å²	83.1	57%	0.565	43%	0.43	S	S	*	.	H	α-helix	trans	-62.7	-44.6	178.5	-60	-179.9	-178.9	173.6	0	112.1	T346 C367 V373	T346-K369 HydrophobicContact CG2-CB 3.99Å; C367-K369 PolarHBondContact O-N 3.43Å; C367-K369 VanDerWaalsContact O-N 3.14Å; K369-V373 WeakPolarHBondContact O-CG2 3.42Å; K369-V373 PolarHBondContact O-N 3.18Å
370	C	97.3	Very high	96	Very high	0 Å²	0	82 Å²	82	0%	0	42%	0.423	C	S	.	.	H	α-helix	trans	-70.8	-35.2	176.1	-83.4	0	0	0	0	112.6	K343 H347 C365 C367 V373 D374	K343-C370 HydrophobicContact CD-CB 4.16Å; K343-C370 HydrophobicContact CG-CB 4.48Å; H347-C370 PolarHBondContact NE2-SG 3.4Å; C365-C370 HydrophobicContact CB-CB 4.21Å; C365-C370 VanDerWaalsContact O-CB 3.28Å; C365-C370 WeakPolarHBondContact O-CB 3.48Å; C367-C370 PolarHBondContact O-N 3.43Å; C367-C370 PolarHBondContact SG-N 3.43Å; C367-C370 VanDerWaalsContact SG-N 3.43Å; C370-V373 WeakPolarHBondContact O-CB 3.02Å; C370-V373 PolarHBondContact O-N 3.46Å; C370-D374 PolarHBondContact O-N 3.39Å
371	H	96.9	Very high	95.9	Very high	105 Å²	105	84.4 Å²	84.4	49%	0.486	44%	0.443	S	S	.	.	H	α-helix	trans	-61.9	-45.2	174.5	-171.8	90.5	0	0	0	111.6	C367 I368 V373 D374 Q375	C367-H371 PolarHBondContact O-N 2.8Å; I368-H371 PolarHBondContact O-N 3.43Å; H371-V373 VanDerWaalsContact C-N 3.28Å; H371-V373 PolarHBondContact O-N 2.86Å; H371-D374 PolarHBondContact O-N 3.42Å; H371-D374 VanDerWaalsContact O-N 3.16Å; H371-Q375 PolarHBondContact CD2-NE2 2.61Å; H371-Q375 PolarHBondContact NE2-NE2 3.33Å; H371-Q375 WeakPolarHBondContact O-CG 3.11Å; H371-Q375 PolarHBondContact O-N 2.94Å
372	L	96.5	Very high	96	Very high	100 Å²	100	87.3 Å²	87.3	52%	0.524	45%	0.446	S	S	.	.	H	α-helix	trans	-61.2	-34.9	173.6	-71.6	169.8	0	0	0	112.6	I368 G376	I368-L372 HydrophobicContact CG2-CD1 4.13Å; I368-L372 HydrophobicContact CG2-CG 4.48Å; I368-L372 WeakPolarHBondContact O-CG 3.25Å; I368-L372 PolarHBondContact O-N 2.77Å; L372-G376 PolarHBondContact O-N 2.93Å
373	V	96.3	Very high	95.9	Very high	18 Å²	18	90.5 Å²	90.5	11%	0.109	46%	0.463	C	S	.	.	H	α-helix	trans	-65.4	-39.7	174.4	169.2	0	0	0	0	111.7	R342 K343 T346 K369 C370 H371 G376 R377	R342-V373 HydrophobicContact CB-CG1 3.84Å; R342-V373 HydrophobicContact CB-CG2 4.35Å; R342-V373 HydrophobicContact CG-CB 4.39Å; R342-V373 HydrophobicContact CG-CG1 3.88Å; R342-V373 HydrophobicContact CG-CG2 3.58Å; K343-V373 HydrophobicContact CG-CB 4.42Å; K343-V373 HydrophobicContact CG-CG1 3.87Å; T346-V373 HydrophobicContact CG2-CG2 4Å; K369-V373 WeakPolarHBondContact O-CG2 3.42Å; K369-V373 PolarHBondContact O-N 3.18Å; C370-V373 WeakPolarHBondContact O-CB 3.02Å; C370-V373 PolarHBondContact O-N 3.46Å; H371-V373 VanDerWaalsContact C-N 3.28Å; H371-V373 PolarHBondContact O-N 2.86Å; V373-G376 PolarHBondContact O-N 2.89Å; V373-R377 WeakPolarHBondContact O-CD 3.47Å; V373-R377 VanDerWaalsContact O-CG 3.26Å; V373-R377 WeakPolarHBondContact O-CG 3.3Å; V373-R377 PolarHBondContact O-N 3.48Å
374	D	95.5	Very high	95.9	Very high	50 Å²	50	91.9 Å²	91.9	27%	0.267	47%	0.467	S	S	.	.	H	α-helix	trans	-77.7	-34.6	178.2	-67.6	-27	0	0	0	113	K343 C370 H371 G376 R377 K378	K343-D374 WeakPolarHBondContact CE-OD1 3.45Å; K343-D374 WeakPolarHBondContact CE-OD2 3.05Å; K343-D374 IonicContact NZ-OD1 3.09Å; K343-D374 IonicContact NZ-OD2 2.75Å; K343-D374 PolarHBondContact NZ-OD2 3.09Å; C370-D374 PolarHBondContact O-N 3.39Å; H371-D374 PolarHBondContact O-N 3.42Å; H371-D374 VanDerWaalsContact O-N 3.16Å; D374-G376 VanDerWaalsContact C-N 3.35Å; D374-R377 PolarHBondContact O-N 2.97Å; D374-R377 WeakPolarHBondContact OD1-CD 3.5Å; D374-R377 IonicContact OD1-CZ 3.85Å; D374-R377 IonicContact OD1-NE 2.71Å; D374-R377 IonicContact OD1-NH1 3.16Å; D374-R377 PolarHBondContact OD1-NH1 3.08Å; D374-K378 WeakPolarHBondContact O-CG 3.07Å; D374-K378 PolarHBondContact O-N 2.86Å
375	Q	95.6	Very high	95.9	Very high	98 Å²	98	87.3 Å²	87.3	46%	0.458	45%	0.448	S	S	.	.	H	α-helix	trans	-57.7	-48	166.2	-72.3	-170.9	1	0	0	110.9	H371 R377 K378 V379	H371-Q375 PolarHBondContact CD2-NE2 2.61Å; H371-Q375 PolarHBondContact NE2-NE2 3.33Å; H371-Q375 WeakPolarHBondContact O-CG 3.11Å; H371-Q375 PolarHBondContact O-N 2.94Å; Q375-R377 VanDerWaalsContact C-N 3.34Å; Q375-R377 PolarHBondContact O-N 3.16Å; Q375-K378 WeakPolarHBondContact O-CB 3.2Å; Q375-K378 PolarHBondContact O-N 2.77Å; Q375-K378 VanDerWaalsContact O-N 3.14Å; Q375-V379 WeakPolarHBondContact O-CG2 3.38Å; Q375-V379 PolarHBondContact O-N 3.35Å
376	G	96.4	Very high	95.8	Very high	34 Å²	34	90.4 Å²	90.4	35%	0.351	46%	0.462	S	S	.	.	H	α-helix	trans	-59.4	-41.3	176.6	0	0	0	0	0	112.9	L372 V373 D374 V379 V380	L372-G376 PolarHBondContact O-N 2.93Å; V373-G376 PolarHBondContact O-N 2.89Å; D374-G376 VanDerWaalsContact C-N 3.35Å; G376-V379 PolarHBondContact O-N 3.45Å; G376-V380 WeakPolarHBondContact O-CG2 3.13Å; G376-V380 PolarHBondContact O-N 2.79Å
377	R	93.2	Very high	95.7	Very high	103 Å²	103	88.1 Å²	88.1	39%	0.389	45%	0.449	S	S	.	.	H	α-helix	trans	-61.2	-44.7	172.4	-74.6	159.8	164.6	-175.7	-9.3	112.1	V373 D374 Q375 V379 V380 A381	V373-R377 WeakPolarHBondContact O-CD 3.47Å; V373-R377 VanDerWaalsContact O-CG 3.26Å; V373-R377 WeakPolarHBondContact O-CG 3.3Å; V373-R377 PolarHBondContact O-N 3.48Å; D374-R377 PolarHBondContact O-N 2.97Å; D374-R377 WeakPolarHBondContact OD1-CD 3.5Å; D374-R377 IonicContact OD1-CZ 3.85Å; D374-R377 IonicContact OD1-NE 2.71Å; D374-R377 IonicContact OD1-NH1 3.16Å; D374-R377 PolarHBondContact OD1-NH1 3.08Å; Q375-R377 VanDerWaalsContact C-N 3.34Å; Q375-R377 PolarHBondContact O-N 3.16Å; R377-V379 VanDerWaalsContact C-N 3.35Å; R377-V379 PolarHBondContact O-N 3.23Å; R377-V380 PolarHBondContact O-N 2.76Å; R377-A381 WeakPolarHBondContact O-CB 3.45Å; R377-A381 PolarHBondContact O-N 3.16Å
378	K	96.1	Very high	95.3	Very high	155 Å²	155	94.5 Å²	94.5	67%	0.674	47%	0.467	S	S	*	.	H	α-helix	trans	-61.2	-40.4	176.1	-73.5	179.3	178.6	-172.1	0	111.9	D374 Q375 K382	D374-K378 WeakPolarHBondContact O-CG 3.07Å; D374-K378 PolarHBondContact O-N 2.86Å; Q375-K378 WeakPolarHBondContact O-CB 3.2Å; Q375-K378 PolarHBondContact O-N 2.77Å; Q375-K378 VanDerWaalsContact O-N 3.14Å; K378-K382 WeakPolarHBondContact O-CG 3.17Å; K378-K382 PolarHBondContact O-N 2.96Å
379	V	96	Very high	95.1	Very high	80 Å²	80	92 Å²	92	49%	0.485	46%	0.455	S	S	.	.	H	α-helix	trans	-64.9	-47.4	175.8	172.7	0	0	0	0	111.6	Q375 G376 R377 A381 K382 Q383	Q375-V379 WeakPolarHBondContact O-CG2 3.38Å; Q375-V379 PolarHBondContact O-N 3.35Å; G376-V379 PolarHBondContact O-N 3.45Å; R377-V379 VanDerWaalsContact C-N 3.35Å; R377-V379 PolarHBondContact O-N 3.23Å; V379-A381 VanDerWaalsContact C-N 3.34Å; V379-A381 PolarHBondContact O-N 2.83Å; V379-K382 PolarHBondContact O-N 2.86Å; V379-Q383 WeakPolarHBondContact O-CG 3.35Å; V379-Q383 PolarHBondContact O-N 3.44Å
380	V	96.3	Very high	94.8	Very high	75 Å²	75	91.7 Å²	91.7	46%	0.455	46%	0.455	S	S	.	.	H	α-helix	trans	-63.8	-39.1	177.9	171.9	0	0	0	0	111.4	G376 R377 Q383 I384	G376-V380 WeakPolarHBondContact O-CG2 3.13Å; G376-V380 PolarHBondContact O-N 2.79Å; R377-V380 PolarHBondContact O-N 2.76Å; V380-Q383 PolarHBondContact O-N 3.14Å; V380-I384 HydrophobicContact CG1-CD1 3.79Å; V380-I384 HydrophobicContact CG1-CG1 4.44Å; V380-I384 WeakPolarHBondContact O-CG1 3.22Å; V380-I384 PolarHBondContact O-N 2.87Å
381	A	95.1	Very high	94.2	Very high	58 Å²	58	94.7 Å²	94.7	48%	0.479	47%	0.474	S	S	.	.	H	α-helix	trans	-61.1	-46.3	174.6	0	0	0	0	0	112	R377 V379 Q383 I384 A385	R377-A381 WeakPolarHBondContact O-CB 3.45Å; R377-A381 PolarHBondContact O-N 3.16Å; V379-A381 VanDerWaalsContact C-N 3.34Å; V379-A381 PolarHBondContact O-N 2.83Å; A381-Q383 VanDerWaalsContact C-N 3.32Å; A381-Q383 PolarHBondContact O-N 3.18Å; A381-I384 PolarHBondContact O-N 2.88Å; A381-A385 PolarHBondContact O-N 2.81Å
382	K	96.4	Very high	93.1	Very high	153 Å²	153	91.8 Å²	91.8	67%	0.665	47%	0.473	S	S	*	.	H	α-helix	trans	-62	-36.8	174.8	-73.7	-171.4	176.1	-165.6	0	112.7	K378 V379 L386	K378-K382 WeakPolarHBondContact O-CG 3.17Å; K378-K382 PolarHBondContact O-N 2.96Å; V379-K382 PolarHBondContact O-N 2.86Å; K382-L386 WeakPolarHBondContact O-CB 3.41Å; K382-L386 VanDerWaalsContact O-CG 3.31Å; K382-L386 WeakPolarHBondContact O-CG 3.22Å; K382-L386 PolarHBondContact O-N 2.86Å
383	Q	95.1	Very high	91.4	Very high	119 Å²	119	89 Å²	89	56%	0.556	46%	0.458	S	S	*	.	H	α-helix	trans	-66.9	-40.1	175.2	-73	172.2	-14.4	0	0	112.5	V379 V380 A381 Y387	V379-Q383 WeakPolarHBondContact O-CG 3.35Å; V379-Q383 PolarHBondContact O-N 3.44Å; V380-Q383 PolarHBondContact O-N 3.14Å; A381-Q383 VanDerWaalsContact C-N 3.32Å; A381-Q383 PolarHBondContact O-N 3.18Å; Q383-Y387 WeakPolarHBondContact O-CB 3.46Å; Q383-Y387 PolarHBondContact O-N 3.38Å
384	I	93.3	Very high	89.5	Confident	94 Å²	94	90.8 Å²	90.8	48%	0.482	47%	0.471	S	S	.	.	H	α-helix	trans	-68.7	-37.8	176.8	-68.5	167	0	0	0	111.3	V380 A381 R388	V380-I384 HydrophobicContact CG1-CD1 3.79Å; V380-I384 HydrophobicContact CG1-CG1 4.44Å; V380-I384 WeakPolarHBondContact O-CG1 3.22Å; V380-I384 PolarHBondContact O-N 2.87Å; A381-I384 PolarHBondContact O-N 2.88Å; I384-R388 WeakPolarHBondContact O-CB 3.27Å; I384-R388 WeakPolarHBondContact O-CG 3.32Å; I384-R388 PolarHBondContact O-N 3.42Å
385	A	94.3	Very high	87.7	Confident	43 Å²	43	95.7 Å²	95.7	36%	0.355	49%	0.492	S	S	.	.	H	α-helix	trans	-60.1	-59.9	171.9	0	0	0	0	0	110.7	A381 Y387 R388 D389	A381-A385 PolarHBondContact O-N 2.81Å; A385-Y387 PolarHBondContact O-N 3.45Å; A385-R388 CarbonylContact O-C 3.58Å; A385-R388 WeakPolarHBondContact O-CA 3.32Å; A385-R388 WeakPolarHBondContact O-CB 3.4Å; A385-R388 PolarHBondContact O-N 3.46Å; A385-D389 PolarHBondContact O-N 2.8Å
386	L	94.6	Very high	85.8	Confident	100 Å²	100	97.8 Å²	97.8	52%	0.524	50%	0.502	S	S	.	.	H	α-helix	trans	-55.1	-34.6	-180	-70.9	169.9	0	0	0	113.6	K382 D389 Q390	K382-L386 WeakPolarHBondContact O-CB 3.41Å; K382-L386 VanDerWaalsContact O-CG 3.31Å; K382-L386 WeakPolarHBondContact O-CG 3.22Å; K382-L386 PolarHBondContact O-N 2.86Å; L386-D389 WeakPolarHBondContact CA-OD2 3.38Å; L386-Q390 WeakPolarHBondContact O-CB 3.5Å; L386-Q390 VanDerWaalsContact O-CD 3.23Å; L386-Q390 WeakPolarHBondContact O-CG 3.24Å; L386-Q390 PolarHBondContact O-N 2.75Å; L386-Q390 VanDerWaalsContact O-N 3.07Å; L386-Q390 PolarHBondContact O-NE2 3.03Å; L386-Q390 VanDerWaalsContact O-NE2 3.08Å
387	Y	93.5	Very high	83.9	Confident	154 Å²	154	100.4 Å²	100.4	60%	0.604	50%	0.501	S	S	*	.	H	α-helix	trans	-70.5	-38.1	174.2	-178.3	-97.3	0	0	0	112.7	Q383 A385 T391	Q383-Y387 WeakPolarHBondContact O-CB 3.46Å; Q383-Y387 PolarHBondContact O-N 3.38Å; A385-Y387 PolarHBondContact O-N 3.45Å; Y387-T391 HydrophobicContact CD1-CG2 4.43Å; Y387-T391 HydrophobicContact CD2-CG2 4.47Å; Y387-T391 HydrophobicContact CE1-CG2 3.95Å; Y387-T391 HydrophobicContact CE2-CG2 4.02Å; Y387-T391 WeakPolarHBondContact O-CB 3.38Å; Y387-T391 WeakPolarHBondContact O-CG2 3.3Å; Y387-T391 PolarHBondContact O-N 2.84Å; Y387-T391 PolarHBondContact O-OG1 3.38Å
388	R	90.8	Very high	82.2	Confident	178 Å²	178	99.4 Å²	99.4	67%	0.672	50%	0.504	S	S	*	.	H	α-helix	trans	-66.8	-40	172.8	-80.5	175.1	147.1	-171.6	-10.5	112.1	I384 A385 Q390 T391 G392	I384-R388 WeakPolarHBondContact O-CB 3.27Å; I384-R388 WeakPolarHBondContact O-CG 3.32Å; I384-R388 PolarHBondContact O-N 3.42Å; A385-R388 CarbonylContact O-C 3.58Å; A385-R388 WeakPolarHBondContact O-CA 3.32Å; A385-R388 WeakPolarHBondContact O-CB 3.4Å; A385-R388 PolarHBondContact O-N 3.46Å; R388-Q390 VanDerWaalsContact C-N 3.35Å; R388-T391 PolarHBondContact O-N 2.93Å; R388-G392 WeakPolarHBondContact O-CA 3.41Å; R388-G392 PolarHBondContact O-N 2.88Å
389	D	91.8	Very high	80.4	Confident	85 Å²	85	95.4 Å²	95.4	46%	0.455	49%	0.492	S	S	.	.	H	α-helix	trans	-64.8	-43.1	177.4	-47.3	-30.9	0	0	0	110.2	A385 L386 N393	A385-D389 PolarHBondContact O-N 2.8Å; L386-D389 WeakPolarHBondContact CA-OD2 3.38Å; D389-N393 WeakPolarHBondContact O-CB 3.4Å; D389-N393 PolarHBondContact O-N 3.13Å; D389-N393 PolarHBondContact O-OD1 3.43Å; D389-N393 VanDerWaalsContact O-OD1 3.11Å
390	Q	90.1	Very high	78.6	Confident	123 Å²	123	98.3 Å²	98.3	58%	0.575	50%	0.5	S	S	*	.	H	α-helix	trans	-65.2	-43.3	176	-74.3	162.7	44.7	0	0	112.8	L386 R388 S394	L386-Q390 WeakPolarHBondContact O-CB 3.5Å; L386-Q390 VanDerWaalsContact O-CD 3.23Å; L386-Q390 WeakPolarHBondContact O-CG 3.24Å; L386-Q390 PolarHBondContact O-N 2.75Å; L386-Q390 VanDerWaalsContact O-N 3.07Å; L386-Q390 PolarHBondContact O-NE2 3.03Å; L386-Q390 VanDerWaalsContact O-NE2 3.08Å; R388-Q390 VanDerWaalsContact C-N 3.35Å; Q390-S394 PolarHBondContact O-OG 2.97Å
391	T	84.6	Confident	76.8	Confident	64 Å²	64	98.8 Å²	98.8	39%	0.393	50%	0.498	S	S	.	.	H	α-helix	trans	-82.6	-31.9	-177.5	49.9	0	0	0	0	113.8	Y387 R388	Y387-T391 HydrophobicContact CD1-CG2 4.43Å; Y387-T391 HydrophobicContact CD2-CG2 4.47Å; Y387-T391 HydrophobicContact CE1-CG2 3.95Å; Y387-T391 HydrophobicContact CE2-CG2 4.02Å; Y387-T391 WeakPolarHBondContact O-CB 3.38Å; Y387-T391 WeakPolarHBondContact O-CG2 3.3Å; Y387-T391 PolarHBondContact O-N 2.84Å; Y387-T391 PolarHBondContact O-OG1 3.38Å; R388-T391 PolarHBondContact O-N 2.93Å
392	G	73.6	Confident	75.1	Confident	44 Å²	44	101.9 Å²	101.9	45%	0.454	50%	0.502	S	S	.	.	H	α-helix	trans	-71.7	-50.3	179.4	0	0	0	0	0	112.5	R388 S394 H395	R388-G392 WeakPolarHBondContact O-CA 3.41Å; R388-G392 PolarHBondContact O-N 2.88Å; G392-S394 VanDerWaalsContact C-N 3.29Å; G392-S394 PolarHBondContact O-N 2.8Å; G392-H395 PolarHBondContact O-N 3.44Å
393	N	60.8	Low	73.3	Confident	42 Å²	42	100.3 Å²	100.3	23%	0.225	50%	0.497	C	S	.	.	H	α-helix	trans	-68.2	-26.5	-179.6	-73.4	84.4	0	0	0	113.2	D389 H395 Q396 R397	D389-N393 WeakPolarHBondContact O-CB 3.4Å; D389-N393 PolarHBondContact O-N 3.13Å; D389-N393 PolarHBondContact O-OD1 3.43Å; D389-N393 VanDerWaalsContact O-OD1 3.11Å; N393-H395 VanDerWaalsContact C-N 3.29Å; N393-H395 PolarHBondContact O-N 3.43Å; N393-Q396 PolarHBondContact O-N 3.43Å; N393-R397 WeakPolarHBondContact O-CG 3.28Å; N393-R397 PolarHBondContact O-N 3.46Å
394	S	56.2	Low	71.8	Confident	55 Å²	55	97.3 Å²	97.3	39%	0.385	49%	0.492	S	S	.	.	H	α-helix	trans	-59.8	-33.5	177.8	-84.4	0	0	0	0	113.7	Q390 G392	Q390-S394 PolarHBondContact O-OG 2.97Å; G392-S394 VanDerWaalsContact C-N 3.29Å; G392-S394 PolarHBondContact O-N 2.8Å
395	H	57.7	Low	70.4	Confident	152 Å²	152	95.9 Å²	95.9	70%	0.704	49%	0.491	S	S	*	.	H	α-helix	trans	-85.6	-7	179.2	-75.7	-15.1	0	0	0	115.1	G392 N393 T399	G392-H395 PolarHBondContact O-N 3.44Å; N393-H395 VanDerWaalsContact C-N 3.29Å; N393-H395 PolarHBondContact O-N 3.43Å; H395-T399 PolarHBondContact O-OG1 3.38Å
396	Q	55.8	Low	68.8	Low	142 Å²	142	98.7 Å²	98.7	66%	0.664	50%	0.5	S	S	*	.	H	α-helix	trans	-101.4	-32.9	172.6	-74.2	-173.6	-18.9	0	0	113.3	N393 T399 H400	N393-Q396 PolarHBondContact O-N 3.43Å; Q396-T399 WeakPolarHBondContact CA-OG1 3.44Å; Q396-T399 PolarHBondContact O-OG1 2.95Å; Q396-T399 VanDerWaalsContact O-OG1 3.11Å; Q396-H400 WeakPolarHBondContact O-CB 3.42Å; Q396-H400 PolarHBondContact O-N 2.72Å; Q396-H400 VanDerWaalsContact O-N 3.11Å
397	R	56.9	Low	67.1	Low	90 Å²	90	98.6 Å²	98.6	34%	0.34	50%	0.5	S	S	.	.	H	α-helix	trans	-65.6	-54.1	176	-68.3	178.1	-171.8	146	4.7	110.9	N393 T399 H400 E401 I778	N393-R397 WeakPolarHBondContact O-CG 3.28Å; N393-R397 PolarHBondContact O-N 3.46Å; R397-T399 PolarHBondContact O-N 3.48Å; R397-H400 PolarHBondContact O-N 2.89Å; R397-E401 WeakPolarHBondContact O-CB 3.39Å; R397-E401 PolarHBondContact O-N 3.07Å; R397-I778 HydrophobicContact CG-CD1 3.83Å
398	D	57.2	Low	65.5	Low	82 Å²	82	100.9 Å²	100.9	44%	0.439	51%	0.507	S	S	.	.	H	α-helix	trans	-55.4	-38.7	-179	-62.4	5.3	0	0	0	112	Q402	D398-Q402 WeakPolarHBondContact O-CB 3.23Å; D398-Q402 VanDerWaalsContact O-CD 3.28Å; D398-Q402 WeakPolarHBondContact O-CG 3.25Å; D398-Q402 PolarHBondContact O-N 3.33Å; D398-Q402 VanDerWaalsContact O-N 3.11Å
399	T	59	Low	64	Low	71 Å²	71	97 Å²	97	44%	0.436	50%	0.503	S	S	.	.	H	α-helix	trans	-75	-41.6	179.3	47.1	0	0	0	0	113.1	H395 Q396 R397 Q403	H395-T399 PolarHBondContact O-OG1 3.38Å; Q396-T399 WeakPolarHBondContact CA-OG1 3.44Å; Q396-T399 PolarHBondContact O-OG1 2.95Å; Q396-T399 VanDerWaalsContact O-OG1 3.11Å; R397-T399 PolarHBondContact O-N 3.48Å; T399-Q403 WeakPolarHBondContact O-CB 3.31Å; T399-Q403 VanDerWaalsContact O-CG 3.26Å; T399-Q403 WeakPolarHBondContact O-CG 3.48Å; T399-Q403 PolarHBondContact O-N 3.47Å
400	H	56.6	Low	62.2	Low	141 Å²	141	98.2 Å²	98.2	65%	0.653	51%	0.506	S	S	*	.	H	α-helix	trans	-69.6	-40.6	178.6	-166.3	-108.7	0	0	0	111.9	Q396 R397 Q403 A404	Q396-H400 WeakPolarHBondContact O-CB 3.42Å; Q396-H400 PolarHBondContact O-N 2.72Å; Q396-H400 VanDerWaalsContact O-N 3.11Å; R397-H400 PolarHBondContact O-N 2.89Å; H400-Q403 PolarHBondContact O-N 3.35Å; H400-A404 VanDerWaalsContact O-CB 3.29Å; H400-A404 WeakPolarHBondContact O-CB 3.39Å; H400-A404 PolarHBondContact O-N 2.67Å
401	E	59.6	Low	60.5	Low	85 Å²	85	97.5 Å²	97.5	40%	0.397	51%	0.51	S	S	.	.	H	α-helix	trans	-73	-36.4	-179.4	-162.6	167.9	-178.3	0	0	112.2	R397 S405 Q779	R397-E401 WeakPolarHBondContact O-CB 3.39Å; R397-E401 PolarHBondContact O-N 3.07Å; E401-S405 VanDerWaalsContact O-CB 3.32Å; E401-S405 WeakPolarHBondContact O-CB 3.31Å; E401-S405 PolarHBondContact O-N 3.34Å; E401-S405 PolarHBondContact O-OG 3.14Å; E401-Q779 PolarHBondContact OE1-NE2 2.99Å
402	Q	58.5	Low	58.9	Low	122 Å²	122	99.1 Å²	99.1	57%	0.57	52%	0.524	S	S	*	.	H	α-helix	trans	-70.3	-37.2	171.9	-69.9	170.2	18.8	0	0	112.4	D398 S405 L406	D398-Q402 WeakPolarHBondContact O-CB 3.23Å; D398-Q402 VanDerWaalsContact O-CD 3.28Å; D398-Q402 WeakPolarHBondContact O-CG 3.25Å; D398-Q402 PolarHBondContact O-N 3.33Å; D398-Q402 VanDerWaalsContact O-N 3.11Å; Q402-S405 PolarHBondContact O-N 2.99Å; Q402-L406 WeakPolarHBondContact O-CB 3.37Å; Q402-L406 WeakPolarHBondContact O-CG 3.41Å; Q402-L406 PolarHBondContact O-N 2.92Å
403	Q	59.5	Low	57.8	Low	121 Å²	121	100.7 Å²	100.7	57%	0.565	53%	0.533	S	S	*	.	H	α-helix	trans	-70.1	-38.3	174.4	-73.1	178.1	14.2	0	0	112.4	T399 H400 S405 L406 N407	T399-Q403 WeakPolarHBondContact O-CB 3.31Å; T399-Q403 VanDerWaalsContact O-CG 3.26Å; T399-Q403 WeakPolarHBondContact O-CG 3.48Å; T399-Q403 PolarHBondContact O-N 3.47Å; H400-Q403 PolarHBondContact O-N 3.35Å; Q403-S405 VanDerWaalsContact C-N 3.31Å; Q403-S405 PolarHBondContact O-N 2.82Å; Q403-L406 PolarHBondContact O-N 3.34Å; Q403-N407 WeakPolarHBondContact O-CB 3.32Å; Q403-N407 PolarHBondContact O-N 3.09Å; Q403-N407 PolarHBondContact O-ND2 3.33Å
404	A	64.1	Low	57.2	Low	55 Å²	55	105 Å²	105	46%	0.455	56%	0.556	S	S	.	*	H	α-helix	trans	-61.6	-40.4	171.3	0	0	0	0	0	111.6	H400 R408	H400-A404 VanDerWaalsContact O-CB 3.29Å; H400-A404 WeakPolarHBondContact O-CB 3.39Å; H400-A404 PolarHBondContact O-N 2.67Å; A404-R408 WeakPolarHBondContact O-CB 3.32Å; A404-R408 PolarHBondContact O-N 2.77Å
405	S	63.3	Low	56.6	Low	65 Å²	65	110 Å²	110	46%	0.455	58%	0.577	S	S	.	*	H	α-helix	trans	-64.8	-48.1	176	-60.8	0	0	0	0	112.4	E401 Q402 Q403 R408 V409	E401-S405 VanDerWaalsContact O-CB 3.32Å; E401-S405 WeakPolarHBondContact O-CB 3.31Å; E401-S405 PolarHBondContact O-N 3.34Å; E401-S405 PolarHBondContact O-OG 3.14Å; Q402-S405 PolarHBondContact O-N 2.99Å; Q403-S405 VanDerWaalsContact C-N 3.31Å; Q403-S405 PolarHBondContact O-N 2.82Å; S405-R408 PolarHBondContact O-N 3.23Å; S405-V409 WeakPolarHBondContact O-CG2 3.3Å; S405-V409 PolarHBondContact O-N 2.71Å; S405-V409 VanDerWaalsContact O-N 3.07Å
406	L	60	Low	55.5	Low	102 Å²	102	110.7 Å²	110.7	53%	0.534	58%	0.58	S	S	.	*	H	α-helix	trans	-63.3	-44.5	177.9	-73.8	169.4	0	0	0	111.5	Q402 Q403 R408 V409 Q410	Q402-L406 WeakPolarHBondContact O-CB 3.37Å; Q402-L406 WeakPolarHBondContact O-CG 3.41Å; Q402-L406 PolarHBondContact O-N 2.92Å; Q403-L406 PolarHBondContact O-N 3.34Å; L406-R408 PolarHBondContact O-N 3.39Å; L406-V409 PolarHBondContact O-N 2.92Å; L406-V409 VanDerWaalsContact O-N 3.13Å; L406-Q410 WeakPolarHBondContact O-CB 3.47Å; L406-Q410 WeakPolarHBondContact O-CG 3.38Å; L406-Q410 PolarHBondContact O-N 3.37Å
407	N	58.9	Low	54.5	Low	98 Å²	98	115 Å²	115	52%	0.524	59%	0.59	S	S	.	*	H	α-helix	trans	-64	-36.9	176.6	-75.4	-43.1	0	0	0	112.6	Q403 V409 T411	Q403-N407 WeakPolarHBondContact O-CB 3.32Å; Q403-N407 PolarHBondContact O-N 3.09Å; Q403-N407 PolarHBondContact O-ND2 3.33Å; N407-V409 VanDerWaalsContact C-N 3.32Å; N407-V409 PolarHBondContact O-N 2.88Å; N407-T411 WeakPolarHBondContact O-CB 3.31Å; N407-T411 VanDerWaalsContact O-CG2 3.31Å; N407-T411 WeakPolarHBondContact O-CG2 3.49Å; N407-T411 PolarHBondContact O-N 3.36Å; N407-T411 PolarHBondContact O-OG1 3.09Å
408	R	60.7	Low	53.6	Low	201 Å²	201	119.1 Å²	119.1	76%	0.758	62%	0.618	S	S	*	*	H	α-helix	trans	-66.9	-29.2	173.7	-179	173.5	-85.5	-127.4	-0.5	113	A404 S405 L406 T411 S412	A404-R408 WeakPolarHBondContact O-CB 3.32Å; A404-R408 PolarHBondContact O-N 2.77Å; S405-R408 PolarHBondContact O-N 3.23Å; L406-R408 PolarHBondContact O-N 3.39Å; R408-T411 PolarHBondContact O-OG1 2.75Å; R408-S412 PolarHBondContact O-OG 3.45Å
409	V	59.1	Low	52.8	Low	97 Å²	97	122.7 Å²	122.7	59%	0.588	63%	0.632	S	S	*	*	H	α-helix	trans	-84.1	-35.8	175.9	173.7	0	0	0	0	111.9	S405 L406 N407 S412	S405-V409 WeakPolarHBondContact O-CG2 3.3Å; S405-V409 PolarHBondContact O-N 2.71Å; S405-V409 VanDerWaalsContact O-N 3.07Å; L406-V409 PolarHBondContact O-N 2.92Å; L406-V409 VanDerWaalsContact O-N 3.13Å; N407-V409 VanDerWaalsContact C-N 3.32Å; N407-V409 PolarHBondContact O-N 2.88Å; V409-S412 PolarHBondContact O-N 3.09Å; V409-S412 PolarHBondContact O-OG 3.33Å; V409-S412 VanDerWaalsContact O-OG 3.09Å
410	Q	54.9	Low	51.7	Low	111 Å²	111	124.5 Å²	124.5	52%	0.519	64%	0.643	S	S	.	*	H	α-helix	trans	-78	-27.4	179	-68.7	178.5	-82.2	0	0	113.3	L406 S412 A413	L406-Q410 WeakPolarHBondContact O-CB 3.47Å; L406-Q410 WeakPolarHBondContact O-CG 3.38Å; L406-Q410 PolarHBondContact O-N 3.37Å; Q410-S412 VanDerWaalsContact C-N 3.25Å; Q410-S412 PolarHBondContact O-N 2.99Å; Q410-A413 PolarHBondContact O-N 3.18Å
411	T	53.6	Low	51	Low	107 Å²	107	124.1 Å²	124.1	66%	0.656	66%	0.656	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.9	-18.1	171.3	45.2	0	0	0	0	113.5	N407 R408	N407-T411 WeakPolarHBondContact O-CB 3.31Å; N407-T411 VanDerWaalsContact O-CG2 3.31Å; N407-T411 WeakPolarHBondContact O-CG2 3.49Å; N407-T411 PolarHBondContact O-N 3.36Å; N407-T411 PolarHBondContact O-OG1 3.09Å; R408-T411 PolarHBondContact O-OG1 2.75Å
412	S	50.7	Low	49.7	Very low	98 Å²	98	126.1 Å²	126.1	69%	0.685	67%	0.674	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98	2.4	176.6	41.9	0	0	0	0	114.1	R408 V409 Q410	R408-S412 PolarHBondContact O-OG 3.45Å; V409-S412 PolarHBondContact O-N 3.09Å; V409-S412 PolarHBondContact O-OG 3.33Å; V409-S412 VanDerWaalsContact O-OG 3.09Å; Q410-S412 VanDerWaalsContact C-N 3.25Å; Q410-S412 PolarHBondContact O-N 2.99Å
413	A	51.6	Low	48.8	Very low	78 Å²	78	128.9 Å²	128.9	65%	0.645	69%	0.688	S	S	*	*	S	Bend	trans	-118.5	2.1	-176.7	0	0	0	0	0	115	Q410	Q410-A413 PolarHBondContact O-N 3.18Å
414	N	46.6	Very low	47.8	Very low	133 Å²	133	128.8 Å²	128.8	71%	0.711	70%	0.695	S	S	*	*			trans	-113.6	29	-169.7	-102.6	-41.7	0	0	0	115
415	I	43.6	Very low	46.6	Very low	159 Å²	159	132 Å²	132	82%	0.815	71%	0.709	S	S	*	*			trans	-129.7	65.9	175.4	-46.1	180	0	0	0	110.9
416	H	35.8	Very low	45.4	Very low	167 Å²	167	134 Å²	134	77%	0.773	72%	0.723	S	S	*	*			trans	-166.2	67.7	154.6	-161.7	-82	0	0	0	113.9
417	W	34.9	Very low	44.5	Very low	233 Å²	233	134 Å²	134	88%	0.883	73%	0.732	S	S	*	*			trans	-139.7	22.2	167.8	-84.1	105.6	0	0	0	113.7	Q419	W417-Q419 PolarHBondContact O-N 3.35Å
418	L	38.3	Very low	43.6	Very low	176 Å²	176	135 Å²	135	92%	0.921	75%	0.746	S	S	*	*			trans	-77.1	114.5	166.7	-90.5	76.6	0	0	0	109.2
419	Q	39.3	Very low	42.7	Very low	156 Å²	156	131.2 Å²	131.2	73%	0.729	75%	0.748	S	S	*	*			trans	-120.2	113.6	174.8	-157.9	177	-13.5	0	0	111.2	W417	W417-Q419 PolarHBondContact O-N 3.35Å
420	T	36.9	Very low	41.6	Very low	110 Å²	110	131.7 Å²	131.7	68%	0.675	76%	0.755	S	S	*	*			trans	41.7	108.3	153.8	58	0	0	0	0	119.7
421	S	40.4	Very low	40.7	Very low	132 Å²	132	131.2 Å²	131.2	92%	0.923	76%	0.764	S	S	*	*			trans	-152.7	102.3	136.1	-75.9	0	0	0	0	109
422	T	33.3	Very low	40	Very low	127 Å²	127	130.3 Å²	130.3	78%	0.779	76%	0.762	S	S	*	*			trans	-102.1	131	179.7	46.4	0	0	0	0	109.8
423	E	40.2	Very low	39.6	Very low	181 Å²	181	132.2 Å²	132.2	85%	0.846	76%	0.763	S	S	*	*			trans	163.5	149.9	153	-94.2	166.9	-146.7	0	0	109.2
424	T	37.1	Very low	39.2	Very low	118 Å²	118	136.3 Å²	136.3	72%	0.724	77%	0.766	S	S	*	*			cis	-165.1	171.3	-41.1	18	0	0	0	0	108.9
425	V	40	Very low	39	Very low	124 Å²	124	138.5 Å²	138.5	75%	0.752	77%	0.77	S	S	*	*			trans	61.5	94.2	162.3	-127.1	0	0	0	0	120.2
426	S	37	Very low	38.8	Very low	105 Å²	105	137.8 Å²	137.8	73%	0.734	77%	0.766	S	S	*	*				63.9	159.4	123	-54.8	0	0	0	0	125.3
427	S	41.1	Very low	39.3	Very low	104 Å²	104	134.6 Å²	134.6	73%	0.727	76%	0.76	S	S	*	*			trans	78.9	81.5	149.9	37.2	0	0	0	0	121.2
428	S	40.3	Very low	39.6	Very low	117 Å²	117	129.2 Å²	129.2	82%	0.818	75%	0.753	S	S	*	*				59	175.8	116.3	-36.6	0	0	0	0	118.7
429	P	42.5	Very low	39.7	Very low	123 Å²	123	126.6 Å²	126.6	80%	0.799	75%	0.745	S	S	*	*				-129.1	-173.1	-118.9	30.3	-5.5	0	0	0	115.1
430	S	35.1	Very low	39.8	Very low	107 Å²	107	124.3 Å²	124.3	75%	0.748	74%	0.742	S	S	*	*			trans	114.2	122.4	141.8	-155.7	0	0	0	0	118.8
431	S	36.6	Very low	39.9	Very low	100 Å²	100	125 Å²	125	70%	0.699	75%	0.745	S	S	*	*			trans	90.7	144.5	140.3	89	0	0	0	0	121.4
432	S	39.6	Very low	39.8	Very low	88 Å²	88	123.1 Å²	123.1	62%	0.615	74%	0.738	S	S	*	*			trans	100.8	109	132.3	-64	0	0	0	0	121.7
433	I	40.9	Very low	40	Very low	138 Å²	138	121 Å²	121	71%	0.708	73%	0.733	S	S	*	*				77	135.1	120.6	-68.6	172.7	0	0	0	117.6
434	K	43.5	Very low	39.8	Very low	164 Å²	164	120 Å²	120	71%	0.713	73%	0.733	S	S	*	*			cis	-178.6	175.2	-16.3	-117.4	171.4	-166.3	171.2	0	108
435	K	41.6	Very low	40	Very low	179 Å²	179	119.6 Å²	119.6	78%	0.778	73%	0.732	S	S	*	*			trans	74.9	125.1	157.8	-75.8	165.1	-179.3	-174.8	0	116.2
436	I	41.1	Very low	39.7	Very low	144 Å²	144	120.9 Å²	120.9	74%	0.738	73%	0.734	S	S	*	*			cis	67.9	128.2	22.1	-33.8	154.6	0	0	0	109.7
437	P	44.7	Very low	39.5	Very low	100 Å²	100	119.9 Å²	119.9	65%	0.649	73%	0.731	S	S	*	*				-162.9	159.6	60.1	46	-23.9	0	0	0	122
438	T	41.6	Very low	39.1	Very low	121 Å²	121	120.8 Å²	120.8	74%	0.742	73%	0.733	S	S	*	*			trans	63.6	164.1	135.9	57.3	0	0	0	0	119.7
439	T	40.1	Very low	38.8	Very low	121 Å²	121	120.7 Å²	120.7	74%	0.742	73%	0.727	S	S	*	*			cis	-165.3	174.9	-2.1	14.1	0	0	0	0	106.9
440	T	41.4	Very low	38.3	Very low	108 Å²	108	119.8 Å²	119.8	66%	0.663	72%	0.716	S	S	*	*			cis	-155.7	141.2	7.7	-126.7	0	0	0	0	107.1
441	T	39.6	Very low	38.3	Very low	123 Å²	123	119 Å²	119	76%	0.755	70%	0.703	S	S	*	*				49.2	144.3	94.4	-4.8	0	0	0	0	114.7
442	A	37.7	Very low	38	Very low	93 Å²	93	118 Å²	118	77%	0.769	71%	0.707	S	S	*	*			cis	-151.8	-173.9	2.4	0	0	0	0	0	107.1
443	A	38.3	Very low	37.7	Very low	82 Å²	82	121.5 Å²	121.5	68%	0.678	71%	0.707	S	S	*	*			cis	-154.8	148.5	-1.3	0	0	0	0	0	105.3
444	L	37	Very low	37.2	Very low	162 Å²	162	121 Å²	121	85%	0.848	71%	0.706	S	S	*	*				52.5	142	63.8	-65.5	173.2	0	0	0	114.3
445	P	40.7	Very low	36.9	Very low	108 Å²	108	123.7 Å²	123.7	70%	0.701	71%	0.712	S	S	*	*			cis	-141.4	-151	-22.5	32.1	-7.8	0	0	0	113
446	I	33.1	Very low	36.7	Very low	152 Å²	152	122.1 Å²	122.1	78%	0.779	71%	0.71	S	S	*	*			trans	97.4	82.9	159.7	-49.6	171.4	0	0	0	118
447	A	32.1	Very low	36.2	Very low	83 Å²	83	120.7 Å²	120.7	69%	0.686	70%	0.704	S	S	*	*				69	150.1	118	0	0	0	0	0	124.5
448	T	34.5	Very low	35.6	Very low	123 Å²	123	123.3 Å²	123.3	76%	0.755	71%	0.708	S	S	*	*			trans	75.4	97.8	153.7	38.8	0	0	0	0	121.6
449	T	32.3	Very low	35.3	Very low	115 Å²	115	120.1 Å²	120.1	71%	0.706	69%	0.693	S	S	*	*				71.2	110.9	128.4	56.2	0	0	0	0	122.3
450	N	33.6	Very low	35.2	Very low	105 Å²	105	120.2 Å²	120.2	56%	0.561	68%	0.684	S	S	*	*				90	142	123.6	-71.4	37.9	0	0	0	121.8	D212	D212-N450 PolarHBondContact OD1-ND2 3.1Å; D212-N450 PolarHBondContact OD2-ND2 2.92Å
451	L	33.7	Very low	35	Very low	91 Å²	91	120.9 Å²	120.9	48%	0.476	68%	0.681	S	S	.	*			trans	68.8	107.7	157.4	-65.3	160.3	0	0	0	118.5	D212 N213	D212-L451 HydrophobicContact CB-CD2 3.95Å; D212-L451 WeakPolarHBondContact OD1-CD2 3.38Å; D212-L451 WeakPolarHBondContact OD1-CG 3.28Å; N213-L451 HydrophobicContact CB-CD1 4.27Å; N213-L451 HydrophobicContact CB-CD2 3.84Å; N213-L451 VanDerWaalsContact N-CD2 3.34Å; N213-L451 WeakPolarHBondContact O-CD2 3.16Å
452	G	31	Very low	34.9	Very low	77 Å²	77	118 Å²	118	79%	0.794	66%	0.661	S	S	*	*			trans	-170.3	17.3	-179.8	0	0	0	0	0	122.7
453	R	33.3	Very low	35.1	Very low	163 Å²	163	117 Å²	117	62%	0.615	64%	0.639	S	S	*	*			trans	46.2	145.9	156.9	-123	-168.2	-169.6	113.4	12.9	122.2	N214 N215	N214-R453 VanDerWaalsContact O-CZ 3.29Å; N214-R453 PolarHBondContact O-NH1 2.92Å; N214-R453 PolarHBondContact O-NH2 3.2Å; N215-R453 PolarHBondContact O-NH1 3.07Å
454	N	30.6	Very low	34.8	Very low	126 Å²	126	119.1 Å²	119.1	67%	0.674	64%	0.639	S	S	*	*			trans	82.4	124.1	154	-59.5	-20.9	0	0	0	120.3
455	R	36.7	Very low	34.8	Very low	221 Å²	221	115.6 Å²	115.6	83%	0.834	63%	0.633	S	S	*	*				24.7	132.6	125.3	-50.1	-178.8	-178.3	-173.2	-3.2	116.6
456	I	36.9	Very low	34.5	Very low	147 Å²	147	116.8 Å²	116.8	75%	0.754	64%	0.639	S	S	*	*				-152.9	131.7	65.3	-81.6	155.8	0	0	0	110.3
457	D	31.2	Very low	34.5	Very low	113 Å²	113	114.5 Å²	114.5	60%	0.604	63%	0.632	S	S	*	*				23.1	163.7	129.9	-31.1	-39.6	0	0	0	122.3
458	E	33	Very low	34.6	Very low	156 Å²	156	115.3 Å²	115.3	73%	0.729	63%	0.628	S	S	*	*			trans	83.4	78.9	169.1	-57	-146.4	128.8	0	0	120.1
459	A	34.6	Very low	34.5	Very low	53 Å²	53	115.1 Å²	115.1	44%	0.438	61%	0.614	S	S	.	*				72.1	156	98.5	0	0	0	0	0	123.4	D1034	A459-D1034 WeakPolarHBondContact CA-OD1 3.36Å; A459-D1034 VanDerWaalsContact CB-CG 3.4Å; A459-D1034 WeakPolarHBondContact CB-OD1 3.29Å; A459-D1034 VanDerWaalsContact CB-OD2 3.25Å; A459-D1034 WeakPolarHBondContact CB-OD2 3.26Å
460	K	37	Very low	34.6	Very low	124 Å²	124	112.2 Å²	112.2	54%	0.539	59%	0.594	S	S	.	*			trans	78.3	100	154	-40.8	-158.6	165.5	157.9	0	119.8	I1032 D1034	K460-I1032 HydrophobicContact CB-CD1 4.12Å; K460-I1032 HydrophobicContact CB-CG1 3.87Å; K460-I1032 HydrophobicContact CB-CG2 4.08Å; K460-I1032 HydrophobicContact CD-CD1 4.1Å; K460-I1032 HydrophobicContact CD-CG2 3.82Å; K460-I1032 HydrophobicContact CG-CD1 4.36Å; K460-I1032 HydrophobicContact CG-CG1 4.28Å; K460-I1032 HydrophobicContact CG-CG2 3.64Å; K460-D1034 WeakPolarHBondContact CE-OD2 3.45Å; K460-D1034 IonicContact NZ-OD2 3.92Å
461	M	38.2	Very low	34.9	Very low	122 Å²	122	109.1 Å²	109.1	60%	0.601	58%	0.579	S	S	*	*				139.4	122.4	108.1	-163.2	150	-145.1	0	0	117	N1031 I1032	M461-N1031 WeakPolarHBondContact CA-O 3.45Å; M461-N1031 WeakPolarHBondContact CG-O 3.3Å; M461-I1032 HydrophobicContact CB-CG1 3.85Å; M461-I1032 HydrophobicContact CE-CD1 3.71Å; M461-I1032 HydrophobicContact CE-CG1 3.94Å; M461-I1032 HydrophobicContact CG-CD1 4.33Å; M461-I1032 HydrophobicContact CG-CG1 3.84Å; M461-I1032 HydrophobicContact SD-CD1 3.73Å; M461-I1032 HydrophobicContact SD-CG1 3.92Å
462	N	37.8	Very low	35	Very low	62 Å²	62	109.5 Å²	109.5	33%	0.332	59%	0.585	S	S	.	*			trans	-64	160.5	173.8	-156.9	22.3	0	0	0	111.5	N1031	N462-N1031 HydrophobicContact CB-CB 3.83Å; N462-N1031 WeakPolarHBondContact CB-O 3.29Å; N462-N1031 PolarHBondContact N-O 3.27Å; N462-N1031 VanDerWaalsContact ND2-CB 3.3Å; N462-N1031 WeakPolarHBondContact ND2-CB 3.26Å; N462-N1031 VanDerWaalsContact ND2-CG 3.32Å; N462-N1031 PolarHBondContact ND2-OD1 3.24Å
463	K	40.5	Very low	35.2	Very low	72 Å²	72	116.1 Å²	116.1	31%	0.313	59%	0.586	S	S	.	*				-175.9	134.7	52.6	-164.4	168.8	-150.4	166.9	0	114.9	Q1029 G1030 N1031	K463-Q1029 HydrophobicContact CB-CB 4Å; K463-Q1029 HydrophobicContact CB-CG 4.48Å; K463-Q1029 WeakPolarHBondContact CD-O 3.17Å; K463-Q1029 PolarHBondContact NZ-O 3.24Å; K463-Q1029 VanDerWaalsContact NZ-O 3.09Å; K463-Q1029 PolarHBondContact O-NE2 2.66Å; K463-G1030 PolarHBondContact NZ-O 2.88Å; K463-N1031 WeakPolarHBondContact CE-OD1 3.1Å; K463-N1031 PolarHBondContact NZ-OD1 3.16Å
464	N	33.6	Very low	35.4	Very low	126 Å²	126	114.9 Å²	114.9	67%	0.674	59%	0.591	S	S	*	*			trans	42.7	141.6	149.8	-57.5	10.5	0	0	0	122.2
465	A	35.8	Very low	35.6	Very low	89 Å²	89	113.1 Å²	113.1	74%	0.736	59%	0.589	S	S	*	*			trans	87.7	115.3	152.8	0	0	0	0	0	116.3
466	T	34.7	Very low	35.6	Very low	132 Å²	132	108.9 Å²	108.9	81%	0.81	58%	0.583	S	S	*	*				94.8	127.1	79.7	-70.8	0	0	0	0	111
467	T	33.6	Very low	35.7	Very low	104 Å²	104	107.2 Å²	107.2	64%	0.638	58%	0.58	S	S	*	*			cis	-174	159.2	2.1	-100	0	0	0	0	110.5
468	T	33.2	Very low	36	Very low	100 Å²	100	108.4 Å²	108.4	61%	0.613	59%	0.591	S	S	*	*			trans	65.8	161.5	162.6	49.4	0	0	0	0	121.8	N1340	T468-N1340 PolarHBondContact O-OD1 2.62Å
469	R	34.2	Very low	36.2	Very low	119 Å²	119	104.4 Å²	104.4	45%	0.449	59%	0.591	S	S	.	*			cis	176.4	165.9	-29.9	-98.3	-167.3	166.6	144.2	-5.8	112	N1340 D1341 D1342 N1343	R469-N1340 PolarHBondContact N-OD1 2.98Å; R469-N1340 VanDerWaalsContact O-CB 3.29Å; R469-N1340 WeakPolarHBondContact O-CB 3.11Å; R469-N1340 PolarHBondContact O-ND2 3.08Å; R469-N1340 VanDerWaalsContact O-ND2 3.13Å; R469-N1340 PolarHBondContact O-OD1 2.92Å; R469-D1341 WeakPolarHBondContact CA-O 3.34Å; R469-D1342 WeakPolarHBondContact CD-O 3.07Å; R469-D1342 WeakPolarHBondContact CG-O 3.43Å; R469-D1342 PolarHBondContact NE-O 3.42Å; R469-N1343 VanDerWaalsContact CD-ND2 3.3Å; R469-N1343 WeakPolarHBondContact CD-ND2 3.46Å; R469-N1343 WeakPolarHBondContact CD-OD1 3.05Å; R469-N1343 PolarHBondContact NE-OD1 3.26Å; R469-N1343 PolarHBondContact NH1-OD1 2.96Å
470	N	34.3	Very low	36.3	Very low	55 Å²	55	109.9 Å²	109.9	29%	0.294	61%	0.612	S	S	.	*			trans	109.6	85.7	155.7	-86.3	97.9	0	0	0	129	D1341 N1343 Q1344	N470-D1341 VanDerWaalsContact O-OD1 3.13Å; N470-N1343 WeakPolarHBondContact ND2-CB 3.46Å; N470-N1343 PolarHBondContact ND2-N 3.36Å; N470-N1343 WeakPolarHBondContact OD1-CB 3.37Å; N470-N1343 VanDerWaalsContact OD1-CG 3.26Å; N470-N1343 PolarHBondContact OD1-N 2.72Å; N470-N1343 PolarHBondContact OD1-ND2 2.81Å; N470-Q1344 PolarHBondContact ND2-OE1 2.75Å
471	T	38.5	Very low	36.3	Very low	40 Å²	40	111.4 Å²	111.4	25%	0.245	62%	0.62	C	S	.	*			trans	36.1	137.6	132.2	59.3	0	0	0	0	124.5	D1341 D1342 N1343	T471-D1341 VanDerWaalsContact CA-OD2 3.29Å; T471-D1341 WeakPolarHBondContact CA-OD2 3.07Å; T471-D1341 PolarHBondContact N-OD1 3.34Å; T471-D1341 PolarHBondContact N-OD2 2.85Å; T471-D1342 VanDerWaalsContact CA-OD1 3.29Å; T471-D1342 WeakPolarHBondContact CA-OD1 3.2Å; T471-D1342 HydrophobicContact CG2-CB 4.04Å; T471-D1342 WeakPolarHBondContact CG2-OD1 3.2Å; T471-D1342 PolarHBondContact N-OD1 2.93Å; T471-N1343 WeakPolarHBondContact CG2-O 3.46Å
472	T	36.8	Very low	36.2	Very low	99 Å²	99	112.2 Å²	112.2	61%	0.607	63%	0.627	S	S	*	*				142	151.6	116.3	56.5	0	0	0	0	112.5
473	R	34.1	Very low	36.2	Very low	216 Å²	216	114.3 Å²	114.3	82%	0.815	64%	0.644	S	S	*	*			cis	-157.9	145.3	49.3	-82.4	-171.1	173.3	-119.3	-11.8	111.2
474	L	37.8	Very low	35.9	Very low	136 Å²	136	115.9 Å²	115.9	71%	0.712	66%	0.664	S	S	*	*				65.9	137.4	68.6	-81.7	161.9	0	0	0	113.7
475	S	36.2	Very low	35.7	Very low	90 Å²	90	118.7 Å²	118.7	63%	0.629	67%	0.671	S	S	*	*			cis	-142.2	-152.4	6.5	-56.1	0	0	0	0	110.4
476	D	35.5	Very low	35.4	Very low	131 Å²	131	119 Å²	119	70%	0.701	67%	0.667	S	S	*	*			cis	-167.8	171.5	3.5	-137.1	-52.9	0	0	0	113.7
477	T	38.4	Very low	35.4	Very low	113 Å²	113	118.6 Å²	118.6	69%	0.693	66%	0.659	S	S	*	*			trans	62.7	145.2	156.6	60.2	0	0	0	0	121.9
478	T	38.5	Very low	35.2	Very low	138 Å²	138	120 Å²	120	85%	0.847	66%	0.659	S	S	*	*			cis	-167	152.3	-9	19.6	0	0	0	0	113.2
479	G	36.4	Very low	35.3	Very low	71 Å²	71	124.6 Å²	124.6	73%	0.732	67%	0.665	S	S	*	*			trans	99.4	148.9	153.7	0	0	0	0	0	117.3
480	I	37.7	Very low	35.5	Very low	168 Å²	168	125.9 Å²	125.9	86%	0.862	68%	0.679	S	S	*	*			cis	-144.9	160.4	0	-68.5	-175.2	0	0	0	110
481	H	36.6	Very low	35.3	Very low	157 Å²	157	130 Å²	130	73%	0.727	70%	0.701	S	S	*	*			trans	-30.9	166.1	170.5	-91.1	-120.4	0	0	0	119.7
482	D	35.3	Very low	35.1	Very low	139 Å²	139	133.5 Å²	133.5	74%	0.743	73%	0.727	S	S	*	*			cis	-153.7	150.5	27.5	-129	-34.4	0	0	0	114.9
483	P	38.2	Very low	35.1	Very low	105 Å²	105	133.8 Å²	133.8	68%	0.682	73%	0.729	S	S	*	*			trans	-126.1	168.4	176.6	42.1	-29.7	0	0	0	116.8
484	S	35	Very low	35.2	Very low	106 Å²	106	130.6 Å²	130.6	74%	0.741	73%	0.727	S	S	*	*			trans	-161.4	129.1	163	-173.8	0	0	0	0	109.4
485	F	28.2	Very low	35.1	Very low	185 Å²	185	129.9 Å²	129.9	81%	0.811	73%	0.728	S	S	*	*				62	138.9	61.7	-78.3	-109.5	0	0	0	113.5
486	C	30.3	Very low	34.9	Very low	96 Å²	96	133.7 Å²	133.7	65%	0.649	74%	0.736	S	S	*	*			cis	-159.5	-176.6	-9.1	58.9	0	0	0	0	108.3
487	D	35.2	Very low	35	Very low	123 Å²	123	134.3 Å²	134.3	66%	0.658	74%	0.739	S	S	*	*			cis	-146.9	152.5	8.2	-98.9	-41.5	0	0	0	107.4
488	E	29.6	Very low	34.7	Very low	134 Å²	134	133.5 Å²	133.5	63%	0.626	74%	0.738	S	S	*	*				71.2	107.7	67.6	-148.9	-157.7	-131.4	0	0	116.6
489	R	35.4	Very low	34.6	Very low	195 Å²	195	132.6 Å²	132.6	74%	0.736	73%	0.732	S	S	*	*				164.2	124.6	121.2	-87.2	168	-165.4	171.1	16.6	119
490	I	37	Very low	34.7	Very low	147 Å²	147	137.2 Å²	137.2	75%	0.754	73%	0.734	S	S	*	*			trans	73.2	115.7	131.2	-58.9	166.2	0	0	0	122.1
491	N	31.4	Very low	34.9	Very low	141 Å²	141	134 Å²	134	75%	0.754	73%	0.727	S	S	*	*			trans	-22.1	142.6	155	-51.8	-26	0	0	0	120.1
492	S	34.3	Very low	35.1	Very low	113 Å²	113	133.4 Å²	133.4	79%	0.79	73%	0.729	S	S	*	*				170.3	163	106	-81.6	0	0	0	0	113.7
493	T	36	Very low	35.6	Very low	106 Å²	106	130.3 Å²	130.3	65%	0.65	72%	0.718	S	S	*	*			cis	179	144.8	-25.2	-80.5	0	0	0	0	107
494	L	35.6	Very low	35.9	Very low	149 Å²	149	131 Å²	131	78%	0.78	72%	0.715	S	S	*	*			trans	62	130	176.3	-92.7	80.8	0	0	0	116.2
495	V	35.8	Very low	36.4	Very low	120 Å²	120	136.9 Å²	136.9	73%	0.727	72%	0.722	S	S	*	*			cis	88.3	116.6	46.9	166.7	0	0	0	0	114.2
496	Q	33	Very low	37.1	Very low	170 Å²	170	131.9 Å²	131.9	79%	0.794	71%	0.71	S	S	*	*				-169.8	162.7	119.5	-115.8	164.5	14.9	0	0	113
497	L	37.1	Very low	37.6	Very low	144 Å²	144	132.1 Å²	132.1	75%	0.754	70%	0.702	S	S	*	*			trans	49.7	100.1	171.1	-84.8	56.5	0	0	0	116
498	S	33.2	Very low	38.1	Very low	96 Å²	96	132.4 Å²	132.4	67%	0.671	71%	0.708	S	S	*	*			cis	74.3	142.6	24.5	107.9	0	0	0	0	116.2
499	T	36.2	Very low	38.8	Very low	120 Å²	120	131.1 Å²	131.1	74%	0.736	71%	0.709	S	S	*	*			trans	74.7	150.3	-175.8	72.4	0	0	0	0	117.9
500	H	38.7	Very low	39	Very low	167 Å²	167	129.1 Å²	129.1	77%	0.773	71%	0.71	S	S	*	*			trans	103.4	-12.9	179.1	-65.1	-65.4	0	0	0	120.9	N502 S503	H500-N502 PolarHBondContact O-N 2.82Å; H500-S503 PolarHBondContact O-N 3.33Å
501	S	40.5	Very low	39.4	Very low	101 Å²	101	130.3 Å²	130.3	71%	0.706	72%	0.715	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.6	-13.3	176.8	48.7	0	0	0	0	115.5	S503	S501-S503 VanDerWaalsContact C-N 3.27Å; S501-S503 PolarHBondContact O-N 2.91Å
502	N	40.5	Very low	39.9	Very low	145 Å²	145	129.3 Å²	129.3	78%	0.775	71%	0.709	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.6	-14.4	177.8	-75.9	-13.6	0	0	0	114.8	H500	H500-N502 PolarHBondContact O-N 2.82Å
503	S	45.9	Very low	40.1	Very low	74 Å²	74	130.6 Å²	130.6	52%	0.517	71%	0.707	S	S	.	*	S	Bend	trans	-71.2	-39.6	179.5	-169.8	0	0	0	0	112.9	H500 S501 R505 S506	H500-S503 PolarHBondContact O-N 3.33Å; S501-S503 VanDerWaalsContact C-N 3.27Å; S501-S503 PolarHBondContact O-N 2.91Å; S503-R505 VanDerWaalsContact C-N 3.27Å; S503-R505 PolarHBondContact O-N 3.41Å; S503-S506 WeakPolarHBondContact O-CB 3.27Å; S503-S506 PolarHBondContact O-N 2.8Å
504	L	45.2	Very low	40.6	Very low	118 Å²	118	135.1 Å²	135.1	62%	0.618	72%	0.718	S	S	*	*	G	3₁₀ helix	trans	-63.7	-28.6	-174.9	-80.5	160.2	0	0	0	113.5	S506 M507	L504-S506 PolarHBondContact O-N 3.18Å; L504-M507 HydrophobicContact CD2-CE 3.55Å; L504-M507 HydrophobicContact CG-CE 4.23Å; L504-M507 PolarHBondContact O-N 3.02Å; L504-M507 VanDerWaalsContact O-N 3.16Å
505	R	44.9	Very low	41	Very low	231 Å²	231	136.1 Å²	136.1	87%	0.872	72%	0.719	S	S	*	*	G	3₁₀ helix	trans	-70.5	-12.6	173.5	-108.4	-175.6	176.6	-159.4	-1.5	114.1	S503	S503-R505 VanDerWaalsContact C-N 3.27Å; S503-R505 PolarHBondContact O-N 3.41Å
506	S	44.6	Very low	41.3	Very low	80 Å²	80	134.3 Å²	134.3	56%	0.559	71%	0.708	S	S	*	*	G	3₁₀ helix	trans	-98	-0.9	171.5	-166.9	0	0	0	0	113.7	S503 L504 T509	S503-S506 WeakPolarHBondContact O-CB 3.27Å; S503-S506 PolarHBondContact O-N 2.8Å; L504-S506 PolarHBondContact O-N 3.18Å; S506-T509 PolarHBondContact O-OG1 3.11Å; S506-T509 VanDerWaalsContact O-OG1 3.04Å
507	M	39.1	Very low	42.1	Very low	101 Å²	101	131.5 Å²	131.5	50%	0.498	70%	0.698	S	S	.	*	T	Hydrogen-bonded Turn	trans	-104.8	-18.8	179	-58.9	-157.5	-64	0	0	113.2	L504 T509 M510	L504-M507 HydrophobicContact CD2-CE 3.55Å; L504-M507 HydrophobicContact CG-CE 4.23Å; L504-M507 PolarHBondContact O-N 3.02Å; L504-M507 VanDerWaalsContact O-N 3.16Å; M507-T509 PolarHBondContact O-N 3.45Å; M507-M510 PolarHBondContact O-N 3.02Å; M507-M510 VanDerWaalsContact O-N 3.09Å
508	V	46.8	Very low	42.8	Very low	128 Å²	128	128.1 Å²	128.1	78%	0.776	68%	0.683	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64	-18.5	170	177.3	0	0	0	0	112.1
509	T	44.9	Very low	44.2	Very low	107 Å²	107	130.1 Å²	130.1	66%	0.656	70%	0.697	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.8	5.3	174	46.9	0	0	0	0	114.4	S506 M507	S506-T509 PolarHBondContact O-OG1 3.11Å; S506-T509 VanDerWaalsContact O-OG1 3.04Å; M507-T509 PolarHBondContact O-N 3.45Å
510	M	39.5	Very low	46.1	Very low	153 Å²	153	126 Å²	126	75%	0.754	68%	0.678	S	S	*	*	S	Bend	trans	-124.6	13.7	-169.6	-68.4	-81.9	-81.1	0	0	114.4	M507	M507-M510 PolarHBondContact O-N 3.02Å; M507-M510 VanDerWaalsContact O-N 3.09Å
511	M	44.1	Very low	48.5	Very low	172 Å²	172	122.8 Å²	122.8	85%	0.847	67%	0.672	S	S	*	*			trans	-118.7	9.5	177.7	-64.3	-166.3	76.3	0	0	114.8	D513	M511-D513 PolarHBondContact O-N 2.93Å
512	D	42.2	Very low	51	Low	120 Å²	120	121.4 Å²	121.4	64%	0.642	65%	0.654	S	S	*	*			trans	-81.9	1.4	179.4	-149.6	7.2	0	0	0	113.5	K514 T516	D512-K514 PolarHBondContact O-N 2.87Å; D512-T516 WeakPolarHBondContact O-CG2 3.35Å; D512-T516 PolarHBondContact O-OG1 2.95Å; D512-T516 WeakPolarHBondContact OD1-CG2 3.46Å
513	D	39.6	Very low	53.6	Low	140 Å²	140	115 Å²	115	75%	0.749	62%	0.62	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97	45.5	-174.8	-104.6	-41.5	0	0	0	114.1	M511	M511-D513 PolarHBondContact O-N 2.93Å
514	K	45.3	Very low	55.8	Low	201 Å²	201	116.6 Å²	116.6	87%	0.874	62%	0.615	S	S	*	*	T	Hydrogen-bonded Turn	trans	-166.6	-10	162.2	-111	148.1	-109.1	-65.3	0	118.1	D512	D512-K514 PolarHBondContact O-N 2.87Å
515	Q	44.7	Very low	58.2	Low	170 Å²	170	112.5 Å²	112.5	79%	0.794	59%	0.591	S	S	*	*	T	Hydrogen-bonded Turn	trans	-122.8	18.4	174.3	-79.5	-162	16.7	0	0	115.7	I517	Q515-I517 PolarHBondContact O-N 3.19Å
516	T	42.3	Very low	60.6	Low	83 Å²	83	101.5 Å²	101.5	51%	0.509	55%	0.55	S	S	.	*			trans	-67.4	65.5	159.8	40.3	0	0	0	0	111.4	D512 T518	D512-T516 WeakPolarHBondContact O-CG2 3.35Å; D512-T516 PolarHBondContact O-OG1 2.95Å; D512-T516 WeakPolarHBondContact OD1-CG2 3.46Å; T516-T518 WeakPolarHBondContact O-CA 3.09Å; T516-T518 PolarHBondContact O-N 3.17Å
517	I	49.3	Very low	63	Low	111 Å²	111	104.7 Å²	104.7	57%	0.569	55%	0.55	S	S	*	.			trans	-60.8	100.6	174.9	-63.6	-179.8	0	0	0	107.3	Q515 S519 T534	Q515-I517 PolarHBondContact O-N 3.19Å; I517-S519 PolarHBondContact O-N 2.92Å; I517-T534 HydrophobicContact CG2-CG2 3.78Å
518	T	52	Low	65.6	Low	72 Å²	72	101.5 Å²	101.5	44%	0.442	54%	0.535	S	S	.	.			trans	-46.9	131.4	-152.6	69.1	0	0	0	0	113.3	T516 G520 T534	T516-T518 WeakPolarHBondContact O-CA 3.09Å; T516-T518 PolarHBondContact O-N 3.17Å; T518-G520 PolarHBondContact O-N 2.91Å; T518-T534 WeakPolarHBondContact OG1-CG2 3.19Å
519	S	62	Low	68	Low	139 Å²	139	98.1 Å²	98.1	97%	0.972	51%	0.511	S	S	*	.	S	Bend	trans	-62.9	20.4	-176.3	-31.1	0	0	0	0	116.3	I517	I517-S519 PolarHBondContact O-N 2.92Å
520	G	75.6	Confident	70.3	Confident	32 Å²	32	98.9 Å²	98.9	33%	0.33	52%	0.52	S	S	.	.	S	Bend	trans	-86.9	177.1	174.2	0	0	0	0	0	113.7	T518 H522	T518-G520 PolarHBondContact O-N 2.91Å; G520-H522 PolarHBondContact O-N 3.45Å; G520-H522 PolarHBondContact O-ND1 3.14Å
521	P	89.2	Confident	72.9	Confident	100 Å²	100	95.4 Å²	95.4	65%	0.649	50%	0.504	S	S	*	.			trans	-61.2	133.5	-179.5	25.1	-34.1	0	0	0	111.3	W535	P521-W535 HydrophobicContact CG-CB 4.46Å; P521-W535 WeakPolarHBondContact O-CB 3.16Å; P521-W535 PolarHBondContact O-N 3.11Å
522	H	92.9	Very high	75.2	Confident	72 Å²	72	90.7 Å²	90.7	33%	0.333	49%	0.492	S	S	.	.	B	Isolated β-bridge	trans	-80.8	148.5	174.8	-73.7	50.6	0	0	0	111.5	G520 R524 V533	G520-H522 PolarHBondContact O-N 3.45Å; G520-H522 PolarHBondContact O-ND1 3.14Å; H522-R524 PolarHBondContact O-N 3.17Å; H522-V533 CarbonylContact C-O 3.26Å; H522-V533 WeakPolarHBondContact CA-O 3.45Å
523	C	94.6	Very high	77.5	Confident	10 Å²	10	87.1 Å²	87.1	7%	0.068	48%	0.475	C	S	.	.			trans	-60	107.6	176.3	179.4	0	0	0	0	110.7	R525 C526 R527 V533 H538 C542	C523-R525 PolarHBondContact O-N 2.89Å; C523-R525 VanDerWaalsContact O-N 3.12Å; C523-C526 HydrophobicContact CB-CB 4.06Å; C523-C526 PolarHBondContact O-N 3.01Å; C523-C526 VanDerWaalsContact O-N 3.15Å; C523-R527 PolarHBondContact O-N 3.08Å; C523-V533 WeakPolarHBondContact CB-O 3.31Å; C523-V533 PolarHBondContact N-O 2.86Å; C523-H538 VanDerWaalsContact CB-CD2 3.45Å; C523-H538 WeakPolarHBondContact CB-CD2 3.45Å; C523-H538 PolarHBondContact SG-CD2 3.07Å; C523-H538 PolarHBondContact SG-NE2 3.01Å; C523-H538 VanDerWaalsContact SG-NE2 3.42Å; C523-C542 VanDerWaalsContact SG-SG 3.63Å
524	R	93.2	Very high	80	Confident	108 Å²	108	81.9 Å²	81.9	41%	0.408	45%	0.448	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.9	-23.2	-176.8	-173.5	61	-127.6	-148	2	113.3	H522 N528 W535 I555	H522-R524 PolarHBondContact O-N 3.17Å; R524-N528 VanDerWaalsContact CZ-OD1 3.29Å; R524-N528 PolarHBondContact NE-OD1 3.11Å; R524-N528 PolarHBondContact NH2-OD1 2.76Å; R524-N528 PolarHBondContact O-N 2.81Å; R524-N528 PolarHBondContact O-OD1 2.82Å; R524-N528 VanDerWaalsContact O-OD1 3.06Å; R524-W535 HydrophobicContact CB-CZ3 4.24Å; R524-I555 HydrophobicContact CB-CD1 4.08Å; R524-I555 HydrophobicContact CG-CD1 3.67Å; R524-I555 HydrophobicContact CG-CG1 4.15Å
525	R	94.6	Very high	82.1	Confident	32 Å²	32	76.8 Å²	76.8	12%	0.121	42%	0.423	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.3	-54.4	171.9	-59.3	-157.6	-167.1	-83.2	18.1	111.5	C523 R527 N528 H529 F544 R545 C552 I555 N556	C523-R525 PolarHBondContact O-N 2.89Å; C523-R525 VanDerWaalsContact O-N 3.12Å; R525-R527 VanDerWaalsContact C-N 3.26Å; R525-R527 PolarHBondContact O-N 3.35Å; R525-N528 VanDerWaalsContact O-CB 3.3Å; R525-N528 WeakPolarHBondContact O-CB 3.26Å; R525-N528 PolarHBondContact O-N 3.04Å; R525-H529 PolarHBondContact O-CD2 3.11Å; R525-F544 HydrophobicContact CB-CB 4.1Å; R525-F544 WeakPolarHBondContact CD-O 3.13Å; R525-R545 PolarHBondContact NE-O 3.04Å; R525-R545 PolarHBondContact NH2-O 2.83Å; R525-C552 PolarHBondContact NH1-O 3Å; R525-I555 HydrophobicContact CG-CD1 4.05Å; R525-N556 PolarHBondContact NH1-OD1 3.48Å; R525-N556 PolarHBondContact NH2-OD1 2.94Å
526	C	96.2	Very high	84.2	Confident	1 Å²	1	77.3 Å²	77.3	1%	0.007	42%	0.423	C	S	.	.	G	3₁₀ helix	trans	-56.8	-40	176.6	-69.9	0	0	0	0	112.2	C523 N528 H529 S530 I531 V533 H538 C542 F544	C523-C526 HydrophobicContact CB-CB 4.06Å; C523-C526 PolarHBondContact O-N 3.01Å; C523-C526 VanDerWaalsContact O-N 3.15Å; C526-N528 PolarHBondContact O-N 3.11Å; C526-H529 CarbonylContact O-C 3.56Å; C526-H529 WeakPolarHBondContact O-CA 3.34Å; C526-H529 PolarHBondContact O-N 2.69Å; C526-S530 PolarHBondContact O-N 3.44Å; C526-I531 CarbonylContact C-O 3.51Å; C526-I531 HydrophobicContact CB-CB 4.08Å; C526-I531 WeakPolarHBondContact CB-O 3.36Å; C526-I531 PolarHBondContact O-N 3.32Å; C526-V533 HydrophobicContact CB-CG2 4.2Å; C526-H538 VanDerWaalsContact SG-CE1 3.53Å; C526-H538 PolarHBondContact SG-NE2 2.79Å; C526-C542 VanDerWaalsContact SG-SG 3.66Å; C526-F544 HydrophobicContact CB-CD2 4.26Å; C526-F544 HydrophobicContact CB-CE2 4.43Å
527	R	94.6	Very high	86.4	Confident	146 Å²	146	76.7 Å²	76.7	55%	0.551	43%	0.432	S	S	*	.	G	3₁₀ helix	trans	-62.4	-21.4	174.2	-176	161.1	64.3	141.7	-9.1	114.2	C523 R525 H529 I531	C523-R527 PolarHBondContact O-N 3.08Å; R525-R527 VanDerWaalsContact C-N 3.26Å; R525-R527 PolarHBondContact O-N 3.35Å; R527-H529 VanDerWaalsContact C-N 3.29Å; R527-I531 PolarHBondContact N-O 3.42Å
528	N	94.8	Very high	88.5	Confident	34 Å²	34	72.2 Å²	72.2	18%	0.182	41%	0.409	C	S	.	.	G	3₁₀ helix	trans	-78.3	-14	171.9	-64.1	-12.8	0	0	0	113.4	R524 R525 C526 P551 C552 I555	R524-N528 VanDerWaalsContact CZ-OD1 3.29Å; R524-N528 PolarHBondContact NE-OD1 3.11Å; R524-N528 PolarHBondContact NH2-OD1 2.76Å; R524-N528 PolarHBondContact O-N 2.81Å; R524-N528 PolarHBondContact O-OD1 2.82Å; R524-N528 VanDerWaalsContact O-OD1 3.06Å; R525-N528 VanDerWaalsContact O-CB 3.3Å; R525-N528 WeakPolarHBondContact O-CB 3.26Å; R525-N528 PolarHBondContact O-N 3.04Å; C526-N528 PolarHBondContact O-N 3.11Å; N528-P551 HydrophobicContact CB-CB 3.85Å; N528-P551 VanDerWaalsContact ND2-CB 3.3Å; N528-P551 WeakPolarHBondContact ND2-CB 3.32Å; N528-P551 PolarHBondContact ND2-O 3.27Å; N528-C552 PolarHBondContact ND2-N 3.22Å; N528-I555 WeakPolarHBondContact ND2-CD1 3.32Å
529	H	96.3	Very high	90.3	Very high	58 Å²	58	76.4 Å²	76.4	27%	0.269	42%	0.421	S	S	.	.	G	3₁₀ helix	trans	-116	28.5	176.6	-60.8	-85.4	0	0	0	110.5	R525 C526 R527 I531 F544 C547 C549 C552	R525-H529 PolarHBondContact O-CD2 3.11Å; C526-H529 CarbonylContact O-C 3.56Å; C526-H529 WeakPolarHBondContact O-CA 3.34Å; C526-H529 PolarHBondContact O-N 2.69Å; R527-H529 VanDerWaalsContact C-N 3.29Å; H529-I531 WeakPolarHBondContact O-CG1 3.29Å; H529-I531 PolarHBondContact O-N 2.95Å; H529-F544 HydrophobicContact CB-CD1 4.31Å; H529-F544 HydrophobicContact CB-CD2 4.17Å; H529-F544 HydrophobicContact CB-CE1 3.8Å; H529-F544 HydrophobicContact CB-CE2 3.63Å; H529-F544 HydrophobicContact CB-CG 4.48Å; H529-F544 HydrophobicContact CB-CZ 3.43Å; H529-F544 VanDerWaalsContact CB-CZ 3.43Å; H529-F544 AromaticContact CD2-CD1 3.37Å; H529-F544 WeakPolarHBondContact CD2-CD1 3.33Å; H529-F544 AromaticContact CD2-CD2 3.68Å; H529-F544 AromaticContact CD2-CE1 3.76Å; H529-F544 AromaticContact CD2-CG 3.33Å; H529-F544 WeakPolarHBondContact CD2-CG 3.41Å; H529-F544 AromaticContact CE1-CD1 3.95Å; H529-F544 AromaticContact CG-CD1 3.67Å; H529-F544 AromaticContact CG-CE1 3.54Å; H529-F544 AromaticContact CG-CG 3.96Å; H529-F544 AromaticContact CG-CZ 3.72Å; H529-F544 AromaticContact ND1-CE1 3.87Å; H529-F544 AromaticContact NE2-CD1 3.59Å; H529-F544 AromaticContact NE2-CG 3.8Å; H529-C547 PolarHBondContact CE1-SG 2.67Å; H529-C547 PolarHBondContact NE2-SG 2.79Å; H529-C547 VanDerWaalsContact NE2-SG 3.39Å; H529-C549 PolarHBondContact CE1-SG 3.39Å; H529-C549 PolarHBondContact NE2-SG 3.32Å; H529-C549 VanDerWaalsContact NE2-SG 3.43Å; H529-C552 PolarHBondContact NE2-SG 3.25Å; H529-C552 VanDerWaalsContact NE2-SG 3.43Å
530	S	94	Very high	91.7	Very high	122 Å²	122	78.4 Å²	78.4	85%	0.853	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.7	10.6	-179.7	-53.6	0	0	0	0	116.7	C526	C526-S530 PolarHBondContact O-N 3.44Å
531	I	92.7	Very high	92.5	Very high	81 Å²	81	82 Å²	82	42%	0.415	43%	0.428	S	S	.	.			trans	-95	119.5	177.7	-44.5	-164.7	0	0	0	110.7	C526 R527 H529 V533 F544	C526-I531 CarbonylContact C-O 3.51Å; C526-I531 HydrophobicContact CB-CB 4.08Å; C526-I531 WeakPolarHBondContact CB-O 3.36Å; C526-I531 PolarHBondContact O-N 3.32Å; R527-I531 PolarHBondContact N-O 3.42Å; H529-I531 WeakPolarHBondContact O-CG1 3.29Å; H529-I531 PolarHBondContact O-N 2.95Å; I531-V533 HydrophobicContact CG2-CG2 3.62Å; I531-V533 PolarHBondContact O-N 3.07Å; I531-F544 HydrophobicContact CD1-CE2 3.75Å; I531-F544 HydrophobicContact CD1-CZ 3.8Å; I531-F544 HydrophobicContact CG1-CE2 4.07Å; I531-F544 HydrophobicContact CG1-CZ 4.32Å
532	A	92.7	Very high	92.8	Very high	73 Å²	73	77.6 Å²	77.6	60%	0.603	40%	0.4	S	S	*	.			trans	-85.8	99	173.6	0	0	0	0	0	110.9
533	V	91.2	Very high	92.8	Very high	45 Å²	45	78.8 Å²	78.8	27%	0.273	41%	0.414	S	S	.	.			trans	-124.4	136.9	171.8	-160.8	0	0	0	0	110.2	H522 C523 C526 I531 H538	H522-V533 CarbonylContact C-O 3.26Å; H522-V533 WeakPolarHBondContact CA-O 3.45Å; C523-V533 WeakPolarHBondContact CB-O 3.31Å; C523-V533 PolarHBondContact N-O 2.86Å; C526-V533 HydrophobicContact CB-CG2 4.2Å; I531-V533 HydrophobicContact CG2-CG2 3.62Å; I531-V533 PolarHBondContact O-N 3.07Å; V533-H538 HydrophobicContact CG1-CB 4.43Å; V533-H538 VanDerWaalsContact CG1-ND1 3.34Å; V533-H538 WeakPolarHBondContact CG1-ND1 3.43Å
534	T	92.7	Very high	92.9	Very high	29 Å²	29	80.2 Å²	80.2	18%	0.178	42%	0.419	C	S	.	.	B	Isolated β-bridge	trans	-66.2	140.7	177.7	61.2	0	0	0	0	110.3	I517 T518 K536 H538	I517-T534 HydrophobicContact CG2-CG2 3.78Å; T518-T534 WeakPolarHBondContact OG1-CG2 3.19Å; T534-K536 VanDerWaalsContact C-N 3.33Å; T534-K536 PolarHBondContact O-N 3.26Å; T534-H538 WeakPolarHBondContact O-CB 3.48Å
535	W	88.5	Confident	92.8	Very high	94 Å²	94	81.7 Å²	81.7	36%	0.356	42%	0.424	S	S	.	.	S	Bend	trans	-72.4	-27	-173.8	-172.1	-60.1	0	0	0	112.6	P521 R524 G537 H538 K539	P521-W535 HydrophobicContact CG-CB 4.46Å; P521-W535 WeakPolarHBondContact O-CB 3.16Å; P521-W535 PolarHBondContact O-N 3.11Å; R524-W535 HydrophobicContact CB-CZ3 4.24Å; W535-G537 PolarHBondContact O-N 2.68Å; W535-H538 PolarHBondContact O-N 3.05Å; W535-K539 PolarHBondContact O-N 2.99Å
536	K	87.9	Confident	92.7	Very high	182 Å²	182	86.3 Å²	86.3	79%	0.791	45%	0.452	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.9	124.9	-179	-164.7	177.5	-179.9	-175.2	0	109.4	T534 H538	T534-K536 VanDerWaalsContact C-N 3.33Å; T534-K536 PolarHBondContact O-N 3.26Å; K536-H538 PolarHBondContact O-N 3.02Å
537	G	89.8	Confident	92.6	Very high	69 Å²	69	87.6 Å²	87.6	71%	0.711	46%	0.46	S	S	*	.	T	Hydrogen-bonded Turn	trans	74.6	-47.8	-170.3	0	0	0	0	0	114.4	W535 K539	W535-G537 PolarHBondContact O-N 2.68Å; G537-K539 PolarHBondContact O-N 3.34Å
538	H	93.5	Very high	92.6	Very high	18 Å²	18	86.1 Å²	86.1	8%	0.083	47%	0.47	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.5	-18.6	-170.7	-176	89.8	0	0	0	116.4	C523 C526 V533 T534 W535 K536 K540 T541 C542	C523-H538 VanDerWaalsContact CB-CD2 3.45Å; C523-H538 WeakPolarHBondContact CB-CD2 3.45Å; C523-H538 PolarHBondContact SG-CD2 3.07Å; C523-H538 PolarHBondContact SG-NE2 3.01Å; C523-H538 VanDerWaalsContact SG-NE2 3.42Å; C526-H538 VanDerWaalsContact SG-CE1 3.53Å; C526-H538 PolarHBondContact SG-NE2 2.79Å; V533-H538 HydrophobicContact CG1-CB 4.43Å; V533-H538 VanDerWaalsContact CG1-ND1 3.34Å; V533-H538 WeakPolarHBondContact CG1-ND1 3.43Å; T534-H538 WeakPolarHBondContact O-CB 3.48Å; W535-H538 PolarHBondContact O-N 3.05Å; K536-H538 PolarHBondContact O-N 3.02Å; H538-K540 PolarHBondContact O-N 3.12Å; H538-T541 WeakPolarHBondContact CA-OG1 3.39Å; H538-T541 PolarHBondContact O-N 3.17Å; H538-T541 VanDerWaalsContact O-N 3.09Å; H538-C542 WeakPolarHBondContact NE2-CA 3.42Å; H538-C542 WeakPolarHBondContact NE2-CB 3.34Å; H538-C542 PolarHBondContact NE2-SG 3.49Å; H538-C542 WeakPolarHBondContact O-CB 3.41Å; H538-C542 PolarHBondContact O-N 2.79Å
539	K	90.3	Very high	92.7	Very high	160 Å²	160	86.4 Å²	86.4	70%	0.696	47%	0.474	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.4	-32.9	179.1	-177.1	-178.9	174.9	-175.1	0	114	W535 G537	W535-K539 PolarHBondContact O-N 2.99Å; G537-K539 PolarHBondContact O-N 3.34Å
540	K	90.2	Very high	92.6	Very high	180 Å²	180	87.7 Å²	87.7	78%	0.783	48%	0.483	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89	-36.3	177.3	-71.3	-173.9	178.5	-178.5	0	113.4	H538	H538-K540 PolarHBondContact O-N 3.12Å
541	T	93.3	Very high	92.7	Very high	107 Å²	107	85 Å²	85	66%	0.656	46%	0.462	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.6	5.1	-173.3	52	0	0	0	0	114.4	H538 P543	H538-T541 WeakPolarHBondContact CA-OG1 3.39Å; H538-T541 PolarHBondContact O-N 3.17Å; H538-T541 VanDerWaalsContact O-N 3.09Å; T541-P543 WeakPolarHBondContact O-CD 3.47Å
542	C	94.6	Very high	92.8	Very high	9 Å²	9	81.1 Å²	81.1	6%	0.061	44%	0.443	C	S	.	.			trans	-61.1	119.5	178	-176.2	0	0	0	0	111.9	C523 C526 H538 F544 R545	C523-C542 VanDerWaalsContact SG-SG 3.63Å; C526-C542 VanDerWaalsContact SG-SG 3.66Å; H538-C542 WeakPolarHBondContact NE2-CA 3.42Å; H538-C542 WeakPolarHBondContact NE2-CB 3.34Å; H538-C542 PolarHBondContact NE2-SG 3.49Å; H538-C542 WeakPolarHBondContact O-CB 3.41Å; H538-C542 PolarHBondContact O-N 2.79Å; C542-F544 VanDerWaalsContact C-N 3.28Å; C542-F544 PolarHBondContact O-N 2.95Å; C542-R545 HydrophobicContact CB-CB 4.18Å; C542-R545 WeakPolarHBondContact O-CB 3.36Å; C542-R545 PolarHBondContact O-N 2.76Å
543	P	93.9	Very high	92.9	Very high	96 Å²	96	84.6 Å²	84.6	62%	0.623	44%	0.44	S	S	*	.	G	3₁₀ helix	trans	-62.5	-38.8	179	24	-32.6	0	0	0	111.2	T541 R545	T541-P543 WeakPolarHBondContact O-CD 3.47Å; P543-R545 PolarHBondContact O-N 3.2Å
544	F	95.6	Very high	92.9	Very high	41 Å²	41	87.5 Å²	87.5	18%	0.18	45%	0.454	C	S	.	.	G	3₁₀ helix	trans	-79.9	11.9	177.4	-47.6	-67.7	0	0	0	113.9	R525 C526 H529 I531 C542 N546 C547	R525-F544 HydrophobicContact CB-CB 4.1Å; R525-F544 WeakPolarHBondContact CD-O 3.13Å; C526-F544 HydrophobicContact CB-CD2 4.26Å; C526-F544 HydrophobicContact CB-CE2 4.43Å; H529-F544 HydrophobicContact CB-CD1 4.31Å; H529-F544 HydrophobicContact CB-CD2 4.17Å; H529-F544 HydrophobicContact CB-CE1 3.8Å; H529-F544 HydrophobicContact CB-CE2 3.63Å; H529-F544 HydrophobicContact CB-CG 4.48Å; H529-F544 HydrophobicContact CB-CZ 3.43Å; H529-F544 VanDerWaalsContact CB-CZ 3.43Å; H529-F544 AromaticContact CD2-CD1 3.37Å; H529-F544 WeakPolarHBondContact CD2-CD1 3.33Å; H529-F544 AromaticContact CD2-CD2 3.68Å; H529-F544 AromaticContact CD2-CE1 3.76Å; H529-F544 AromaticContact CD2-CG 3.33Å; H529-F544 WeakPolarHBondContact CD2-CG 3.41Å; H529-F544 AromaticContact CE1-CD1 3.95Å; H529-F544 AromaticContact CG-CD1 3.67Å; H529-F544 AromaticContact CG-CE1 3.54Å; H529-F544 AromaticContact CG-CG 3.96Å; H529-F544 AromaticContact CG-CZ 3.72Å; H529-F544 AromaticContact ND1-CE1 3.87Å; H529-F544 AromaticContact NE2-CD1 3.59Å; H529-F544 AromaticContact NE2-CG 3.8Å; I531-F544 HydrophobicContact CD1-CE2 3.75Å; I531-F544 HydrophobicContact CD1-CZ 3.8Å; I531-F544 HydrophobicContact CG1-CE2 4.07Å; I531-F544 HydrophobicContact CG1-CZ 4.32Å; C542-F544 VanDerWaalsContact C-N 3.28Å; C542-F544 PolarHBondContact O-N 2.95Å; F544-N546 PolarHBondContact O-N 3.47Å; F544-C547 HydrophobicContact CB-CB 3.84Å; F544-C547 HydrophobicContact CD1-CB 4.36Å; F544-C547 WeakPolarHBondContact O-CB 3.48Å; F544-C547 PolarHBondContact O-N 3.08Å
545	R	92.5	Very high	92.9	Very high	138 Å²	138	87.2 Å²	87.2	52%	0.521	45%	0.451	S	S	.	.	G	3₁₀ helix	trans	-50.1	-36.2	-175.5	-179.1	-176.4	161.2	-150.8	-9.6	113	R525 C542 P543	R525-R545 PolarHBondContact NE-O 3.04Å; R525-R545 PolarHBondContact NH2-O 2.83Å; C542-R545 HydrophobicContact CB-CB 4.18Å; C542-R545 WeakPolarHBondContact O-CB 3.36Å; C542-R545 PolarHBondContact O-N 2.76Å; P543-R545 PolarHBondContact O-N 3.2Å
546	N	91.6	Very high	93	Very high	129 Å²	129	85.5 Å²	85.5	69%	0.69	45%	0.449	S	S	*	.	G	3₁₀ helix	trans	-117.7	19.8	-179.6	-60.1	-4.6	0	0	0	112.4	F544	F544-N546 PolarHBondContact O-N 3.47Å
547	C	94.9	Very high	93.1	Very high	28 Å²	28	80.7 Å²	80.7	19%	0.189	43%	0.434	C	S	.	.			trans	-63.2	131.1	-176	-176.2	0	0	0	0	111.5	H529 F544 C549 C552	H529-C547 PolarHBondContact CE1-SG 2.67Å; H529-C547 PolarHBondContact NE2-SG 2.79Å; H529-C547 VanDerWaalsContact NE2-SG 3.39Å; F544-C547 HydrophobicContact CB-CB 3.84Å; F544-C547 HydrophobicContact CD1-CB 4.36Å; F544-C547 WeakPolarHBondContact O-CB 3.48Å; F544-C547 PolarHBondContact O-N 3.08Å; C547-C549 VanDerWaalsContact C-N 3.34Å; C547-C549 PolarHBondContact O-N 3.03Å; C547-C552 HydrophobicContact CB-CB 4.14Å; C547-C552 WeakPolarHBondContact O-CB 3.13Å
548	P	93.7	Very high	93.2	Very high	116 Å²	116	86.5 Å²	86.5	75%	0.753	44%	0.435	S	S	*	.			trans	-78.3	-9.9	-175.2	31.2	-36.9	0	0	0	114.7
549	C	96.4	Very high	93.1	Very high	40 Å²	40	90 Å²	90	27%	0.27	45%	0.449	S	S	.	.	S	Bend	trans	-61	147.5	-175.7	77.8	0	0	0	0	112.3	H529 C547 C552 R553	H529-C549 PolarHBondContact CE1-SG 3.39Å; H529-C549 PolarHBondContact NE2-SG 3.32Å; H529-C549 VanDerWaalsContact NE2-SG 3.43Å; C547-C549 VanDerWaalsContact C-N 3.34Å; C547-C549 PolarHBondContact O-N 3.03Å; C549-C552 CarbonylContact O-C 3.29Å; C549-C552 WeakPolarHBondContact O-CA 3.15Å; C549-C552 WeakPolarHBondContact O-CB 2.97Å; C549-C552 PolarHBondContact O-N 2.95Å; C549-R553 PolarHBondContact O-N 3.42Å
550	D	95.5	Very high	93.1	Very high	84 Å²	84	86.7 Å²	86.7	45%	0.449	44%	0.44	S	S	.	.	H	α-helix	trans	-55.2	-43.5	-174.5	-83.6	-57.4	0	0	0	115.5	C552 R553 L554	D550-C552 PolarHBondContact O-N 2.94Å; D550-R553 PolarHBondContact O-N 2.87Å; D550-R553 VanDerWaalsContact O-N 3.16Å; D550-R553 IonicContact OD1-CZ 3.22Å; D550-R553 IonicContact OD1-NE 2.8Å; D550-R553 PolarHBondContact OD1-NE 3Å; D550-R553 IonicContact OD1-NH2 2.81Å; D550-R553 PolarHBondContact OD1-NH2 3.36Å; D550-R553 IonicContact OD2-NH2 2.7Å; D550-L554 WeakPolarHBondContact O-CB 3.38Å; D550-L554 VanDerWaalsContact O-CG 3.28Å; D550-L554 WeakPolarHBondContact O-CG 3.31Å; D550-L554 PolarHBondContact O-N 3.46Å
551	P	95.3	Very high	93.2	Very high	66 Å²	66	81.7 Å²	81.7	43%	0.429	42%	0.424	S	S	.	.	H	α-helix	trans	-55.4	-34.4	172.6	-28.9	37.2	0	0	0	113.5	N528 I555	N528-P551 HydrophobicContact CB-CB 3.85Å; N528-P551 VanDerWaalsContact ND2-CB 3.3Å; N528-P551 WeakPolarHBondContact ND2-CB 3.32Å; N528-P551 PolarHBondContact ND2-O 3.27Å; P551-I555 WeakPolarHBondContact O-CG1 3.5Å
552	C	95.3	Very high	93.1	Very high	0 Å²	0	80.6 Å²	80.6	0%	0	41%	0.411	C	S	.	.	H	α-helix	trans	-84.4	-31.5	177.3	-79.7	0	0	0	0	113.2	R525 N528 H529 C547 C549 D550 I555	R525-C552 PolarHBondContact NH1-O 3Å; N528-C552 PolarHBondContact ND2-N 3.22Å; H529-C552 PolarHBondContact NE2-SG 3.25Å; H529-C552 VanDerWaalsContact NE2-SG 3.43Å; C547-C552 HydrophobicContact CB-CB 4.14Å; C547-C552 WeakPolarHBondContact O-CB 3.13Å; C549-C552 CarbonylContact O-C 3.29Å; C549-C552 WeakPolarHBondContact O-CA 3.15Å; C549-C552 WeakPolarHBondContact O-CB 2.97Å; C549-C552 PolarHBondContact O-N 2.95Å; D550-C552 PolarHBondContact O-N 2.94Å; C552-I555 WeakPolarHBondContact O-CB 3.38Å; C552-I555 PolarHBondContact O-N 2.89Å
553	R	93.8	Very high	93	Very high	146 Å²	146	85.4 Å²	85.4	55%	0.551	43%	0.431	S	S	*	.	H	α-helix	trans	-62.1	-47	171	-171.5	162.3	73	143.9	-6.7	111.1	C549 D550 I555 N556 V557	C549-R553 PolarHBondContact O-N 3.42Å; D550-R553 PolarHBondContact O-N 2.87Å; D550-R553 VanDerWaalsContact O-N 3.16Å; D550-R553 IonicContact OD1-CZ 3.22Å; D550-R553 IonicContact OD1-NE 2.8Å; D550-R553 PolarHBondContact OD1-NE 3Å; D550-R553 IonicContact OD1-NH2 2.81Å; D550-R553 PolarHBondContact OD1-NH2 3.36Å; D550-R553 IonicContact OD2-NH2 2.7Å; R553-I555 PolarHBondContact O-N 3.37Å; R553-N556 WeakPolarHBondContact O-CB 3.42Å; R553-N556 PolarHBondContact O-N 2.97Å; R553-V557 PolarHBondContact O-N 3.04Å; R553-V557 VanDerWaalsContact O-N 3.16Å
554	L	92.8	Very high	92.9	Very high	106 Å²	106	84.1 Å²	84.1	56%	0.555	42%	0.422	S	S	*	.	H	α-helix	trans	-61.4	-26.7	176.6	-70.2	169.1	0	0	0	113.6	D550 R558	D550-L554 WeakPolarHBondContact O-CB 3.38Å; D550-L554 VanDerWaalsContact O-CG 3.28Å; D550-L554 WeakPolarHBondContact O-CG 3.31Å; D550-L554 PolarHBondContact O-N 3.46Å; L554-R558 VanDerWaalsContact O-CB 3.3Å; L554-R558 WeakPolarHBondContact O-CB 3.38Å; L554-R558 PolarHBondContact O-N 2.92Å; L554-R558 VanDerWaalsContact O-N 3.07Å
555	I	92.4	Very high	92.7	Very high	22 Å²	22	86.7 Å²	86.7	11%	0.113	44%	0.437	C	S	.	.	H	α-helix	trans	-70.3	-31.1	172.7	-68.6	166.9	0	0	0	111.9	R524 R525 N528 P551 C552 R553 K559	R524-I555 HydrophobicContact CB-CD1 4.08Å; R524-I555 HydrophobicContact CG-CD1 3.67Å; R524-I555 HydrophobicContact CG-CG1 4.15Å; R525-I555 HydrophobicContact CG-CD1 4.05Å; N528-I555 WeakPolarHBondContact ND2-CD1 3.32Å; P551-I555 WeakPolarHBondContact O-CG1 3.5Å; C552-I555 WeakPolarHBondContact O-CB 3.38Å; C552-I555 PolarHBondContact O-N 2.89Å; R553-I555 PolarHBondContact O-N 3.37Å; I555-K559 HydrophobicContact CG2-CD 4.26Å; I555-K559 WeakPolarHBondContact O-CD 3.36Å; I555-K559 VanDerWaalsContact O-CG 3.27Å; I555-K559 WeakPolarHBondContact O-CG 3.46Å; I555-K559 PolarHBondContact O-N 3.14Å
556	N	89.3	Confident	92.6	Very high	59 Å²	59	88 Å²	88	32%	0.316	44%	0.442	S	S	.	.	H	α-helix	trans	-71.1	-59.9	174.1	-62.1	-7.2	0	0	0	108.7	R525 R553 R558 K559 D560	R525-N556 PolarHBondContact NH1-OD1 3.48Å; R525-N556 PolarHBondContact NH2-OD1 2.94Å; R553-N556 WeakPolarHBondContact O-CB 3.42Å; R553-N556 PolarHBondContact O-N 2.97Å; N556-R558 PolarHBondContact O-N 3.29Å; N556-R558 VanDerWaalsContact O-N 3.08Å; N556-K559 WeakPolarHBondContact O-CA 3.42Å; N556-K559 WeakPolarHBondContact O-CB 3.34Å; N556-K559 PolarHBondContact O-N 2.91Å; N556-D560 VanDerWaalsContact O-CG 3.25Å; N556-D560 PolarHBondContact O-N 2.88Å
557	V	91.2	Very high	92.6	Very high	80 Å²	80	85.4 Å²	85.4	49%	0.485	43%	0.426	S	S	.	.	H	α-helix	trans	-49.5	-44.7	-178.1	179.8	0	0	0	0	111.9	R553 K559 D560 T561	R553-V557 PolarHBondContact O-N 3.04Å; R553-V557 VanDerWaalsContact O-N 3.16Å; V557-K559 PolarHBondContact O-N 3.23Å; V557-D560 PolarHBondContact O-N 3.48Å; V557-T561 HydrophobicContact CG1-CG2 4.48Å; V557-T561 WeakPolarHBondContact O-CG2 3.13Å; V557-T561 PolarHBondContact O-N 2.79Å; V557-T561 PolarHBondContact O-OG1 3.34Å; V557-T561 VanDerWaalsContact O-OG1 3.1Å
558	R	92.1	Very high	92.1	Very high	192 Å²	192	89 Å²	89	73%	0.725	44%	0.441	S	S	*	.	H	α-helix	trans	-65.3	-33.6	177.2	-171	-177.4	-60.4	-171.4	0.1	114.1	L554 N556 T561 E562	L554-R558 VanDerWaalsContact O-CB 3.3Å; L554-R558 WeakPolarHBondContact O-CB 3.38Å; L554-R558 PolarHBondContact O-N 2.92Å; L554-R558 VanDerWaalsContact O-N 3.07Å; N556-R558 PolarHBondContact O-N 3.29Å; N556-R558 VanDerWaalsContact O-N 3.08Å; R558-T561 PolarHBondContact O-OG1 3.49Å; R558-E562 WeakPolarHBondContact O-CB 3.07Å; R558-E562 PolarHBondContact O-N 2.86Å
559	K	90.2	Very high	91.8	Very high	91 Å²	91	88 Å²	88	40%	0.396	43%	0.433	S	S	.	.	H	α-helix	trans	-74.8	-36.8	175.7	-73.7	169.3	-177.8	168.7	0	111.4	I555 N556 V557 K563	I555-K559 HydrophobicContact CG2-CD 4.26Å; I555-K559 WeakPolarHBondContact O-CD 3.36Å; I555-K559 VanDerWaalsContact O-CG 3.27Å; I555-K559 WeakPolarHBondContact O-CG 3.46Å; I555-K559 PolarHBondContact O-N 3.14Å; N556-K559 WeakPolarHBondContact O-CA 3.42Å; N556-K559 WeakPolarHBondContact O-CB 3.34Å; N556-K559 PolarHBondContact O-N 2.91Å; V557-K559 PolarHBondContact O-N 3.23Å; K559-K563 WeakPolarHBondContact O-CB 3.47Å; K559-K563 PolarHBondContact O-N 3.03Å
560	D	91.3	Very high	91	Very high	91 Å²	91	89.5 Å²	89.5	49%	0.487	44%	0.443	S	S	.	.	H	α-helix	trans	-72.8	-41.6	-177.9	-55.8	-36.8	0	0	0	110	N556 V557 K563 T564	N556-D560 VanDerWaalsContact O-CG 3.25Å; N556-D560 PolarHBondContact O-N 2.88Å; V557-D560 PolarHBondContact O-N 3.48Å; D560-K563 WeakPolarHBondContact O-CB 3.33Å; D560-K563 PolarHBondContact O-N 3.44Å; D560-T564 PolarHBondContact O-N 2.87Å; D560-T564 PolarHBondContact O-OG1 2.99Å; D560-T564 VanDerWaalsContact O-OG1 3.09Å
561	T	91	Very high	89.8	Confident	75 Å²	75	92.7 Å²	92.7	46%	0.46	46%	0.455	S	S	.	.	H	α-helix	trans	-66.2	-40.9	171.6	56.8	0	0	0	0	113.2	V557 R558 K563 T564 L565	V557-T561 HydrophobicContact CG1-CG2 4.48Å; V557-T561 WeakPolarHBondContact O-CG2 3.13Å; V557-T561 PolarHBondContact O-N 2.79Å; V557-T561 PolarHBondContact O-OG1 3.34Å; V557-T561 VanDerWaalsContact O-OG1 3.1Å; R558-T561 PolarHBondContact O-OG1 3.49Å; T561-K563 VanDerWaalsContact C-N 3.31Å; T561-K563 PolarHBondContact O-N 3.01Å; T561-T564 PolarHBondContact O-N 2.97Å; T561-L565 WeakPolarHBondContact O-CB 3.3Å; T561-L565 VanDerWaalsContact O-CG 3.28Å; T561-L565 WeakPolarHBondContact O-CG 2.99Å; T561-L565 PolarHBondContact O-N 3.25Å
562	E	92.4	Very high	88.4	Confident	83 Å²	83	96 Å²	96	39%	0.388	47%	0.47	S	S	.	.	H	α-helix	trans	-61.3	-37.7	173.6	177.1	67	-169.2	0	0	112	R558 R566	R558-E562 WeakPolarHBondContact O-CB 3.07Å; R558-E562 PolarHBondContact O-N 2.86Å; E562-R566 VanDerWaalsContact O-CG 3.31Å; E562-R566 WeakPolarHBondContact O-CG 3.29Å; E562-R566 PolarHBondContact O-N 3.48Å; E562-R566 VanDerWaalsContact O-N 3.09Å; E562-R566 IonicContact OE1-CZ 2.77Å; E562-R566 IonicContact OE1-NE 3.14Å; E562-R566 PolarHBondContact OE1-NE 3.18Å; E562-R566 IonicContact OE1-NH2 2.61Å; E562-R566 PolarHBondContact OE1-NH2 3.13Å
563	K	92.2	Very high	86.3	Confident	110 Å²	110	103.2 Å²	103.2	48%	0.478	50%	0.503	S	S	.	.	H	α-helix	trans	-63.3	-53.7	173.7	-173.5	-163.6	173.2	-93.8	0	110.5	K559 D560 T561 L565 R566 E567	K559-K563 WeakPolarHBondContact O-CB 3.47Å; K559-K563 PolarHBondContact O-N 3.03Å; D560-K563 WeakPolarHBondContact O-CB 3.33Å; D560-K563 PolarHBondContact O-N 3.44Å; T561-K563 VanDerWaalsContact C-N 3.31Å; T561-K563 PolarHBondContact O-N 3.01Å; K563-L565 VanDerWaalsContact C-N 3.29Å; K563-L565 PolarHBondContact O-N 3.45Å; K563-R566 WeakPolarHBondContact O-CB 3.02Å; K563-R566 PolarHBondContact O-N 3.15Å; K563-R566 VanDerWaalsContact O-N 3.09Å; K563-E567 VanDerWaalsContact CE-OE1 3.22Å; K563-E567 WeakPolarHBondContact CE-OE1 3.47Å; K563-E567 IonicContact NZ-OE1 3.91Å; K563-E567 PolarHBondContact NZ-OE1 3.33Å; K563-E567 IonicContact NZ-OE2 3.78Å; K563-E567 PolarHBondContact NZ-OE2 2.96Å; K563-E567 WeakPolarHBondContact O-CG 3.41Å; K563-E567 PolarHBondContact O-N 3.17Å
564	T	92	Very high	84.5	Confident	69 Å²	69	103.5 Å²	103.5	42%	0.423	52%	0.515	S	S	.	.	H	α-helix	trans	-61.4	-37.4	-179.7	-53.3	0	0	0	0	111.9	D560 T561 E567 M568	D560-T564 PolarHBondContact O-N 2.87Å; D560-T564 PolarHBondContact O-OG1 2.99Å; D560-T564 VanDerWaalsContact O-OG1 3.09Å; T561-T564 PolarHBondContact O-N 2.97Å; T564-E567 PolarHBondContact O-N 3.21Å; T564-M568 HydrophobicContact CG2-CE 4.16Å; T564-M568 HydrophobicContact CG2-CG 4.44Å; T564-M568 HydrophobicContact CG2-SD 4.36Å; T564-M568 WeakPolarHBondContact O-CB 3.47Å; T564-M568 VanDerWaalsContact O-CG 3.3Å; T564-M568 WeakPolarHBondContact O-CG 3.07Å; T564-M568 PolarHBondContact O-N 3.4Å
565	L	90.2	Very high	82.7	Confident	95 Å²	95	106.9 Å²	106.9	50%	0.497	53%	0.525	S	S	.	.	H	α-helix	trans	-61.6	-44	173.4	-76.8	166.5	0	0	0	112.1	T561 K563 M568 V569	T561-L565 WeakPolarHBondContact O-CB 3.3Å; T561-L565 VanDerWaalsContact O-CG 3.28Å; T561-L565 WeakPolarHBondContact O-CG 2.99Å; T561-L565 PolarHBondContact O-N 3.25Å; K563-L565 VanDerWaalsContact C-N 3.29Å; K563-L565 PolarHBondContact O-N 3.45Å; L565-M568 HydrophobicContact CD2-CE 3.91Å; L565-M568 HydrophobicContact CG-CE 4.44Å; L565-V569 VanDerWaalsContact O-CG2 3.31Å; L565-V569 WeakPolarHBondContact O-CG2 3.49Å; L565-V569 PolarHBondContact O-N 3.2Å
566	R	91.5	Very high	80.2	Confident	166 Å²	166	110.7 Å²	110.7	63%	0.626	55%	0.551	S	S	*	*	H	α-helix	trans	-64.9	-41.4	175.9	-73.6	171.3	-177	-93.9	-11	112.3	E562 K563 V569 S570	E562-R566 VanDerWaalsContact O-CG 3.31Å; E562-R566 WeakPolarHBondContact O-CG 3.29Å; E562-R566 PolarHBondContact O-N 3.48Å; E562-R566 VanDerWaalsContact O-N 3.09Å; E562-R566 IonicContact OE1-CZ 2.77Å; E562-R566 IonicContact OE1-NE 3.14Å; E562-R566 PolarHBondContact OE1-NE 3.18Å; E562-R566 IonicContact OE1-NH2 2.61Å; E562-R566 PolarHBondContact OE1-NH2 3.13Å; K563-R566 WeakPolarHBondContact O-CB 3.02Å; K563-R566 PolarHBondContact O-N 3.15Å; K563-R566 VanDerWaalsContact O-N 3.09Å; R566-V569 PolarHBondContact O-N 2.94Å; R566-S570 WeakPolarHBondContact O-CB 3.34Å; R566-S570 PolarHBondContact O-N 3.21Å; R566-S570 PolarHBondContact O-OG 3.06Å
567	E	90.8	Very high	77.8	Confident	75 Å²	75	114.2 Å²	114.2	35%	0.35	56%	0.564	S	S	.	*	H	α-helix	trans	-62.5	-50.1	177.2	-71.1	174.8	145.3	0	0	110.6	K563 T564 V569 S570 H571	K563-E567 VanDerWaalsContact CE-OE1 3.22Å; K563-E567 WeakPolarHBondContact CE-OE1 3.47Å; K563-E567 IonicContact NZ-OE1 3.91Å; K563-E567 PolarHBondContact NZ-OE1 3.33Å; K563-E567 IonicContact NZ-OE2 3.78Å; K563-E567 PolarHBondContact NZ-OE2 2.96Å; K563-E567 WeakPolarHBondContact O-CG 3.41Å; K563-E567 PolarHBondContact O-N 3.17Å; T564-E567 PolarHBondContact O-N 3.21Å; E567-V569 VanDerWaalsContact C-N 3.32Å; E567-V569 PolarHBondContact O-N 3.3Å; E567-S570 WeakPolarHBondContact CA-OG 3.49Å; E567-S570 PolarHBondContact O-N 3.37Å; E567-S570 VanDerWaalsContact O-N 3.17Å; E567-S570 PolarHBondContact O-OG 2.87Å; E567-H571 PolarHBondContact O-CD2 2.94Å; E567-H571 PolarHBondContact O-N 2.91Å
568	M	84.6	Confident	75.6	Confident	104 Å²	104	115.9 Å²	115.9	51%	0.512	57%	0.574	S	S	.	*	H	α-helix	trans	-60.6	-35	175.6	-70.3	-174.1	-57.8	0	0	113.9	T564 L565	T564-M568 HydrophobicContact CG2-CE 4.16Å; T564-M568 HydrophobicContact CG2-CG 4.44Å; T564-M568 HydrophobicContact CG2-SD 4.36Å; T564-M568 WeakPolarHBondContact O-CB 3.47Å; T564-M568 VanDerWaalsContact O-CG 3.3Å; T564-M568 WeakPolarHBondContact O-CG 3.07Å; T564-M568 PolarHBondContact O-N 3.4Å; L565-M568 HydrophobicContact CD2-CE 3.91Å; L565-M568 HydrophobicContact CG-CE 4.44Å
569	V	87.3	Confident	73.1	Confident	95 Å²	95	113 Å²	113	58%	0.576	57%	0.573	S	S	*	*	H	α-helix	trans	-69.1	-47.6	173.1	170.1	0	0	0	0	110.5	L565 R566 E567 H571 N572 E573	L565-V569 VanDerWaalsContact O-CG2 3.31Å; L565-V569 WeakPolarHBondContact O-CG2 3.49Å; L565-V569 PolarHBondContact O-N 3.2Å; R566-V569 PolarHBondContact O-N 2.94Å; E567-V569 VanDerWaalsContact C-N 3.32Å; E567-V569 PolarHBondContact O-N 3.3Å; V569-H571 VanDerWaalsContact C-N 3.32Å; V569-H571 PolarHBondContact O-N 3.16Å; V569-N572 PolarHBondContact O-N 3.32Å; V569-N572 VanDerWaalsContact O-N 3.14Å; V569-E573 PolarHBondContact O-N 2.88Å
570	S	79.9	Confident	70.9	Confident	71 Å²	71	111.7 Å²	111.7	50%	0.497	57%	0.573	S	S	.	*	H	α-helix	trans	-64.4	-31.5	-177.5	68	0	0	0	0	114.2	R566 E567	R566-S570 WeakPolarHBondContact O-CB 3.34Å; R566-S570 PolarHBondContact O-N 3.21Å; R566-S570 PolarHBondContact O-OG 3.06Å; E567-S570 WeakPolarHBondContact CA-OG 3.49Å; E567-S570 PolarHBondContact O-N 3.37Å; E567-S570 VanDerWaalsContact O-N 3.17Å; E567-S570 PolarHBondContact O-OG 2.87Å
571	H	70.2	Confident	68.3	Low	150 Å²	150	114.8 Å²	114.8	69%	0.694	58%	0.582	S	S	*	*	H	α-helix	trans	-79.5	-16.9	176.7	-71.6	-57.6	0	0	0	113.8	E567 V569	E567-H571 PolarHBondContact O-CD2 2.94Å; E567-H571 PolarHBondContact O-N 2.91Å; V569-H571 VanDerWaalsContact C-N 3.32Å; V569-H571 PolarHBondContact O-N 3.16Å
572	N	64.9	Low	66.1	Low	137 Å²	137	119.5 Å²	119.5	73%	0.733	60%	0.596	S	S	*	*	H	α-helix	trans	-92.1	-3.5	175.6	-84	-8.2	0	0	0	113.8	V569 L574	V569-N572 PolarHBondContact O-N 3.32Å; V569-N572 VanDerWaalsContact O-N 3.14Å; N572-L574 PolarHBondContact O-N 2.99Å
573	E	52.9	Low	63.7	Low	151 Å²	151	124.2 Å²	124.2	71%	0.706	62%	0.618	S	S	*	*			trans	-75.6	74.7	165.3	-67.9	-159.6	172.3	0	0	110.7	V569 K575	V569-E573 PolarHBondContact O-N 2.88Å; E573-K575 PolarHBondContact O-N 3.43Å
574	L	55.6	Low	60.9	Low	152 Å²	152	126.1 Å²	126.1	80%	0.796	63%	0.634	S	S	*	*			trans	-55.9	106.7	158.2	-74.6	175.9	0	0	0	107.8	N572	N572-L574 PolarHBondContact O-N 2.99Å
575	K	53.6	Low	58.4	Low	177 Å²	177	133.7 Å²	133.7	77%	0.77	65%	0.654	S	S	*	*			trans	-44.7	131.5	178.4	-67.5	179.2	178.4	179	0	109.5	E573 F577	E573-K575 PolarHBondContact O-N 3.43Å; K575-F577 PolarHBondContact O-N 3.09Å; K575-F577 VanDerWaalsContact O-N 3.11Å
576	P	41	Very low	55.9	Low	101 Å²	101	136.1 Å²	136.1	66%	0.656	67%	0.668	S	S	*	*			trans	-57.5	123.4	176.6	23.6	-32.8	0	0	0	108.9	T578	P576-T578 HydrophobicContact CB-CG2 4.13Å; P576-T578 PolarHBondContact O-N 3.14Å; P576-T578 PolarHBondContact O-OG1 2.98Å
577	F	38.3	Very low	53.3	Low	134 Å²	134	135 Å²	135	59%	0.588	67%	0.674	S	S	*	*			trans	-72.8	35	-179.9	-89.1	-89.2	0	0	0	112.7	K575 N579	K575-F577 PolarHBondContact O-N 3.09Å; K575-F577 VanDerWaalsContact O-N 3.11Å; F577-N579 PolarHBondContact O-N 2.72Å
578	T	44.9	Very low	50.6	Low	114 Å²	114	143 Å²	143	70%	0.699	70%	0.703	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77	36.4	-180	51.6	0	0	0	0	112.9	P576	P576-T578 HydrophobicContact CB-CG2 4.13Å; P576-T578 PolarHBondContact O-N 3.14Å; P576-T578 PolarHBondContact O-OG1 2.98Å
579	N	40.5	Very low	48.2	Very low	131 Å²	131	143.6 Å²	143.6	70%	0.701	72%	0.718	S	S	*	*	T	Hydrogen-bonded Turn	trans	-135.4	3.4	177.6	-105.4	4.2	0	0	0	114.5	F577	F577-N579 PolarHBondContact O-N 2.72Å
580	V	42.6	Very low	45.6	Very low	64 Å²	64	144.8 Å²	144.8	39%	0.388	73%	0.725	S	S	.	*	S	Bend	trans	-123.6	38	179.9	-148.5	0	0	0	0	113.6	P661	V580-P661 HydrophobicContact CB-CG 4.16Å; V580-P661 VanDerWaalsContact CG1-CD 3.46Å; V580-P661 HydrophobicContact CG1-CG 4.38Å; V580-P661 HydrophobicContact CG2-CG 4.28Å
581	F	37.9	Very low	43.6	Very low	157 Å²	157	147.3 Å²	147.3	69%	0.689	74%	0.74	S	S	*	*	S	Bend	trans	-131	18.5	167.1	-79.7	-77.2	0	0	0	112.5	C662	F581-C662 WeakPolarHBondContact CE1-SG 3.25Å; F581-C662 WeakPolarHBondContact CZ-SG 3.41Å
582	K	45.3	Very low	41.9	Very low	174 Å²	174	148.5 Å²	148.5	76%	0.757	74%	0.743	S	S	*	*	S	Bend	trans	-110.1	-18.6	179	-78.8	-173.6	172.6	-179.3	0	114.8
583	E	40.5	Very low	40.3	Very low	181 Å²	181	150.3 Å²	150.3	85%	0.846	75%	0.752	S	S	*	*	S	Bend	trans	-118.1	47.4	-170.6	-64.9	-178	160.2	0	0	113.4
584	N	35.2	Very low	39.6	Very low	150 Å²	150	150.8 Å²	150.8	80%	0.802	75%	0.754	S	S	*	*	S	Bend	trans	-156.8	32.6	158.6	-135.6	-13.6	0	0	0	114.7
585	R	39.2	Very low	38.4	Very low	228 Å²	228	148.4 Å²	148.4	86%	0.86	75%	0.75	S	S	*	*	S	Bend	trans	-90.6	-0.8	178.5	-91.4	-172	171.8	-169.9	-2.4	115.1
586	N	37.4	Very low	37.5	Very low	147 Å²	147	147.6 Å²	147.6	79%	0.786	75%	0.753	S	S	*	*	S	Bend	trans	-121.8	66.1	-175.5	-64.7	-4.9	0	0	0	111
587	N	37.1	Very low	37.2	Very low	142 Å²	142	148.1 Å²	148.1	76%	0.759	75%	0.754	S	S	*	*	S	Bend	trans	-179.1	72	155.5	-95	-20.1	0	0	0	112.1
588	Y	32.9	Very low	37.1	Very low	242 Å²	242	149.7 Å²	149.7	95%	0.949	76%	0.763	S	S	*	*	S	Bend	trans	-161	111.2	140.4	-99.6	-63.9	0	0	0	108.3
589	S	35.3	Very low	36.5	Very low	117 Å²	117	148.8 Å²	148.8	82%	0.818	76%	0.761	S	S	*	*			trans	-71.7	146.1	-168.2	-61.9	0	0	0	0	113.1	P591	S589-P591 WeakPolarHBondContact O-CD 3.23Å
590	T	32.7	Very low	36.1	Very low	121 Å²	121	149.4 Å²	149.4	74%	0.742	77%	0.765	S	S	*	*			trans	-72.9	128.2	172.8	44.1	0	0	0	0	110.9	K592	T590-K592 VanDerWaalsContact C-N 3.3Å; T590-K592 PolarHBondContact O-N 3.03Å
591	P	37	Very low	35.5	Very low	123 Å²	123	150.9 Å²	150.9	80%	0.799	78%	0.778	S	S	*	*			trans	-74.4	88.1	162.1	30.6	-31.6	0	0	0	108.6	S589 L593	S589-P591 WeakPolarHBondContact O-CD 3.23Å; P591-L593 PolarHBondContact O-N 2.61Å
592	K	34.5	Very low	35.2	Very low	175 Å²	175	149.5 Å²	149.5	76%	0.761	78%	0.782	S	S	*	*			trans	-63.2	116.3	159.4	-80.4	-174.9	176.7	-179.3	0	107.9	T590	T590-K592 VanDerWaalsContact C-N 3.3Å; T590-K592 PolarHBondContact O-N 3.03Å
593	L	32.7	Very low	34.7	Very low	176 Å²	176	148.2 Å²	148.2	92%	0.921	78%	0.783	S	S	*	*			trans	-119	108.8	155.3	-78.5	178.3	0	0	0	109.2	P591	P591-L593 PolarHBondContact O-N 2.61Å
594	Q	36.7	Very low	34.1	Very low	160 Å²	160	145.3 Å²	145.3	75%	0.748	77%	0.773	S	S	*	*			trans	-134.6	130.7	176.2	-177.2	174.8	1.3	0	0	106.4
595	S	31.6	Very low	33.9	Very low	103 Å²	103	144.2 Å²	144.2	72%	0.72	77%	0.767	S	S	*	*			trans	53	103.9	172.6	56.4	0	0	0	0	119
596	I	34.4	Very low	33.8	Very low	160 Å²	160	139.3 Å²	139.3	82%	0.821	76%	0.763	S	S	*	*			trans	-160.2	111.1	131	-90.7	142.8	0	0	0	103.2
597	V	33.8	Very low	33.4	Very low	111 Å²	111	139.5 Å²	139.5	67%	0.673	76%	0.764	S	S	*	*				76.7	135.4	64.7	175.2	0	0	0	0	112.2
598	Q	36.6	Very low	33.2	Very low	168 Å²	168	138.9 Å²	138.9	79%	0.785	76%	0.759	S	S	*	*			trans	74.6	85.9	171.8	-75.6	153.4	-4.5	0	0	119.7
599	S	32.5	Very low	33	Very low	94 Å²	94	135.7 Å²	135.7	66%	0.657	75%	0.753	S	S	*	*				58.7	143.5	111.7	63.2	0	0	0	0	123.5
600	N	33.5	Very low	32.9	Very low	145 Å²	145	133.7 Å²	133.7	78%	0.775	74%	0.744	S	S	*	*			trans	85.3	86.8	150	-63.8	-1.3	0	0	0	120.5
601	S	29.9	Very low	33.1	Very low	95 Å²	95	133.4 Å²	133.4	66%	0.664	74%	0.737	S	S	*	*				60.7	131	113.6	65.2	0	0	0	0	123
602	T	30.8	Very low	32.7	Very low	128 Å²	128	137.3 Å²	137.3	79%	0.785	74%	0.738	S	S	*	*			trans	80.1	144.3	137.5	46.2	0	0	0	0	122.2
603	L	34	Very low	32.9	Very low	146 Å²	146	133.8 Å²	133.8	76%	0.764	73%	0.733	S	S	*	*			trans	81.5	97	159.6	-67.9	165	0	0	0	120.4
604	N	29.7	Very low	32.9	Very low	120 Å²	120	134.7 Å²	134.7	64%	0.642	73%	0.725	S	S	*	*				64.7	126.3	109.5	-74.5	51.3	0	0	0	123.8
605	D	30.2	Very low	32.9	Very low	127 Å²	127	134.5 Å²	134.5	68%	0.679	72%	0.722	S	S	*	*				75.2	159.3	128.5	-57.3	-23.5	0	0	0	122.2
606	T	36.1	Very low	33.1	Very low	125 Å²	125	134.7 Å²	134.7	77%	0.767	72%	0.721	S	S	*	*			trans	64.7	123.3	178.8	46.2	0	0	0	0	115.6
607	N	29.4	Very low	32.9	Very low	151 Å²	151	132.1 Å²	132.1	81%	0.807	72%	0.717	S	S	*	*			cis	66.3	157.7	29.6	-156.5	17.3	0	0	0	114.1
608	I	33.5	Very low	32.8	Very low	130 Å²	130	134.8 Å²	134.8	67%	0.667	73%	0.726	S	S	*	*			trans	79.5	111.9	-165.4	-52.4	169.7	0	0	0	109.5
609	Q	29.5	Very low	32.5	Very low	174 Å²	174	134 Å²	134	81%	0.813	73%	0.727	S	S	*	*			cis	89.2	152.9	46.4	-177.2	-176.2	-9.8	0	0	112.3
610	A	32.5	Very low	32.5	Very low	76 Å²	76	135 Å²	135	63%	0.628	73%	0.732	S	S	*	*			trans	108.1	97.3	164.1	0	0	0	0	0	118.1
611	D	35.8	Very low	32.2	Very low	114 Å²	114	134.6 Å²	134.6	61%	0.61	72%	0.72	S	S	*	*				78.2	108.9	107.1	-62.8	4.1	0	0	0	123.6
612	Y	30.3	Very low	32.3	Very low	205 Å²	205	133.3 Å²	133.3	80%	0.804	71%	0.706	S	S	*	*				70.1	169.2	121.6	-66.2	-45	0	0	0	121.2
613	P	37.6	Very low	32.2	Very low	102 Å²	102	132 Å²	132	66%	0.662	69%	0.694	S	S	*	*			cis	-140.1	179.4	-41.1	37.1	-20.9	0	0	0	115.3
614	Y	32.2	Very low	31.9	Very low	194 Å²	194	128.5 Å²	128.5	76%	0.761	68%	0.682	S	S	*	*			trans	70.8	156.6	147.1	-104.2	-155.9	0	0	0	119
615	K	37.4	Very low	32	Very low	156 Å²	156	130 Å²	130	68%	0.678	69%	0.69	S	S	*	*			cis	-150.8	158.7	-9	-155.8	177.7	-172.9	171.3	0	109.3
616	P	35.7	Very low	32.1	Very low	108 Å²	108	132.5 Å²	132.5	70%	0.701	70%	0.695	S	S	*	*			trans	-122.7	-168.6	-169.1	38	-21	0	0	0	115.7
617	S	29.9	Very low	31.9	Very low	105 Å²	105	133.4 Å²	133.4	73%	0.734	69%	0.693	S	S	*	*			trans	109	156.5	145.9	-58.4	0	0	0	0	120.6
618	I	32.1	Very low	31.9	Very low	168 Å²	168	132.2 Å²	132.2	86%	0.862	69%	0.687	S	S	*	*			trans	105.2	130.9	155.3	-48	-175.2	0	0	0	117.6
619	N	30.4	Very low	32.1	Very low	152 Å²	152	131.6 Å²	131.6	81%	0.813	69%	0.689	S	S	*	*			trans	-74.4	-167.8	174.5	-80.1	-20.7	0	0	0	111.8
620	P	33.2	Very low	32.4	Very low	115 Å²	115	129.2 Å²	129.2	75%	0.747	68%	0.682	S	S	*	*			cis	-142	-179.4	6.1	43.9	-23.8	0	0	0	118.5
621	Y	27.2	Very low	32.6	Very low	135 Å²	135	134.1 Å²	134.1	53%	0.529	69%	0.691	S	S	.	*			trans	-37.9	140.8	147.8	-104.5	-144.1	0	0	0	116.9	P1114	Y621-P1114 HydrophobicContact CD1-CB 4.04Å; Y621-P1114 HydrophobicContact CD1-CG 4.01Å; Y621-P1114 HydrophobicContact CD2-CG 4.01Å; Y621-P1114 HydrophobicContact CE1-CB 3.89Å; Y621-P1114 HydrophobicContact CE1-CG 3.89Å; Y621-P1114 HydrophobicContact CE2-CG 3.87Å; Y621-P1114 HydrophobicContact CG-CG 4.07Å
622	N	30.3	Very low	32.8	Very low	68 Å²	68	133.9 Å²	133.9	36%	0.364	70%	0.696	S	S	.	*				138	136.5	124.6	-76.6	-2.6	0	0	0	122.4	V1113 P1114 S1115	N622-V1113 CarbonylContact C-O 3.28Å; N622-V1113 WeakPolarHBondContact CA-O 3.29Å; N622-V1113 PolarHBondContact N-O 2.87Å; N622-P1114 CarbonylContact C-O 3.02Å; N622-P1114 WeakPolarHBondContact CA-O 3.08Å; N622-P1114 PolarHBondContact OD1-O 3.2Å; N622-P1114 VanDerWaalsContact OD1-O 3.12Å; N622-S1115 PolarHBondContact ND2-O 3.36Å; N622-S1115 PolarHBondContact OD1-N 2.88Å
623	N	28.8	Very low	33	Very low	100 Å²	100	131.3 Å²	131.3	54%	0.535	70%	0.696	S	S	.	*			trans	81.3	108.8	138.2	-87.3	-35.7	0	0	0	126.2	V1113 P1114	N623-V1113 PolarHBondContact N-O 3.48Å; N623-P1114 WeakPolarHBondContact CA-O 3.28Å; N623-P1114 PolarHBondContact N-O 3.1Å; N623-P1114 PolarHBondContact OD1-O 3.09Å
624	S	28.4	Very low	33	Very low	74 Å²	74	129 Å²	129	52%	0.517	69%	0.691	S	S	.	*				75.7	134.1	111.1	-68.7	0	0	0	0	125.4
625	N	31.4	Very low	33.1	Very low	150 Å²	150	126.7 Å²	126.7	80%	0.802	69%	0.692	S	S	*	*			trans	74.2	161.5	149.7	-65	-37.1	0	0	0	118
626	K	32.9	Very low	33	Very low	181 Å²	181	126.4 Å²	126.4	79%	0.787	69%	0.693	S	S	*	*			cis	-167.4	176	23.5	-146	175.4	-176.8	177.8	0	112.6
627	I	32.5	Very low	33.1	Very low	143 Å²	143	128.8 Å²	128.8	73%	0.733	69%	0.693	S	S	*	*			trans	90.2	99.2	150.6	-66.6	159.5	0	0	0	121.2
628	N	28.6	Very low	33.3	Very low	126 Å²	126	130.6 Å²	130.6	67%	0.674	69%	0.692	S	S	*	*				71.1	132.4	116.3	-157.3	27	0	0	0	124.4
629	V	38.2	Very low	33.3	Very low	117 Å²	117	130.8 Å²	130.8	71%	0.709	69%	0.69	S	S	*	*				170.6	109.1	113.4	161.7	0	0	0	0	113.9
630	N	35.8	Very low	33.6	Very low	124 Å²	124	131.7 Å²	131.7	66%	0.663	69%	0.689	S	S	*	*			trans	33.9	121.1	143	-52	-23.5	0	0	0	125.4
631	H	34.8	Very low	33.7	Very low	179 Å²	179	131.8 Å²	131.8	83%	0.829	69%	0.687	S	S	*	*				35.4	159.6	116.1	-91.7	-85.8	0	0	0	123.1
632	P	40.2	Very low	34.2	Very low	109 Å²	109	132 Å²	132	71%	0.708	70%	0.697	S	S	*	*			cis	-130.3	-151	4.2	35.8	-11.2	0	0	0	112.2
633	N	34.6	Very low	34.3	Very low	151 Å²	151	135.6 Å²	135.6	81%	0.807	72%	0.715	S	S	*	*			cis	-161.2	156.3	3.1	-160.5	22.8	0	0	0	114.4
634	G	38.1	Very low	34.4	Very low	55 Å²	55	137.1 Å²	137.1	57%	0.567	72%	0.723	S	S	*	*			trans	67.1	147.7	143.6	0	0	0	0	0	123.1
635	N	34.2	Very low	34.6	Very low	145 Å²	145	140.9 Å²	140.9	78%	0.775	73%	0.733	S	S	*	*			cis	-168.7	123.7	-38.7	48.2	-84.1	0	0	0	111.2
636	E	36.5	Very low	34.6	Very low	150 Å²	150	140.8 Å²	140.8	70%	0.701	73%	0.727	S	S	*	*				168.2	122.6	128.8	-88.1	-147.5	123.4	0	0	112.2
637	K	36.9	Very low	34.4	Very low	158 Å²	158	138.1 Å²	138.1	69%	0.687	72%	0.72	S	S	*	*			trans	53.7	105.8	158.9	-64.3	159.3	-174.3	137.1	0	118.1
638	I	33.4	Very low	34.3	Very low	143 Å²	143	139 Å²	139	73%	0.733	73%	0.726	S	S	*	*				64.2	123.5	60.9	-53	162.5	0	0	0	109.7
639	E	33	Very low	34.4	Very low	171 Å²	171	139.7 Å²	139.7	80%	0.799	73%	0.725	S	S	*	*			cis	-145	165.2	16.9	-125.4	137.3	-144.4	0	0	108.1
640	E	35.9	Very low	33.9	Very low	171 Å²	171	138.6 Å²	138.6	80%	0.799	72%	0.723	S	S	*	*			cis	-147.4	163.5	1.1	-160.4	171.4	-165.6	0	0	110
641	T	36.3	Very low	33.7	Very low	117 Å²	117	139.9 Å²	139.9	72%	0.718	73%	0.729	S	S	*	*			trans	-74.9	169.5	-176.2	38.5	0	0	0	0	114.3
642	L	36.6	Very low	33.4	Very low	139 Å²	139	137.6 Å²	137.6	73%	0.728	72%	0.722	S	S	*	*			cis	-147.2	146.2	38	-85.4	83.6	0	0	0	114.9
643	I	33.4	Very low	32.8	Very low	144 Å²	144	139.2 Å²	139.2	74%	0.738	72%	0.724	S	S	*	*			trans	53.2	87.2	142.5	-56.7	176.7	0	0	0	115.6
644	N	30	Very low	32.6	Very low	132 Å²	132	137.1 Å²	137.1	71%	0.706	72%	0.722	S	S	*	*				43.1	113.4	80.6	-69	-13.8	0	0	0	115.1
645	Q	34	Very low	32.3	Very low	154 Å²	154	146 Å²	146	72%	0.72	74%	0.738	S	S	*	*				81.2	145.7	57.3	-76.6	-156	26.5	0	0	116
646	Q	31.2	Very low	32	Very low	148 Å²	148	144.8 Å²	144.8	69%	0.692	74%	0.738	S	S	*	*			trans	77.1	109.7	156.5	-72.9	161.9	-27.5	0	0	117.1
647	I	27.8	Very low	31.7	Very low	125 Å²	125	143.2 Å²	143.2	64%	0.641	74%	0.741	S	S	*	*				77.3	112	90.3	-70.4	175.7	0	0	0	112.2	E649	I647-E649 HydrophobicContact CG2-CB 4.48Å; I647-E649 HydrophobicContact CG2-CG 3.82Å
648	N	30.9	Very low	31.4	Very low	160 Å²	160	145.9 Å²	145.9	86%	0.856	75%	0.752	S	S	*	*				-149.7	117.2	123.7	-84.4	-49.9	0	0	0	106.5
649	E	29.6	Very low	31.3	Very low	141 Å²	141	144.4 Å²	144.4	66%	0.659	76%	0.755	S	S	*	*				73.2	104	62.4	-83.8	-69.2	141.4	0	0	114.6	I647	I647-E649 HydrophobicContact CG2-CB 4.48Å; I647-E649 HydrophobicContact CG2-CG 3.82Å
650	S	29.4	Very low	31.3	Very low	94 Å²	94	140.4 Å²	140.4	66%	0.657	75%	0.745	S	S	*	*			trans	68.3	-179.2	137.7	-71.2	0	0	0	0	119.4
651	L	30.3	Very low	31.5	Very low	152 Å²	152	135.8 Å²	135.8	80%	0.796	73%	0.73	S	S	*	*			trans	77.2	132.4	-175.5	-48.1	-176.7	0	0	0	115.6
652	L	28.8	Very low	31	Very low	130 Å²	130	133.2 Å²	133.2	68%	0.681	72%	0.717	S	S	*	*			cis	-154.6	147	-21	-89.4	-179.6	0	0	0	109.8
653	L	28.5	Very low	30.6	Very low	143 Å²	143	133.2 Å²	133.2	75%	0.749	72%	0.716	S	S	*	*			trans	64.3	155.8	140.7	-88.7	40.7	0	0	0	124.7
654	S	30.3	Very low	30.6	Very low	108 Å²	108	132.7 Å²	132.7	76%	0.755	72%	0.72	S	S	*	*			trans	70.3	110.5	149.6	47.1	0	0	0	0	120.9
655	R	31	Very low	30.8	Very low	242 Å²	242	134.1 Å²	134.1	91%	0.913	72%	0.723	S	S	*	*			trans	-57.6	145.9	152.7	-63.9	172.2	172.3	175	-3	110.7
656	P	29.3	Very low	30.8	Very low	118 Å²	118	133.5 Å²	133.5	77%	0.766	72%	0.723	S	S	*	*				-106	171.2	120.6	-18.4	34.8	0	0	0	113.9
657	P	29.5	Very low	30.7	Very low	118 Å²	118	132.5 Å²	132.5	77%	0.766	72%	0.722	S	S	*	*			trans	-98.2	-179.5	-167.5	39.1	-36.9	0	0	0	115.3
658	K	30.2	Very low	31	Very low	214 Å²	214	133.7 Å²	133.7	93%	0.93	73%	0.725	S	S	*	*			trans	-75.7	124.4	173.1	-56	168.4	-176.1	172.2	0	111
659	S	31	Very low	31	Very low	112 Å²	112	132.1 Å²	132.1	78%	0.783	72%	0.716	S	S	*	*			trans	-154	171.5	163.5	53.5	0	0	0	0	110.9
660	S	33.3	Very low	31	Very low	86 Å²	86	131.6 Å²	131.6	60%	0.601	72%	0.718	S	S	*	*			trans	-105.5	-136.2	-168.9	-59.7	0	0	0	0	114.1
661	P	39.8	Very low	31.2	Very low	74 Å²	74	134.5 Å²	134.5	48%	0.481	73%	0.726	S	S	.	*				-121	-158.3	-124.1	38.3	-17.7	0	0	0	113.2	V580	V580-P661 HydrophobicContact CB-CG 4.16Å; V580-P661 VanDerWaalsContact CG1-CD 3.46Å; V580-P661 HydrophobicContact CG1-CG 4.38Å; V580-P661 HydrophobicContact CG2-CG 4.28Å
662	C	25.9	Very low	31.2	Very low	64 Å²	64	131.2 Å²	131.2	43%	0.432	72%	0.715	S	S	.	*			trans	85.6	105.5	154.5	-150.3	0	0	0	0	118.6	F581	F581-C662 WeakPolarHBondContact CE1-SG 3.25Å; F581-C662 WeakPolarHBondContact CZ-SG 3.41Å
663	L	29.5	Very low	31.2	Very low	138 Å²	138	131.5 Å²	131.5	72%	0.723	72%	0.718	S	S	*	*				55.5	106.3	126.3	-158.6	170.3	0	0	0	118.5
664	T	33.5	Very low	31.4	Very low	133 Å²	133	130.4 Å²	130.4	82%	0.816	71%	0.713	S	S	*	*				-172.8	157.4	122.4	-71.4	0	0	0	0	110.4
665	Q	33.7	Very low	31.6	Very low	162 Å²	162	131.5 Å²	131.5	76%	0.757	71%	0.71	S	S	*	*			trans	-95.3	178.9	-174.4	-60.3	167.5	-46	0	0	112.5
666	L	33	Very low	31.7	Very low	141 Å²	141	126.1 Å²	126.1	74%	0.738	70%	0.699	S	S	*	*			trans	68.8	116.8	147.8	-84.8	154.9	0	0	0	117.7
667	L	30.5	Very low	31.9	Very low	128 Å²	128	125.4 Å²	125.4	67%	0.67	69%	0.693	S	S	*	*				-175	153.4	90	-94.6	173.9	0	0	0	112.9
668	H	33.9	Very low	32.1	Very low	149 Å²	149	126 Å²	126	69%	0.69	69%	0.69	S	S	*	*			trans	65.9	155.8	160.1	-55	139.5	0	0	0	119.5
669	N	30.5	Very low	32.3	Very low	127 Å²	127	121.9 Å²	121.9	68%	0.679	68%	0.678	S	S	*	*			cis	174.2	169.9	-42.7	-105.2	6.2	0	0	0	107.4
670	N	30.2	Very low	32.4	Very low	130 Å²	130	121.9 Å²	121.9	70%	0.695	67%	0.673	S	S	*	*			trans	75.5	110.4	159.3	-59.4	-18.7	0	0	0	115.7
671	L	33.5	Very low	32.4	Very low	156 Å²	156	123.5 Å²	123.5	82%	0.817	68%	0.679	S	S	*	*				86.1	146.5	85.6	-98.8	72.6	0	0	0	112.4
672	S	28.5	Very low	32.1	Very low	83 Å²	83	125 Å²	125	58%	0.58	69%	0.687	S	S	*	*			cis	-168.4	152.4	-10.7	-152.3	0	0	0	0	112.3
673	N	29.8	Very low	32.5	Very low	136 Å²	136	128.3 Å²	128.3	73%	0.727	70%	0.701	S	S	*	*			trans	63.5	159.3	136	-85.2	6.5	0	0	0	124.6
674	N	32.9	Very low	32.8	Very low	120 Å²	120	127.9 Å²	127.9	64%	0.642	70%	0.699	S	S	*	*			trans	86.2	113.9	153.5	-64.2	-17.4	0	0	0	117.5
675	N	34.2	Very low	33	Very low	131 Å²	131	128 Å²	128	70%	0.701	70%	0.695	S	S	*	*				89.5	145.6	68	-69	-1.9	0	0	0	111.1
676	N	32.2	Very low	32.8	Very low	128 Å²	128	127.6 Å²	127.6	68%	0.684	70%	0.698	S	S	*	*			cis	-160.6	171.5	-1.7	-122.9	-5.7	0	0	0	112
677	T	33.3	Very low	33.1	Very low	104 Å²	104	125.5 Å²	125.5	64%	0.638	69%	0.693	S	S	*	*			trans	31.2	133.5	148.1	63.8	0	0	0	0	122.4
678	D	35.2	Very low	33	Very low	131 Å²	131	127.7 Å²	127.7	70%	0.701	70%	0.697	S	S	*	*				-176.5	121.5	106.4	-91.3	3.3	0	0	0	109.8
679	N	33.1	Very low	33	Very low	126 Å²	126	127.4 Å²	127.4	67%	0.674	70%	0.698	S	S	*	*				73.9	135	99.2	-62.9	-31.9	0	0	0	114.1
680	T	33.9	Very low	33.2	Very low	112 Å²	112	126.1 Å²	126.1	69%	0.687	70%	0.699	S	S	*	*			cis	-165.3	166.7	9.5	-0.4	0	0	0	0	112.1
681	T	32.4	Very low	33.3	Very low	120 Å²	120	125 Å²	125	74%	0.736	70%	0.697	S	S	*	*			trans	65	142.4	154.5	50.5	0	0	0	0	119.1
682	T	34.5	Very low	33.2	Very low	105 Å²	105	123.3 Å²	123.3	64%	0.644	69%	0.693	S	S	*	*			cis	-159.6	142.7	3.3	9.9	0	0	0	0	111.4
683	N	34.1	Very low	33.4	Very low	134 Å²	134	130 Å²	130	72%	0.717	71%	0.706	S	S	*	*			trans	62.8	144.8	150.7	-52.6	-8.4	0	0	0	118.5
684	N	35.4	Very low	33.4	Very low	129 Å²	129	128.6 Å²	128.6	69%	0.69	71%	0.706	S	S	*	*			cis	-172.2	156.6	-13.7	-109.5	7	0	0	0	107.4
685	N	37.3	Very low	33.5	Very low	135 Å²	135	130.4 Å²	130.4	72%	0.722	71%	0.711	S	S	*	*			cis	-140.1	164.1	-0	-38.1	-98.2	0	0	0	110
686	D	31	Very low	33.5	Very low	155 Å²	155	131.1 Å²	131.1	83%	0.829	71%	0.714	S	S	*	*			trans	-98.2	-156.6	158	-101.7	-53.7	0	0	0	108.9
687	P	38	Very low	33.4	Very low	97 Å²	97	132.1 Å²	132.1	63%	0.63	72%	0.719	S	S	*	*			cis	-125.5	-175.4	-22.3	11.9	15.2	0	0	0	112
688	F	29.9	Very low	33.6	Very low	174 Å²	174	131.5 Å²	131.5	76%	0.763	72%	0.717	S	S	*	*				-172.8	135.7	74.4	-112.6	-114	0	0	0	109.6
689	M	32.9	Very low	33.3	Very low	142 Å²	142	134.6 Å²	134.6	70%	0.7	72%	0.724	S	S	*	*				50.7	135.2	101.3	-54.2	-78.7	99.5	0	0	115.8
690	S	34.3	Very low	33.2	Very low	101 Å²	101	136 Å²	136	71%	0.706	73%	0.731	S	S	*	*			cis	-159.7	149.5	47.7	-58.8	0	0	0	0	112
691	T	32.8	Very low	33	Very low	107 Å²	107	137.2 Å²	137.2	66%	0.656	73%	0.733	S	S	*	*				63.1	120.3	69.9	-25.4	0	0	0	0	110.7
692	T	31.8	Very low	32.9	Very low	119 Å²	119	136.4 Å²	136.4	73%	0.73	73%	0.733	S	S	*	*			cis	-173.1	164.5	15.9	3.9	0	0	0	0	115.5
693	R	31.3	Very low	32.7	Very low	225 Å²	225	142.8 Å²	142.8	85%	0.849	75%	0.745	S	S	*	*			trans	54.3	102.7	132.6	-165.4	177	-169.9	170.1	2.5	119.5
694	S	31.2	Very low	32.4	Very low	105 Å²	105	140.9 Å²	140.9	73%	0.734	74%	0.743	S	S	*	*				101.1	170.1	79.7	-166.8	0	0	0	0	114.1
695	Q	35.3	Very low	32.1	Very low	158 Å²	158	141.9 Å²	141.9	74%	0.738	75%	0.748	S	S	*	*			trans	96.3	126.2	170.5	-56.7	-69.1	16.3	0	0	120.4
696	L	34.5	Very low	31.7	Very low	147 Å²	147	139.4 Å²	139.4	77%	0.77	74%	0.741	S	S	*	*			trans	69.7	87.8	145.2	-60.5	166.8	0	0	0	122.6
697	N	29.3	Very low	31.6	Very low	148 Å²	148	138.6 Å²	138.6	79%	0.791	74%	0.735	S	S	*	*				36.4	151.1	99	-132.5	18.6	0	0	0	119.9
698	P	37.6	Very low	31.2	Very low	92 Å²	92	141.1 Å²	141.1	60%	0.597	74%	0.743	S	S	*	*				-137.1	-177.1	-64.4	41.2	-25.9	0	0	0	114.8
699	K	28.6	Very low	31.2	Very low	195 Å²	195	136.7 Å²	136.7	85%	0.848	73%	0.734	S	S	*	*			trans	69.7	119.5	166.9	-58.4	172	179.1	172.9	0	118
700	L	30.7	Very low	31	Very low	156 Å²	156	137.5 Å²	137.5	82%	0.817	74%	0.74	S	S	*	*				-170.1	154.6	116.9	-104.3	161.7	0	0	0	113.6
701	N	30.1	Very low	30.7	Very low	137 Å²	137	140 Å²	140	73%	0.733	74%	0.744	S	S	*	*			trans	10	142.2	162.1	-73.1	-6.1	0	0	0	124.8
702	S	31.4	Very low	30.5	Very low	104 Å²	104	138.6 Å²	138.6	73%	0.727	74%	0.739	S	S	*	*			trans	52.6	111.4	136.9	66.7	0	0	0	0	122
703	R	28.6	Very low	30.5	Very low	238 Å²	238	140.5 Å²	140.5	90%	0.898	74%	0.74	S	S	*	*				48.2	140.2	110.8	-129.2	179.5	-173.1	178.2	0.3	120.3
704	S	29.1	Very low	30.4	Very low	95 Å²	95	135.9 Å²	135.9	66%	0.664	73%	0.732	S	S	*	*			trans	74.2	98.1	158.2	32.5	0	0	0	0	119.7
705	N	28.8	Very low	30.4	Very low	149 Å²	149	135.9 Å²	135.9	80%	0.797	73%	0.731	S	S	*	*				64.7	119.5	120.5	-59.9	17.5	0	0	0	121
706	S	28.5	Very low	30.1	Very low	83 Å²	83	132.8 Å²	132.8	58%	0.58	73%	0.728	S	S	*	*				91	105	126.8	-170.5	0	0	0	0	118.6
707	I	29.5	Very low	30	Very low	138 Å²	138	133.1 Å²	133.1	71%	0.708	73%	0.725	S	S	*	*			trans	51.9	102.2	133.6	-49.8	168.7	0	0	0	115.8
708	D	28.5	Very low	30	Very low	150 Å²	150	131.6 Å²	131.6	80%	0.802	72%	0.717	S	S	*	*				-128.2	131.9	116.2	-92.2	-47.9	0	0	0	107.2
709	S	29.4	Very low	29.7	Very low	82 Å²	82	136.4 Å²	136.4	57%	0.573	73%	0.725	S	S	*	*				66.1	100	65.8	-46.6	0	0	0	0	111.6
710	I	29.4	Very low	29.9	Very low	159 Å²	159	133.9 Å²	133.9	82%	0.815	72%	0.719	S	S	*	*			trans	-168.1	113.1	141.3	-104.2	154.4	0	0	0	109.9
711	L	28.7	Very low	29.7	Very low	153 Å²	153	133.3 Å²	133.3	80%	0.801	72%	0.718	S	S	*	*				58.4	107.6	125.7	-130.6	41.3	0	0	0	117
712	S	28.7	Very low	29.9	Very low	78 Å²	78	135.9 Å²	135.9	55%	0.545	73%	0.725	S	S	.	*				120	131.2	93.6	-173.7	0	0	0	0	120
713	Q	31.4	Very low	30	Very low	159 Å²	159	135.4 Å²	135.4	74%	0.743	72%	0.721	S	S	*	*			trans	72.6	104.9	141.1	-76.1	168.9	13.8	0	0	120.2
714	N	28.3	Very low	30.2	Very low	128 Å²	128	131.7 Å²	131.7	68%	0.684	72%	0.719	S	S	*	*				107.5	145	104.8	-76.4	-4.6	0	0	0	118.9
715	S	31	Very low	30.3	Very low	104 Å²	104	134.7 Å²	134.7	73%	0.727	73%	0.726	S	S	*	*			trans	64.9	136.4	140.9	54.3	0	0	0	0	119.9
716	S	29.2	Very low	30.9	Very low	94 Å²	94	132.9 Å²	132.9	66%	0.657	72%	0.723	S	S	*	*			cis	179.9	179.6	-27.4	34.5	0	0	0	0	107
717	E	32.4	Very low	31.1	Very low	153 Å²	153	134.2 Å²	134.2	72%	0.715	73%	0.729	S	S	*	*			trans	78.1	107.9	163.4	-46.4	-160.9	166.8	0	0	114.3
718	N	29.4	Very low	31.1	Very low	117 Å²	117	131.5 Å²	131.5	63%	0.626	72%	0.723	S	S	*	*				72.7	123.4	86.6	-55.4	-30.2	0	0	0	110.5
719	Y	31.1	Very low	31.2	Very low	193 Å²	193	126.1 Å²	126.1	76%	0.757	70%	0.697	S	S	*	*				-169.5	148.6	61.6	-103.9	-69.9	0	0	0	113.2
720	L	34.2	Very low	31.1	Very low	141 Å²	141	129.7 Å²	129.7	74%	0.738	70%	0.699	S	S	*	*			trans	60.1	118.4	161.7	-51.4	177.5	0	0	0	116.7
721	N	26.1	Very low	31	Very low	145 Å²	145	127 Å²	127	78%	0.775	68%	0.683	S	S	*	*				62.2	89.9	50.8	-62.9	-8.2	0	0	0	114.6
722	E	35	Very low	30.9	Very low	191 Å²	191	126.1 Å²	126.1	89%	0.893	68%	0.678	S	S	*	*			trans	-168.8	144.2	132.9	-101.6	179.4	120.3	0	0	108.7
723	S	32.4	Very low	30.9	Very low	93 Å²	93	126.4 Å²	126.4	65%	0.65	69%	0.685	S	S	*	*			cis	-167.7	147.5	-26.4	-115.2	0	0	0	0	111.6
724	L	32.7	Very low	30.7	Very low	160 Å²	160	123.7 Å²	123.7	84%	0.838	68%	0.68	S	S	*	*			trans	62.1	110.4	158.6	-81.5	70.8	0	0	0	121.2
725	L	32.5	Very low	30.7	Very low	158 Å²	158	123.2 Å²	123.2	83%	0.827	68%	0.682	S	S	*	*			trans	-73.3	-170.7	143.3	-65.1	76.7	0	0	0	110.7
726	P	39.7	Very low	30.6	Very low	111 Å²	111	125 Å²	125	72%	0.721	68%	0.683	S	S	*	*			cis	-113.8	-134.7	-41.3	33.6	-12.9	0	0	0	108.6
727	P	34.7	Very low	30.5	Very low	111 Å²	111	124.6 Å²	124.6	72%	0.721	68%	0.679	S	S	*	*			cis	-105.6	167.9	22.7	10.6	14.8	0	0	0	112.9
728	S	29.3	Very low	30.4	Very low	82 Å²	82	123.7 Å²	123.7	57%	0.573	68%	0.68	S	S	*	*			cis	90.4	108.9	26.6	92.8	0	0	0	0	117.4
729	S	28.8	Very low	30.3	Very low	36 Å²	36	124.5 Å²	124.5	25%	0.252	68%	0.681	S	S	.	*				66.2	149.9	129.2	-52.4	0	0	0	0	123.4	V1283 D1285	S729-V1283 VanDerWaalsContact C-CG1 3.48Å; S729-V1283 VanDerWaalsContact CA-CG1 3.48Å; S729-D1285 WeakPolarHBondContact CA-OD1 3.07Å; S729-D1285 WeakPolarHBondContact CA-OD2 3.36Å; S729-D1285 WeakPolarHBondContact CB-OD1 3.47Å; S729-D1285 WeakPolarHBondContact CB-OD2 3.37Å; S729-D1285 PolarHBondContact OG-OD1 3.19Å
730	Y	28.3	Very low	30.1	Very low	157 Å²	157	121.6 Å²	121.6	62%	0.616	68%	0.679	S	S	*	*			trans	81.5	129	159.6	-50.4	-51.4	0	0	0	119.8	V1283 D1285	Y730-V1283 WeakPolarHBondContact O-CG2 3.41Å; Y730-D1285 WeakPolarHBondContact CD1-OD2 3.16Å; Y730-D1285 PolarHBondContact N-OD2 3.28Å
731	Q	27.6	Very low	29.8	Very low	102 Å²	102	121.9 Å²	121.9	48%	0.477	68%	0.676	S	S	.	*			cis	-171.3	-162.9	-15.7	-136.2	179.2	15.8	0	0	109.9
732	L	27.2	Very low	29.7	Very low	135 Å²	135	121.2 Å²	121.2	71%	0.707	67%	0.672	S	S	*	*			trans	7.4	133.4	142.1	-59.9	173.5	0	0	0	116.3
733	A	28.1	Very low	29.3	Very low	84 Å²	84	119 Å²	119	69%	0.694	66%	0.659	S	S	*	*				-156.9	143.5	64.7	0	0	0	0	0	111.8
734	T	27.6	Very low	29.1	Very low	103 Å²	103	119.5 Å²	119.5	63%	0.632	65%	0.651	S	S	*	*				47.6	112.1	79.9	-25.4	0	0	0	0	110
735	T	27.5	Very low	28.8	Very low	118 Å²	118	119 Å²	119	72%	0.724	65%	0.645	S	S	*	*				-162.8	150.7	84.2	21.4	0	0	0	0	114.8
736	L	28.4	Very low	28.6	Very low	142 Å²	142	116.1 Å²	116.1	74%	0.743	63%	0.634	S	S	*	*			trans	59.1	101.5	152.7	-90.1	66.5	0	0	0	116.8
737	S	28.1	Very low	28.1	Very low	84 Å²	84	117.5 Å²	117.5	59%	0.587	64%	0.635	S	S	*	*				89.8	152.1	80.1	77.4	0	0	0	0	112.1
738	N	29.2	Very low	27.8	Very low	135 Å²	135	116.3 Å²	116.3	72%	0.722	63%	0.629	S	S	*	*			cis	-128.5	135	17.5	-103.4	-50.8	0	0	0	110.5
739	M	28.4	Very low	27.7	Very low	134 Å²	134	119 Å²	119	66%	0.66	64%	0.636	S	S	*	*				55.5	111.2	100.5	-66.6	-70.1	108.1	0	0	114.6	H741	M739-H741 PolarHBondContact O-N 3.31Å
740	N	25.6	Very low	27.7	Very low	131 Å²	131	124.8 Å²	124.8	70%	0.701	66%	0.659	S	S	*	*				38.7	81.3	111.4	-57.4	-29.2	0	0	0	116.9
741	H	28.3	Very low	27.5	Very low	148 Å²	148	121.4 Å²	121.4	69%	0.685	66%	0.658	S	S	*	*				-146.4	114.5	129.2	-124	-105.6	0	0	0	107	M739	M739-H741 PolarHBondContact O-N 3.31Å
742	L	24.9	Very low	27.4	Very low	131 Å²	131	124.8 Å²	124.8	69%	0.686	67%	0.671	S	S	*	*			cis	62.8	136.5	44	-156.3	82.5	0	0	0	111.6
743	K	26.3	Very low	27.2	Very low	143 Å²	143	123.4 Å²	123.4	62%	0.622	67%	0.673	S	S	*	*			trans	66.4	168.7	153	-116.4	163.9	147.4	-97.1	0	117.4
744	E	26.8	Very low	27.1	Very low	105 Å²	105	124.5 Å²	124.5	49%	0.491	67%	0.671	S	S	.	*			trans	56.1	126.8	160.3	-89.9	85.6	-110.2	0	0	119.3
745	Q	28.1	Very low	27	Very low	150 Å²	150	125 Å²	125	70%	0.701	67%	0.674	S	S	*	*			cis	-163	-179.6	-21.5	-133	166.8	44.9	0	0	109.4
746	T	27.4	Very low	26.9	Very low	97 Å²	97	127.1 Å²	127.1	60%	0.595	68%	0.676	S	S	*	*			trans	-11.2	134.6	154.4	52.3	0	0	0	0	115.5
747	N	28.8	Very low	26.7	Very low	140 Å²	140	125.7 Å²	125.7	75%	0.749	67%	0.668	S	S	*	*				-155.1	148.2	71.6	-98.3	-59.6	0	0	0	117.1
748	S	28.6	Very low	26.7	Very low	85 Å²	85	128.4 Å²	128.4	59%	0.594	67%	0.669	S	S	*	*			trans	75.4	109.5	141.6	-67.7	0	0	0	0	117.8
749	I	27.8	Very low	26.7	Very low	139 Å²	139	126.6 Å²	126.6	71%	0.713	66%	0.66	S	S	*	*				80.9	121	82.5	-77.5	164.1	0	0	0	109.7
750	Q	28	Very low	26.8	Very low	158 Å²	158	122 Å²	122	74%	0.738	64%	0.641	S	S	*	*			cis	-143.9	153.2	-3	-107.8	163.1	-11.9	0	0	106.5
751	S	24.7	Very low	27.1	Very low	86 Å²	86	120.8 Å²	120.8	60%	0.601	64%	0.635	S	S	*	*				46.6	136.4	79.9	128.9	0	0	0	0	112.4
752	K	25.8	Very low	27.1	Very low	173 Å²	173	119.4 Å²	119.4	75%	0.752	63%	0.631	S	S	*	*			cis	177.8	140.8	7	-115.8	171.7	179.9	179.1	0	105.1	T754	K752-T754 PolarHBondContact O-OG1 3.06Å
753	S	24.1	Very low	27.3	Very low	106 Å²	106	119.3 Å²	119.3	74%	0.741	63%	0.631	S	S	*	*			trans	52.9	-161.4	146.7	69.4	0	0	0	0	118.6
754	T	25.4	Very low	27.6	Very low	106 Å²	106	119 Å²	119	65%	0.65	64%	0.641	S	S	*	*			trans	58.2	69.3	159.3	35.2	0	0	0	0	116.3	K752	K752-T754 PolarHBondContact O-OG1 3.06Å
755	T	24.8	Very low	27.7	Very low	115 Å²	115	120.5 Å²	120.5	71%	0.706	65%	0.651	S	S	*	*				70.1	149.1	72.8	72	0	0	0	0	116
756	Q	25.7	Very low	27.5	Very low	162 Å²	162	120.2 Å²	120.2	76%	0.757	65%	0.65	S	S	*	*			trans	76.7	128.4	154.9	-58.2	-125.5	83.2	0	0	115.8
757	L	25.1	Very low	27.4	Very low	111 Å²	111	122.7 Å²	122.7	58%	0.581	66%	0.655	S	S	*	*			cis	-179.7	164.9	22.7	-110.8	166.2	0	0	0	110.9
758	K	27.1	Very low	27.7	Very low	141 Å²	141	123.6 Å²	123.6	61%	0.613	66%	0.658	S	S	*	*			trans	73.8	102.6	152.5	-74.2	153.2	-175.9	168.8	0	117.9
759	N	29.1	Very low	27.7	Very low	97 Å²	97	125.5 Å²	125.5	52%	0.519	66%	0.661	S	S	.	*	B	Isolated β-bridge		67.8	126.2	76.6	-64	18.8	0	0	0	111.8	Q204 K205 L206	Q204-N759 CarbonylContact C-O 3.54Å; Q204-N759 VanDerWaalsContact CA-O 3.28Å; Q204-N759 WeakPolarHBondContact CA-O 3.29Å; K205-N759 CarbonylContact C-O 2.82Å; K205-N759 WeakPolarHBondContact CA-O 3.43Å; K205-N759 PolarHBondContact N-O 3.25Å; L206-N759 PolarHBondContact N-O 3.34Å
760	S	30.5	Very low	27.7	Very low	39 Å²	39	127.2 Å²	127.2	27%	0.273	67%	0.666	S	S	.	*			cis	177.5	175.8	3.3	42.7	0	0	0	0	108.1	Q204 K205 L206	Q204-S760 VanDerWaalsContact C-N 3.3Å; Q204-S760 CarbonylContact C-O 3.54Å; Q204-S760 VanDerWaalsContact C-O 3.29Å; Q204-S760 VanDerWaalsContact O-O 3.07Å; K205-S760 PolarHBondContact N-O 3.02Å; L206-S760 VanDerWaalsContact CA-OG 3.32Å; L206-S760 WeakPolarHBondContact CA-OG 3.33Å; L206-S760 PolarHBondContact N-OG 3.45Å; L206-S760 VanDerWaalsContact N-OG 3.08Å; L206-S760 PolarHBondContact O-OG 3.09Å
761	N	31.3	Very low	27.8	Very low	105 Å²	105	127.7 Å²	127.7	56%	0.561	67%	0.672	S	S	*	*				174.6	123.6	124.4	-83	-5.1	0	0	0	109.5	K205 L206	K205-N761 PolarHBondContact O-ND2 3.1Å; K205-N761 PolarHBondContact O-OD1 3.35Å; K205-N761 VanDerWaalsContact O-OD1 3.09Å; L206-N761 PolarHBondContact O-OD1 3.49Å
762	L	30.1	Very low	27.9	Very low	118 Å²	118	128.6 Å²	128.6	62%	0.618	68%	0.679	S	S	*	*				64.3	120.3	85.8	-90.2	81.5	0	0	0	110.9
763	L	28.4	Very low	27.9	Very low	130 Å²	130	125.9 Å²	125.9	68%	0.681	68%	0.682	S	S	*	*			cis	-145.7	150.5	15.3	-90.9	143.7	0	0	0	113.1	I765	L763-I765 HydrophobicContact CB-CD1 4.41Å; L763-I765 HydrophobicContact CB-CG1 4.31Å; L763-I765 HydrophobicContact CD1-CD1 4.19Å; L763-I765 HydrophobicContact CD2-CD1 4.17Å; L763-I765 HydrophobicContact CD2-CG1 4.04Å; L763-I765 HydrophobicContact CG-CD1 4.47Å
764	T	31.3	Very low	28	Very low	136 Å²	136	125 Å²	125	83%	0.834	68%	0.675	S	S	*	*			trans	-98.8	137.6	146.4	37.1	0	0	0	0	109.4
765	I	29.4	Very low	28.2	Very low	137 Å²	137	126 Å²	126	70%	0.703	68%	0.677	S	S	*	*			trans	-150.4	140.9	178.9	-76	179.6	0	0	0	105.7	L763	L763-I765 HydrophobicContact CB-CD1 4.41Å; L763-I765 HydrophobicContact CB-CG1 4.31Å; L763-I765 HydrophobicContact CD1-CD1 4.19Å; L763-I765 HydrophobicContact CD2-CD1 4.17Å; L763-I765 HydrophobicContact CD2-CG1 4.04Å; L763-I765 HydrophobicContact CG-CD1 4.47Å
766	H	25.2	Very low	28.3	Very low	143 Å²	143	130.1 Å²	130.1	66%	0.662	68%	0.68	S	S	*	*			cis	-159.3	173.6	-26.5	-152.6	-95.3	0	0	0	107.5
767	E	24.8	Very low	28.3	Very low	150 Å²	150	131.8 Å²	131.8	70%	0.701	68%	0.679	S	S	*	*			trans	-50	141.6	176.7	-54.3	147.3	168.2	0	0	114.7
768	I	34.3	Very low	28.3	Very low	158 Å²	158	130.2 Å²	130.2	81%	0.81	67%	0.671	S	S	*	*			trans	-133.5	98	139.3	-64.5	-171.1	0	0	0	109.3
769	N	29.6	Very low	28.3	Very low	125 Å²	125	129.9 Å²	129.9	67%	0.668	67%	0.671	S	S	*	*			trans	55.5	106.6	138.8	-58.2	-19	0	0	0	122.4
770	H	26.8	Very low	28.1	Very low	176 Å²	176	129.7 Å²	129.7	82%	0.815	68%	0.678	S	S	*	*				60.7	165.8	113.8	-75.8	-80.2	0	0	0	121.7
771	L	30.9	Very low	27.9	Very low	167 Å²	167	133.6 Å²	133.6	87%	0.874	70%	0.7	S	S	*	*			trans	71.5	84.7	-174.4	-51.3	173.6	0	0	0	112
772	S	26.8	Very low	27.8	Very low	106 Å²	106	135.4 Å²	135.4	74%	0.741	71%	0.71	S	S	*	*			cis	70.1	105.3	41.7	-160.1	0	0	0	0	115
773	S	25.6	Very low	27.8	Very low	115 Å²	115	137.1 Å²	137.1	80%	0.804	72%	0.718	S	S	*	*			trans	65.1	176.5	158.6	-149.6	0	0	0	0	118.4
774	S	25.9	Very low	28	Very low	87 Å²	87	139 Å²	139	61%	0.608	73%	0.729	S	S	*	*			trans	62.6	111.9	169.7	38.6	0	0	0	0	118.9
775	D	28.7	Very low	27.8	Very low	129 Å²	129	139.1 Å²	139.1	69%	0.69	72%	0.719	S	S	*	*				105.1	119	115.8	-69.1	-13.5	0	0	0	124.4
776	W	28.2	Very low	27.8	Very low	201 Å²	201	138.9 Å²	138.9	76%	0.761	72%	0.719	S	S	*	*			trans	81.4	76.5	132	-60.2	19.4	0	0	0	119.9
777	W	25.7	Very low	28	Very low	196 Å²	196	139.5 Å²	139.5	74%	0.742	73%	0.726	S	S	*	*				-42.5	131.4	127.4	47.2	-11.3	0	0	0	113.6
778	I	25.3	Very low	28.2	Very low	79 Å²	79	137.9 Å²	137.9	41%	0.405	73%	0.729	S	S	.	*			trans	109.8	114.2	168.6	-57.7	155.2	0	0	0	115.8	R397	R397-I778 HydrophobicContact CG-CD1 3.83Å
779	Q	26.1	Very low	28	Very low	134 Å²	134	136.1 Å²	136.1	63%	0.626	73%	0.725	S	S	*	*			trans	59.4	160	162	-73.4	152.7	-127	0	0	116.1	E401	E401-Q779 PolarHBondContact OE1-NE2 2.99Å
780	S	24.5	Very low	27.9	Very low	93 Å²	93	136.2 Å²	136.2	65%	0.65	73%	0.731	S	S	*	*			cis	-153.4	157.3	31	-51.7	0	0	0	0	114.6
781	T	27.4	Very low	28.2	Very low	121 Å²	121	135.3 Å²	135.3	74%	0.742	73%	0.731	S	S	*	*			trans	34	127.2	140.9	58.8	0	0	0	0	122.8
782	N	29.1	Very low	28.1	Very low	143 Å²	143	132.9 Å²	132.9	77%	0.765	72%	0.723	S	S	*	*			trans	-2.9	121.1	131.6	-61.1	-29.2	0	0	0	117.8
783	L	29.7	Very low	28.2	Very low	153 Å²	153	133 Å²	133	80%	0.801	72%	0.724	S	S	*	*			trans	-175.2	138	142.7	-94.7	154.5	0	0	0	104	H785	L783-H785 HydrophobicContact CD2-CB 4.38Å
784	L	32.6	Very low	28.4	Very low	171 Å²	171	132.9 Å²	132.9	90%	0.895	72%	0.718	S	S	*	*			cis	-82.2	146.3	23.9	-75.1	64.5	0	0	0	115.5
785	H	28.5	Very low	28.8	Very low	137 Å²	137	136 Å²	136	63%	0.634	73%	0.727	S	S	*	*			trans	-125.2	122.7	163	-125.1	50.2	0	0	0	106.7	L783	L783-H785 HydrophobicContact CD2-CB 4.38Å
786	N	27.8	Very low	28.9	Very low	133 Å²	133	134.6 Å²	134.6	71%	0.711	73%	0.728	S	S	*	*			trans	64	170	162.3	-42.1	-30.1	0	0	0	113.7
787	I	29.1	Very low	29.3	Very low	155 Å²	155	130.8 Å²	130.8	80%	0.795	73%	0.728	S	S	*	*			cis	-147.5	159.5	13.1	-67.4	175.4	0	0	0	105.8
788	P	30.3	Very low	29.6	Very low	117 Å²	117	127 Å²	127	76%	0.76	73%	0.727	S	S	*	*			cis	-120.7	179.4	-2.9	25.8	-3.7	0	0	0	114.9
789	T	30.2	Very low	29.8	Very low	120 Å²	120	128.7 Å²	128.7	74%	0.736	74%	0.742	S	S	*	*			trans	-89.8	-177.6	163.6	46.6	0	0	0	0	112.3
790	T	28	Very low	30	Very low	128 Å²	128	129.4 Å²	129.4	79%	0.785	75%	0.749	S	S	*	*			trans	78.1	145.6	178.2	81.4	0	0	0	0	114.3
791	L	32.5	Very low	30.1	Very low	157 Å²	157	129.2 Å²	129.2	82%	0.822	75%	0.748	S	S	*	*			cis	-124.3	167.2	10.4	-86.6	171.8	0	0	0	114.8
792	T	28.6	Very low	30.1	Very low	116 Å²	116	131.6 Å²	131.6	71%	0.712	75%	0.752	S	S	*	*			trans	-54.5	162.1	-178	45.5	0	0	0	0	119.7
793	S	28.2	Very low	30.1	Very low	109 Å²	109	129.3 Å²	129.3	76%	0.762	74%	0.74	S	S	*	*			trans	75.7	155.8	157.8	74.8	0	0	0	0	116.3
794	V	30.5	Very low	30	Very low	112 Å²	112	125.3 Å²	125.3	68%	0.679	72%	0.722	S	S	*	*			cis	-149.2	135.2	25.7	175.2	0	0	0	0	111.3
795	L	33.8	Very low	29.9	Very low	152 Å²	152	122.4 Å²	122.4	80%	0.796	71%	0.707	S	S	*	*			trans	55.8	143.5	162.9	-60.7	167.5	0	0	0	118.3
796	S	30.5	Very low	29.9	Very low	100 Å²	100	119.7 Å²	119.7	70%	0.699	70%	0.695	S	S	*	*			cis	70.7	149.1	32.6	-52.7	0	0	0	0	115.1
797	P	36.6	Very low	30.1	Very low	120 Å²	120	117.8 Å²	117.8	78%	0.779	69%	0.69	S	S	*	*			cis	-106.8	-177.6	-6.5	9.8	15.8	0	0	0	112.3
798	T	33.5	Very low	30	Very low	117 Å²	117	116.1 Å²	116.1	72%	0.718	68%	0.681	S	S	*	*			cis	95.3	146.9	23	-38.6	0	0	0	0	116.3
799	T	29.1	Very low	29.9	Very low	115 Å²	115	117.6 Å²	117.6	71%	0.706	68%	0.678	S	S	*	*			trans	76.6	150	177.7	75.5	0	0	0	0	115.9
800	L	29.5	Very low	29.9	Very low	148 Å²	148	118.5 Å²	118.5	78%	0.775	68%	0.678	S	S	*	*			cis	-125.3	159.8	-11.3	-66.3	82.6	0	0	0	108.9
801	S	26.8	Very low	30	Very low	90 Å²	90	116.7 Å²	116.7	63%	0.629	67%	0.671	S	S	*	*			cis	84.6	82.7	1.3	84.1	0	0	0	0	120.9
802	M	28.1	Very low	29.9	Very low	170 Å²	170	116.3 Å²	116.3	84%	0.837	67%	0.669	S	S	*	*			trans	-161.8	164.4	152.4	-90.8	-55.8	112.5	0	0	112.4
803	N	27.8	Very low	29.9	Very low	96 Å²	96	116 Å²	116	51%	0.513	67%	0.667	S	S	.	*				-166.3	146.8	-72.2	-173.8	19.5	0	0	0	110.7
804	V	27.9	Very low	29.9	Very low	69 Å²	69	117 Å²	117	42%	0.418	67%	0.669	S	S	.	*			trans	50.2	-175.9	171.6	-78.3	0	0	0	0	115.9	P92 F93	P92-V804 HydrophobicContact CB-CG1 4.14Å; F93-V804 HydrophobicContact CE1-CG1 4.15Å; F93-V804 HydrophobicContact CE2-CG1 4.39Å; F93-V804 HydrophobicContact CZ-CG1 3.96Å
805	N	30.2	Very low	29.7	Very low	110 Å²	110	119.2 Å²	119.2	59%	0.588	67%	0.673	S	S	*	*			cis	-146.6	144.1	0.5	-146.1	-6.6	0	0	0	111.9	P92	P92-N805 WeakPolarHBondContact CG-OD1 3.27Å
806	H	29.4	Very low	29.4	Very low	80 Å²	80	119.1 Å²	119.1	37%	0.37	67%	0.674	S	S	.	*			trans	-167	115.3	-145.7	135	66.6	0	0	0	111.1	H90 N91	H90-H806 CarbonylContact C-O 3.52Å; H90-H806 WeakPolarHBondContact CA-ND1 3.04Å; H90-H806 HydrophobicContact CB-CB 3.69Å; H90-H806 WeakPolarHBondContact CB-ND1 3.24Å; H90-H806 VanDerWaalsContact CD2-C 3.45Å; H90-H806 WeakPolarHBondContact CD2-CA 3.41Å; H90-H806 AromaticContact CG-CG 3.3Å; H90-H806 AromaticContact CG-ND1 3Å; H90-H806 WeakPolarHBondContact ND1-CB 3.48Å; H90-H806 AromaticContact ND1-CE1 3.86Å; H90-H806 AromaticContact ND1-CG 3.15Å; H90-H806 AromaticContact ND1-ND1 2.77Å; H90-H806 PolarHBondContact ND1-ND1 3.22Å; N91-H806 CarbonylContact C-O 2.98Å; N91-H806 WeakPolarHBondContact CA-O 3.29Å; N91-H806 HydrophobicContact CB-CB 3.49Å; N91-H806 VanDerWaalsContact CB-CB 3.49Å; N91-H806 VanDerWaalsContact CB-CD2 3.46Å; N91-H806 WeakPolarHBondContact CB-CD2 3.34Å; N91-H806 WeakPolarHBondContact CB-O 3.29Å; N91-H806 VanDerWaalsContact N-CG 3.28Å; N91-H806 PolarHBondContact N-ND1 2.77Å; N91-H806 PolarHBondContact N-O 3.06Å; N91-H806 PolarHBondContact ND2-CD2 3.23Å
807	P	30.6	Very low	29.4	Very low	93 Å²	93	120.1 Å²	120.1	60%	0.604	68%	0.681	S	S	*	*			trans	-135.4	144.2	168.2	15.1	9.7	0	0	0	120.2	L89 H90	L89-P807 WeakPolarHBondContact CB-O 3.42Å; H90-P807 VanDerWaalsContact CB-CA 3.48Å; H90-P807 WeakPolarHBondContact CD2-CD 3.26Å; H90-P807 VanDerWaalsContact O-CA 3.23Å; H90-P807 WeakPolarHBondContact O-CA 3.01Å
808	I	26.9	Very low	29	Very low	119 Å²	119	121.8 Å²	121.8	61%	0.61	68%	0.682	S	S	*	*			trans	-72.7	145	-159.9	-48.2	164.1	0	0	0	122.1	L89	L89-I808 VanDerWaalsContact C-CA 3.47Å; L89-I808 WeakPolarHBondContact O-CG1 3.36Å
809	E	29.8	Very low	28.7	Very low	149 Å²	149	121.8 Å²	121.8	70%	0.696	68%	0.677	S	S	*	*			trans	-162.8	136.1	142.6	-133.9	167.9	-137	0	0	120.6	K87 T88	K87-E809 CarbonylContact C-O 3.2Å; K87-E809 VanDerWaalsContact C-O 3.26Å; T88-E809 PolarHBondContact O-N 2.77Å
810	N	30.5	Very low	28.5	Very low	139 Å²	139	122.8 Å²	122.8	74%	0.743	69%	0.687	S	S	*	*			trans	-80.7	153.8	-160.7	-51.9	-92.3	0	0	0	121.7
811	S	30.3	Very low	28.4	Very low	90 Å²	90	120.5 Å²	120.5	63%	0.629	68%	0.675	S	S	*	*				170.5	171.5	129.6	48.5	0	0	0	0	112.2
812	L	28.9	Very low	28.5	Very low	148 Å²	148	124.8 Å²	124.8	78%	0.775	69%	0.685	S	S	*	*				-152	155.6	-52.5	-172.6	69.9	0	0	0	109.2
813	T	28.6	Very low	28.4	Very low	111 Å²	111	126.6 Å²	126.6	68%	0.681	68%	0.684	S	S	*	*			trans	61.2	100.6	160.7	31.9	0	0	0	0	121.9
814	T	28.3	Very low	28.4	Very low	130 Å²	130	127.9 Å²	127.9	80%	0.798	69%	0.691	S	S	*	*				47.9	113.5	125.4	57.1	0	0	0	0	122.4
815	M	26.7	Very low	28.5	Very low	157 Å²	157	130 Å²	130	77%	0.773	70%	0.704	S	S	*	*			trans	-157.9	166.1	130.7	-107.7	-71.3	-126.2	0	0	109.8
816	N	27.3	Very low	28.6	Very low	151 Å²	151	129 Å²	129	81%	0.807	71%	0.706	S	S	*	*			trans	-100.7	174.7	-167.9	-72.9	-57.5	0	0	0	114.6
817	S	30.8	Very low	28.7	Very low	121 Å²	121	130.8 Å²	130.8	85%	0.846	72%	0.717	S	S	*	*			trans	77.5	84.2	165.6	-56.7	0	0	0	0	116.5
818	I	27.6	Very low	28.6	Very low	155 Å²	155	129.4 Å²	129.4	80%	0.795	72%	0.72	S	S	*	*			trans	-85.8	119.3	161.9	-76.9	175.3	0	0	0	109.4
819	D	27.5	Very low	28.9	Very low	117 Å²	117	129.2 Å²	129.2	63%	0.626	71%	0.713	S	S	*	*			trans	45.5	112.3	143.5	-46.8	-21.8	0	0	0	120.9	I821	D819-I821 HydrophobicContact CB-CD1 4.11Å; D819-I821 HydrophobicContact CB-CG1 3.68Å
820	C	25.3	Very low	28.7	Very low	136 Å²	136	128.1 Å²	128.1	92%	0.919	71%	0.71	S	S	*	*			trans	-66.7	122	136.7	-57.7	0	0	0	0	108.6
821	I	27.9	Very low	28.7	Very low	100 Å²	100	128.8 Å²	128.8	51%	0.513	71%	0.709	S	S	.	*			trans	-126.2	102.3	161.2	-41.3	-176.6	0	0	0	111.3	D819 Y823	D819-I821 HydrophobicContact CB-CD1 4.11Å; D819-I821 HydrophobicContact CB-CG1 3.68Å; I821-Y823 HydrophobicContact CB-CD2 4.27Å; I821-Y823 HydrophobicContact CB-CE2 4.34Å; I821-Y823 HydrophobicContact CD1-CE2 4.1Å; I821-Y823 HydrophobicContact CG2-CD1 4.16Å; I821-Y823 HydrophobicContact CG2-CD2 3.45Å; I821-Y823 VanDerWaalsContact CG2-CD2 3.45Å; I821-Y823 HydrophobicContact CG2-CE1 4.2Å; I821-Y823 HydrophobicContact CG2-CE2 3.53Å; I821-Y823 HydrophobicContact CG2-CG 3.78Å; I821-Y823 PolarHBondContact O-N 3.21Å
822	Q	27.6	Very low	28.6	Very low	180 Å²	180	132.3 Å²	132.3	84%	0.841	72%	0.715	S	S	*	*			trans	-74.3	99.2	154.5	172.9	-177.7	-17.5	0	0	107.2	D824	Q822-D824 PolarHBondContact O-N 2.75Å
823	Y	26.7	Very low	28.6	Very low	208 Å²	208	134.8 Å²	134.8	82%	0.816	72%	0.72	S	S	*	*			trans	-88.4	99.1	170.1	-95.1	-55.9	0	0	0	109.9	I821	I821-Y823 HydrophobicContact CB-CD2 4.27Å; I821-Y823 HydrophobicContact CB-CE2 4.34Å; I821-Y823 HydrophobicContact CD1-CE2 4.1Å; I821-Y823 HydrophobicContact CG2-CD1 4.16Å; I821-Y823 HydrophobicContact CG2-CD2 3.45Å; I821-Y823 VanDerWaalsContact CG2-CD2 3.45Å; I821-Y823 HydrophobicContact CG2-CE1 4.2Å; I821-Y823 HydrophobicContact CG2-CE2 3.53Å; I821-Y823 HydrophobicContact CG2-CG 3.78Å; I821-Y823 PolarHBondContact O-N 3.21Å
824	D	27.3	Very low	28.6	Very low	123 Å²	123	132.4 Å²	132.4	66%	0.658	72%	0.717	S	S	*	*			trans	-120	122.4	162.7	-149	-26.5	0	0	0	109.9	Q822	Q822-D824 PolarHBondContact O-N 2.75Å
825	T	31.1	Very low	28.6	Very low	112 Å²	112	132.8 Å²	132.8	69%	0.687	71%	0.714	S	S	*	*			trans	44.9	80.3	151.6	-52.4	0	0	0	0	119.8
826	S	31	Very low	28.7	Very low	91 Å²	91	130.8 Å²	130.8	64%	0.636	71%	0.707	S	S	*	*				80.8	154.8	122.8	82.4	0	0	0	0	122.6
827	L	32.9	Very low	28.7	Very low	116 Å²	116	130.7 Å²	130.7	61%	0.607	71%	0.706	S	S	*	*			trans	64.8	118.8	157.4	-71.3	153.8	0	0	0	118.8	P184	P184-L827 HydrophobicContact CG-CB 3.82Å; P184-L827 HydrophobicContact CG-CD1 3.95Å; P184-L827 HydrophobicContact CG-CD2 4.46Å; P184-L827 HydrophobicContact CG-CG 4.28Å
828	G	28.2	Very low	28.6	Very low	65 Å²	65	129 Å²	129	67%	0.67	70%	0.7	S	S	*	*			trans	-128.5	154	161.7	0	0	0	0	0	111.4
829	Y	31.8	Very low	28.6	Very low	115 Å²	115	126.3 Å²	126.3	45%	0.451	69%	0.694	S	S	.	*			trans	-140.3	135.3	164.5	-98.3	-96.1	0	0	0	104.4	I183 F185	I183-Y829 HydrophobicContact CD1-CE2 3.96Å; I183-Y829 VanDerWaalsContact CD1-OH 3.31Å; I183-Y829 WeakPolarHBondContact CD1-OH 3.44Å; I183-Y829 HydrophobicContact CG1-CE2 4.07Å; I183-Y829 HydrophobicContact CG2-CD2 4.14Å; I183-Y829 HydrophobicContact CG2-CE2 3.83Å; F185-Y829 VanDerWaalsContact CE2-CB 3.45Å; F185-Y829 HydrophobicContact CE2-CG 4.38Å; F185-Y829 WeakPolarHBondContact CZ-O 3.36Å
830	I	26.9	Very low	28.7	Very low	126 Å²	126	126.6 Å²	126.6	65%	0.646	70%	0.701	S	S	*	*				61.3	109.9	55.8	-58.4	175.2	0	0	0	108.9
831	H	29.8	Very low	29	Very low	153 Å²	153	127.3 Å²	127.3	71%	0.708	69%	0.69	S	S	*	*			cis	-161.9	163.9	20.6	-145.7	-167.6	0	0	0	112.1
832	Q	29.2	Very low	29	Very low	163 Å²	163	130.8 Å²	130.8	76%	0.762	70%	0.702	S	S	*	*			trans	65.7	159.4	157.5	-66.2	176	15.8	0	0	118.7
833	K	28.7	Very low	29.1	Very low	201 Å²	201	128.3 Å²	128.3	87%	0.874	70%	0.695	S	S	*	*			cis	-172.2	129.9	-32.3	176	-179.2	179.6	-173.9	0	107.8
834	G	29	Very low	29.4	Very low	61 Å²	61	123.3 Å²	123.3	63%	0.629	69%	0.69	S	S	*	*			trans	129	117.6	162	0	0	0	0	0	115.1
835	N	26.7	Very low	29.6	Very low	137 Å²	137	121.4 Å²	121.4	73%	0.733	69%	0.691	S	S	*	*			trans	49.9	125	138.5	-73.8	57.9	0	0	0	122.4
836	D	29.4	Very low	29.5	Very low	115 Å²	115	123 Å²	123	62%	0.615	69%	0.694	S	S	*	*				74.9	94.9	126.5	-52.7	-14.6	0	0	0	120.2
837	N	27.7	Very low	29.6	Very low	150 Å²	150	123.7 Å²	123.7	80%	0.802	70%	0.695	S	S	*	*				71.8	131.5	118.8	-59.9	-37.1	0	0	0	121.1
838	A	28.7	Very low	29.6	Very low	85 Å²	85	122 Å²	122	70%	0.702	69%	0.689	S	S	*	*			trans	91.8	115.5	140	0	0	0	0	0	120
839	S	28.4	Very low	29.9	Very low	98 Å²	98	122.8 Å²	122.8	69%	0.685	68%	0.678	S	S	*	*			trans	74.4	137.7	133.1	48.6	0	0	0	0	122
840	T	28.7	Very low	29.9	Very low	124 Å²	124	123.4 Å²	123.4	76%	0.761	68%	0.684	S	S	*	*			trans	69.1	160.6	145	51.9	0	0	0	0	120.3
841	E	31	Very low	30.1	Very low	150 Å²	150	119.8 Å²	119.8	70%	0.701	67%	0.669	S	S	*	*			cis	179.2	162.4	-39.2	-149.3	172.5	-167.6	0	0	108
842	F	28.2	Very low	30.4	Very low	174 Å²	174	117 Å²	117	76%	0.763	66%	0.657	S	S	*	*			trans	61.1	157.9	170.8	-74.5	-98.1	0	0	0	118
843	D	31	Very low	30.6	Very low	128 Å²	128	115.6 Å²	115.6	68%	0.684	65%	0.654	S	S	*	*			cis	-173.3	171.1	-31.3	-164.3	11.7	0	0	0	112
844	S	32	Very low	30.6	Very low	103 Å²	103	112.7 Å²	112.7	72%	0.72	65%	0.647	S	S	*	*			trans	70.3	156.7	152.6	75.7	0	0	0	0	120.8
845	A	32.1	Very low	30.7	Very low	82 Å²	82	113.9 Å²	113.9	68%	0.678	65%	0.646	S	S	*	*			cis	-172.9	-161.3	-22.3	0	0	0	0	0	112
846	I	29.3	Very low	30.9	Very low	146 Å²	146	115.2 Å²	115.2	75%	0.749	65%	0.652	S	S	*	*			trans	105.4	169.2	160.4	-65.9	171.3	0	0	0	120	K194	K194-I846 PolarHBondContact NZ-O 2.88Å
847	T	31.8	Very low	31	Very low	106 Å²	106	117 Å²	117	65%	0.65	66%	0.656	S	S	*	*			trans	-118.2	174.6	-143	46.6	0	0	0	0	117	K194	K194-T847 VanDerWaalsContact NZ-CA 3.25Å
848	T	33.7	Very low	31.1	Very low	80 Å²	80	117.4 Å²	117.4	49%	0.491	66%	0.658	S	S	.	*			cis	177.8	132.5	-39.5	-82.9	0	0	0	0	112.7	K194 D195	K194-T848 PolarHBondContact NZ-OG1 3.02Å; D195-T848 VanDerWaalsContact OD2-C 3.23Å; D195-T848 WeakPolarHBondContact OD2-CA 2.91Å; D195-T848 PolarHBondContact OD2-N 2.7Å
849	D	33.5	Very low	31.1	Very low	82 Å²	82	123.4 Å²	123.4	44%	0.439	66%	0.664	S	S	.	*			trans	71.6	159.5	164.1	-90	-78.7	0	0	0	119.8	D195 I196	D195-D849 PolarHBondContact OD2-N 3.46Å; D195-D849 VanDerWaalsContact OD2-N 3.08Å; I196-D849 CarbonylContact O-C 2.7Å
850	F	31.6	Very low	31.2	Very low	128 Å²	128	128 Å²	128	56%	0.561	67%	0.668	S	S	*	*			cis	-150.3	157.3	24.8	-55.9	-101.7	0	0	0	116.8	I196 I197	I196-F850 CarbonylContact C-O 3.53Å; I196-F850 VanDerWaalsContact C-O 3.29Å; I196-F850 VanDerWaalsContact CB-O 3.29Å; I196-F850 WeakPolarHBondContact CB-O 3.39Å; I196-F850 PolarHBondContact O-N 2.79Å; I197-F850 VanDerWaalsContact CA-O 3.23Å; I197-F850 WeakPolarHBondContact CA-O 3.13Å; I197-F850 HydrophobicContact CD1-CD2 4.33Å; I197-F850 HydrophobicContact CG1-CB 4.36Å; I197-F850 PolarHBondContact N-O 3.04Å
851	S	32.8	Very low	31.4	Very low	49 Å²	49	130.6 Å²	130.6	34%	0.343	67%	0.671	S	S	.	*			trans	65.3	159.1	148.1	67	0	0	0	0	123.4	E198	E198-S851 VanDerWaalsContact CG-OG 3.27Å; E198-S851 WeakPolarHBondContact CG-OG 3.47Å; E198-S851 WeakPolarHBondContact OE1-CB 3.27Å; E198-S851 PolarHBondContact OE1-OG 2.81Å
852	Q	34.8	Very low	31.1	Very low	96 Å²	96	128.8 Å²	128.8	45%	0.449	68%	0.675	S	S	.	*			cis	-150.1	134.2	12.9	-151.4	-171.2	86.6	0	0	116.5	E198	E198-Q852 HydrophobicContact CG-CB 3.75Å; E198-Q852 HydrophobicContact CG-CG 4.22Å; E198-Q852 PolarHBondContact OE1-NE2 3.46Å; E198-Q852 PolarHBondContact OE2-NE2 2.87Å
853	L	33.1	Very low	31.5	Very low	133 Å²	133	125.9 Å²	125.9	70%	0.696	67%	0.674	S	S	*	*			trans	44.3	125.6	148.6	-65.8	170.5	0	0	0	126.4
854	N	29	Very low	31.3	Very low	139 Å²	139	127.7 Å²	127.7	74%	0.743	68%	0.682	S	S	*	*				26.8	152.2	112.5	-61.7	14.9	0	0	0	121.2
855	S	32.1	Very low	31	Very low	86 Å²	86	130 Å²	130	60%	0.601	69%	0.685	S	S	*	*			cis	-167.8	157.8	-1	-107.7	0	0	0	0	110.6
856	I	30.8	Very low	31.1	Very low	166 Å²	166	135.3 Å²	135.3	85%	0.851	69%	0.693	S	S	*	*				178.4	133.5	128	-95.8	163.4	0	0	0	109.7
857	E	30.8	Very low	31	Very low	153 Å²	153	135.4 Å²	135.4	72%	0.715	70%	0.695	S	S	*	*			trans	-98.8	158.9	175.7	-63.2	120	112.9	0	0	112.3
858	D	29.8	Very low	30.9	Very low	157 Å²	157	135 Å²	135	84%	0.84	70%	0.696	S	S	*	*			trans	172.1	46.9	132.8	-95.5	-17.7	0	0	0	114.5
859	Y	28.2	Very low	30.8	Very low	211 Å²	211	138.6 Å²	138.6	83%	0.827	71%	0.712	S	S	*	*			trans	-150.1	121	168.4	-110.6	-87.3	0	0	0	114.8
860	Y	30.2	Very low	30.6	Very low	196 Å²	196	140.6 Å²	140.6	77%	0.769	73%	0.727	S	S	*	*			trans	62.8	153.7	149	-90.2	-124.2	0	0	0	123.1
861	E	32.9	Very low	30.5	Very low	177 Å²	177	140.1 Å²	140.1	83%	0.827	73%	0.731	S	S	*	*			trans	66.8	-178.5	152.7	-78.7	-177	169.6	0	0	121.6
862	S	26.5	Very low	30.2	Very low	112 Å²	112	145.3 Å²	145.3	78%	0.783	75%	0.75	S	S	*	*			trans	-162.7	169.7	-164.4	-49.6	0	0	0	0	108.3
863	P	35.2	Very low	30.1	Very low	114 Å²	114	143.4 Å²	143.4	74%	0.74	75%	0.75	S	S	*	*			cis	-122.6	-166.8	-18	36.4	-18.6	0	0	0	111
864	I	27.3	Very low	29.9	Very low	165 Å²	165	143 Å²	143	85%	0.846	75%	0.748	S	S	*	*			trans	159.9	152.5	137.3	-81.8	157	0	0	0	113
865	L	26.5	Very low	30.1	Very low	151 Å²	151	140 Å²	140	79%	0.791	74%	0.735	S	S	*	*			trans	-68.5	147	-170.9	-60.8	149.2	0	0	0	117.7
866	K	33.6	Very low	30	Very low	194 Å²	194	139.4 Å²	139.4	84%	0.843	73%	0.725	S	S	*	*				167.4	128.1	123.1	-86.7	153.9	-174	178.6	0	109.3
867	N	27.4	Very low	30	Very low	149 Å²	149	140.2 Å²	140.2	80%	0.797	72%	0.723	S	S	*	*				52.1	128.7	77.6	-71.2	19.7	0	0	0	112.9
868	S	30.3	Very low	29.9	Very low	96 Å²	96	139.9 Å²	139.9	67%	0.671	72%	0.721	S	S	*	*			cis	-150.8	144.9	42.1	-65.5	0	0	0	0	113.2
869	L	30.6	Very low	30	Very low	157 Å²	157	143.5 Å²	143.5	82%	0.822	73%	0.725	S	S	*	*				61.2	134.2	107.3	-57.7	167	0	0	0	115.9
870	T	28.8	Very low	30	Very low	124 Å²	124	139 Å²	139	76%	0.761	72%	0.715	S	S	*	*			cis	-128.9	-162.8	18.9	55.2	0	0	0	0	111.5
871	N	28.9	Very low	30	Very low	117 Å²	117	138 Å²	138	63%	0.626	72%	0.723	S	S	*	*			cis	-153	-166.4	-0.6	-147.9	34.8	0	0	0	114.1
872	E	28.2	Very low	29.9	Very low	159 Å²	159	135.1 Å²	135.1	74%	0.743	71%	0.713	S	S	*	*			trans	-39	153.9	164.2	-68.2	157.6	-122.3	0	0	117.7
873	A	32.1	Very low	30.3	Very low	56 Å²	56	140.4 Å²	140.4	46%	0.463	72%	0.718	S	S	.	*			cis	-167.9	151.9	-8.1	0	0	0	0	0	115.8	T67 T68	T67-A873 CarbonylContact C-O 3.39Å; T67-A873 VanDerWaalsContact C-O 3.25Å; T67-A873 PolarHBondContact O-N 3.47Å; T68-A873 PolarHBondContact N-O 2.89Å; T68-A873 CarbonylContact O-C 3.33Å; T68-A873 WeakPolarHBondContact O-CA 3.03Å
874	N	27.7	Very low	30.1	Very low	123 Å²	123	141.2 Å²	141.2	66%	0.658	72%	0.716	S	S	*	*			trans	36.2	100.9	163.4	-72.8	-31.3	0	0	0	123.2	T68 T69	T68-N874 VanDerWaalsContact C-N 3.35Å; T68-N874 PolarHBondContact O-N 3.25Å; T69-N874 HydrophobicContact CG2-CB 4.48Å
875	V	34.6	Very low	30.5	Very low	76 Å²	76	142.7 Å²	142.7	46%	0.461	72%	0.716	S	S	.	*			trans	-151.2	95	146.7	-174.2	0	0	0	0	111.9	T69 F877	T69-V875 WeakPolarHBondContact OG1-CA 3.5Å; T69-V875 PolarHBondContact OG1-N 3.32Å; T69-V875 PolarHBondContact OG1-O 3.17Å; V875-F877 HydrophobicContact CG1-CD2 4.4Å; V875-F877 HydrophobicContact CG1-CE2 4.08Å; V875-F877 PolarHBondContact O-N 2.94Å
876	N	29.1	Very low	30.9	Very low	74 Å²	74	141.1 Å²	141.1	40%	0.396	71%	0.708	S	S	.	*			trans	-59.9	132.7	-177.8	-104.3	-65.1	0	0	0	113.2	T69 N71	T69-N876 HydrophobicContact CG2-CB 4.43Å; T69-N876 PolarHBondContact OG1-N 2.86Å; N71-N876 PolarHBondContact ND2-OD1 3.35Å; N71-N876 PolarHBondContact OD1-ND2 3.37Å
877	F	31.6	Very low	30.7	Very low	183 Å²	183	141.5 Å²	141.5	80%	0.803	71%	0.706	S	S	*	*			trans	-122.8	109.9	159.1	-90.9	-82	0	0	0	111.8	V875	V875-F877 HydrophobicContact CG1-CD2 4.4Å; V875-F877 HydrophobicContact CG1-CE2 4.08Å; V875-F877 PolarHBondContact O-N 2.94Å
878	H	28.2	Very low	30.8	Very low	147 Å²	147	142.5 Å²	142.5	68%	0.681	70%	0.7	S	S	*	*			trans	-88.6	128.3	172	-129.2	50.6	0	0	0	108.3
879	Y	31.5	Very low	30.8	Very low	232 Å²	232	146.8 Å²	146.8	91%	0.91	70%	0.703	S	S	*	*			trans	-115.9	130.3	157.3	-115.6	-91.1	0	0	0	108.4
880	N	29.3	Very low	30.9	Very low	118 Å²	118	145.8 Å²	145.8	63%	0.631	70%	0.698	S	S	*	*			trans	-108.9	103.9	-155.7	-170.3	4.7	0	0	0	110.4	N882	N880-N882 VanDerWaalsContact C-N 3.29Å; N880-N882 PolarHBondContact O-N 3.35Å
881	D	29.7	Very low	31.1	Very low	174 Å²	174	147.6 Å²	147.6	93%	0.93	70%	0.703	S	S	*	*			trans	-71.1	82.4	176.8	-103.8	-29.2	0	0	0	110.4
882	N	30.9	Very low	31.4	Very low	116 Å²	116	145.6 Å²	145.6	62%	0.62	71%	0.71	S	S	*	*			trans	-151.5	77.3	-176.7	-150.1	-10	0	0	0	113.3	N880	N880-N882 VanDerWaalsContact C-N 3.29Å; N880-N882 PolarHBondContact O-N 3.35Å
883	Y	34	Very low	31.7	Very low	224 Å²	224	145 Å²	145	88%	0.878	71%	0.711	S	S	*	*			trans	-147.3	104.4	152.2	-109.9	-66.9	0	0	0	112.4
884	N	31.1	Very low	31.7	Very low	131 Å²	131	150.9 Å²	150.9	70%	0.701	72%	0.723	S	S	*	*			trans	-96.4	128.6	170.3	-179	13.5	0	0	0	108.9
885	K	36.2	Very low	32	Very low	195 Å²	195	153.1 Å²	153.1	85%	0.848	73%	0.727	S	S	*	*			trans	-150.4	136.5	163.4	-123.5	170	-173.7	176.5	0	113.1
886	N	34.5	Very low	31.9	Very low	118 Å²	118	152.8 Å²	152.8	63%	0.631	74%	0.739	S	S	*	*			trans	-103.5	147.3	-177	-93.9	-33.2	0	0	0	109.9
887	Y	29.6	Very low	32.5	Very low	202 Å²	202	154.3 Å²	154.3	79%	0.792	75%	0.753	S	S	*	*			trans	53.6	157.7	141.7	-71.7	-115.4	0	0	0	118.6
888	Y	30.1	Very low	32.6	Very low	171 Å²	171	152.8 Å²	152.8	67%	0.671	76%	0.759	S	S	*	*			cis	-173	160.3	-27.6	-148.4	-71.8	0	0	0	104.4
889	Y	29.8	Very low	32.8	Very low	186 Å²	186	152.7 Å²	152.7	73%	0.729	76%	0.762	S	S	*	*			trans	64	101.9	169.4	-77.2	-68.1	0	0	0	119.5
890	D	32.2	Very low	32.8	Very low	135 Å²	135	148.7 Å²	148.7	72%	0.722	76%	0.756	S	S	*	*				44.7	119.9	102.4	-152.7	5.9	0	0	0	119.6
891	N	34.2	Very low	32.8	Very low	163 Å²	163	151.4 Å²	151.4	87%	0.872	76%	0.763	S	S	*	*			trans	173.9	143.3	142.8	-95.7	-51.2	0	0	0	112.7
892	G	33.9	Very low	32.9	Very low	74 Å²	74	154 Å²	154	76%	0.763	76%	0.759	S	S	*	*			trans	94.4	101.5	139.9	0	0	0	0	0	119.7
893	D	35.3	Very low	33	Very low	146 Å²	146	155.7 Å²	155.7	78%	0.781	77%	0.768	S	S	*	*			trans	-55	160.8	170.3	-45.3	-77.6	0	0	0	116.3
894	Y	32.4	Very low	33	Very low	180 Å²	180	151.7 Å²	151.7	71%	0.706	77%	0.768	S	S	*	*				-171.7	124.1	105.6	-118	-110.7	0	0	0	114.6
895	F	34.1	Very low	33.1	Very low	171 Å²	171	150.6 Å²	150.6	75%	0.75	77%	0.77	S	S	*	*			trans	36.2	145	144.8	-65.9	-114.5	0	0	0	121.4
896	G	33	Very low	33.3	Very low	68 Å²	68	145.3 Å²	145.3	70%	0.701	76%	0.756	S	S	*	*			cis	128.7	174	12	0	0	0	0	0	110.7
897	P	40.4	Very low	33.3	Very low	107 Å²	107	149.9 Å²	149.9	70%	0.695	77%	0.766	S	S	*	*			cis	-137.7	171.9	-13	42.9	-26.6	0	0	0	115.5
898	T	34.9	Very low	33.3	Very low	151 Å²	151	148.8 Å²	148.8	93%	0.926	77%	0.772	S	S	*	*			trans	-165.6	159.5	140.7	7	0	0	0	0	109.8
899	I	31.5	Very low	33.4	Very low	145 Å²	145	146.8 Å²	146.8	74%	0.744	78%	0.782	S	S	*	*			trans	-140.4	135.6	-148.2	-67.9	164.5	0	0	0	113.5
900	D	31.3	Very low	33.6	Very low	148 Å²	148	148 Å²	148	79%	0.791	79%	0.785	S	S	*	*				-163.2	164.1	122	-138.8	-31.2	0	0	0	113.6
901	F	30	Very low	33.7	Very low	174 Å²	174	148.5 Å²	148.5	76%	0.763	79%	0.787	S	S	*	*			trans	-147.3	145.8	-162.9	-106	-85.7	0	0	0	115.3
902	R	32.4	Very low	33.5	Very low	229 Å²	229	146.6 Å²	146.6	86%	0.864	78%	0.776	S	S	*	*			trans	171.1	142.2	151.1	-90.4	143.1	-156.1	-144.6	6.3	108.5
903	N	32.6	Very low	33.3	Very low	151 Å²	151	153.1 Å²	153.1	81%	0.807	78%	0.778	S	S	*	*			cis	-142.9	171.4	8.5	-84.5	-44.3	0	0	0	110.9
904	T	33.9	Very low	33.1	Very low	141 Å²	141	149.5 Å²	149.5	87%	0.865	76%	0.764	S	S	*	*			trans	-152.1	-179.4	178.4	-25.3	0	0	0	0	111.4
905	S	33.8	Very low	33.1	Very low	107 Å²	107	149.3 Å²	149.3	75%	0.748	77%	0.77	S	S	*	*			trans	109.9	152.5	165.4	-163.4	0	0	0	0	115.8
906	P	39.1	Very low	32.8	Very low	85 Å²	85	145.1 Å²	145.1	55%	0.552	77%	0.767	S	S	*	*			cis	-123.9	-176.1	-26.8	22	2.8	0	0	0	111.2
907	Y	34	Very low	32.7	Very low	214 Å²	214	152 Å²	152	84%	0.839	77%	0.774	S	S	*	*			cis	-149.5	140.6	32	-74.3	-89.7	0	0	0	113.8
908	L	31.2	Very low	32.2	Very low	178 Å²	178	153 Å²	153	93%	0.932	77%	0.773	S	S	*	*			trans	-133.9	158.5	155.7	-84.5	173.5	0	0	0	108.5
909	C	30.9	Very low	32.3	Very low	130 Å²	130	150.7 Å²	150.7	88%	0.878	76%	0.761	S	S	*	*			trans	-94.1	151.7	176.1	-155	0	0	0	0	112.4
910	R	34	Very low	32.3	Very low	210 Å²	210	150.3 Å²	150.3	79%	0.792	77%	0.765	S	S	*	*			trans	-65.8	168.1	-175.7	-70.3	173.9	173.8	162.1	-3.2	111.4
911	I	34.3	Very low	32.2	Very low	147 Å²	147	148.4 Å²	148.4	75%	0.754	76%	0.759	S	S	*	*				-153.1	122.2	54.7	-74.9	172.9	0	0	0	111.6
912	N	30.2	Very low	32.2	Very low	122 Å²	122	147.1 Å²	147.1	65%	0.652	76%	0.76	S	S	*	*				34.8	143	126.4	-55	-27.7	0	0	0	119.2
913	R	29.5	Very low	32.1	Very low	211 Å²	211	142.9 Å²	142.9	80%	0.796	76%	0.755	S	S	*	*			cis	-172.9	177.9	12.4	-114.5	-175.4	138.2	-171.7	-4.3	106.8
914	S	30.8	Very low	32.1	Very low	71 Å²	71	144 Å²	144	50%	0.497	76%	0.759	S	S	.	*			cis	174	159.5	-39.6	61.7	0	0	0	0	110.1
915	Q	32.6	Very low	31.8	Very low	175 Å²	175	144.7 Å²	144.7	82%	0.818	76%	0.758	S	S	*	*			trans	74.1	146.1	167.9	-59.2	170.8	-19.6	0	0	115.5
916	A	29.4	Very low	31.8	Very low	84 Å²	84	144.8 Å²	144.8	69%	0.694	76%	0.759	S	S	*	*			cis	-168	149.6	-15.6	0	0	0	0	0	113.6
917	Y	30.6	Very low	31.4	Very low	213 Å²	213	147.5 Å²	147.5	84%	0.835	77%	0.768	S	S	*	*			trans	65.9	104.7	147.5	-88.7	-112.7	0	0	0	124.1
918	N	29.9	Very low	31.3	Very low	126 Å²	126	140.8 Å²	140.8	67%	0.674	75%	0.746	S	S	*	*				66.8	159.8	113.2	-89.2	5.2	0	0	0	124.3
919	P	36.8	Very low	31.2	Very low	104 Å²	104	138 Å²	138	68%	0.675	73%	0.733	S	S	*	*			trans	-134.7	-177.9	-140.3	46.1	-31.1	0	0	0	116.8
920	T	31.6	Very low	31.3	Very low	137 Å²	137	139.9 Å²	139.9	84%	0.84	73%	0.732	S	S	*	*			trans	-161.2	140.3	145.5	-2.1	0	0	0	0	115.8
921	T	28.7	Very low	31.2	Very low	107 Å²	107	137.5 Å²	137.5	66%	0.656	73%	0.729	S	S	*	*			trans	-25.6	142.5	164.1	54.4	0	0	0	0	121
922	N	30.5	Very low	30.9	Very low	147 Å²	147	138.3 Å²	138.3	79%	0.786	74%	0.735	S	S	*	*				176.9	150	97.9	-97.2	-40.5	0	0	0	117.7
923	N	28.8	Very low	31	Very low	141 Å²	141	137.6 Å²	137.6	75%	0.754	73%	0.731	S	S	*	*			trans	-56.6	151.5	178.7	-65.2	-54.8	0	0	0	117.8
924	L	32.4	Very low	31.1	Very low	173 Å²	173	133.1 Å²	133.1	91%	0.906	72%	0.724	S	S	*	*				-179.8	158.9	104.2	-95.1	166.9	0	0	0	114
925	N	28.1	Very low	31.1	Very low	156 Å²	156	135.9 Å²	135.9	83%	0.834	73%	0.733	S	S	*	*			trans	-97.6	165.2	-172	-78.3	-16.9	0	0	0	114.8
926	S	34.1	Very low	31.1	Very low	109 Å²	109	135 Å²	135	76%	0.762	73%	0.733	S	S	*	*			trans	-158	127.3	154.6	-58.8	0	0	0	0	114.4
927	N	31.9	Very low	31.1	Very low	142 Å²	142	136.4 Å²	136.4	76%	0.759	74%	0.738	S	S	*	*			trans	53.6	116.8	145.4	-52.8	-8.4	0	0	0	120.8
928	I	31.7	Very low	31	Very low	74 Å²	74	132 Å²	132	38%	0.379	74%	0.737	S	S	.	*			cis	88	120.4	49.5	-65.4	171.1	0	0	0	115.1	Y1133	I928-Y1133 VanDerWaalsContact CA-OH 3.25Å; I928-Y1133 WeakPolarHBondContact CA-OH 3.4Å; I928-Y1133 PolarHBondContact N-OH 2.7Å
929	N	28	Very low	31.1	Very low	120 Å²	120	130 Å²	130	64%	0.642	74%	0.739	S	S	*	*			trans	67.3	137.4	158.2	-76.8	-31.6	0	0	0	121.9
930	I	32.9	Very low	30.7	Very low	168 Å²	168	131.3 Å²	131.3	86%	0.862	74%	0.74	S	S	*	*				-160.1	142.4	99.6	-95.9	160.5	0	0	0	113.1
931	H	33	Very low	30.8	Very low	160 Å²	160	132.4 Å²	132.4	74%	0.741	74%	0.735	S	S	*	*			trans	-42.7	154.8	172.1	-132.2	58.9	0	0	0	116.5
932	N	28	Very low	30.7	Very low	164 Å²	164	131.1 Å²	131.1	88%	0.877	73%	0.731	S	S	*	*			trans	-133.3	119.8	162.6	-176.7	6.2	0	0	0	109.7
933	N	32.3	Very low	30.8	Very low	107 Å²	107	131.1 Å²	131.1	57%	0.572	73%	0.731	S	S	*	*			trans	-157.5	132	-178.8	-150.9	-6	0	0	0	113.3
934	N	31	Very low	30.7	Very low	118 Å²	118	131.8 Å²	131.8	63%	0.631	73%	0.734	S	S	*	*			trans	57.6	110	160.5	-68.3	-34.6	0	0	0	122.6
935	N	29.9	Very low	30.9	Very low	128 Å²	128	128.2 Å²	128.2	68%	0.684	72%	0.721	S	S	*	*				58.5	115	119.5	-49.4	-26.8	0	0	0	121.5
936	N	32.5	Very low	31	Very low	156 Å²	156	128.4 Å²	128.4	83%	0.834	72%	0.719	S	S	*	*				-175.4	124.9	110.2	-87.5	-37.2	0	0	0	108.6
937	S	30	Very low	30.8	Very low	114 Å²	114	128.8 Å²	128.8	80%	0.797	71%	0.713	S	S	*	*				83.7	102.7	57.5	-169.5	0	0	0	0	113.3
938	C	28.6	Very low	30.9	Very low	121 Å²	121	128.5 Å²	128.5	82%	0.818	71%	0.711	S	S	*	*			trans	-159.1	125.1	156.4	-151.3	0	0	0	0	112.5
939	A	32.4	Very low	31	Very low	85 Å²	85	132.3 Å²	132.3	70%	0.702	73%	0.725	S	S	*	*			trans	48.9	154.4	142.6	0	0	0	0	0	123.5
940	N	28.3	Very low	31.1	Very low	130 Å²	130	135.5 Å²	135.5	70%	0.695	73%	0.733	S	S	*	*			cis	-171.7	160.7	-42.5	-129	-12.3	0	0	0	109.5
941	H	32.9	Very low	30.9	Very low	160 Å²	160	130.7 Å²	130.7	74%	0.741	73%	0.725	S	S	*	*			trans	64.4	165.7	165.2	-53	-50.7	0	0	0	118.5
942	S	27.8	Very low	30.9	Very low	81 Å²	81	128 Å²	128	57%	0.566	72%	0.724	S	S	*	*				-171.1	156.7	-69.3	47.8	0	0	0	0	111.2
943	N	31.9	Very low	30.9	Very low	147 Å²	147	129.6 Å²	129.6	79%	0.786	72%	0.719	S	S	*	*			trans	77.3	107.4	160.5	-49.3	-32.3	0	0	0	119.7
944	N	27.9	Very low	30.9	Very low	155 Å²	155	134.1 Å²	134.1	83%	0.829	73%	0.734	S	S	*	*				12.7	162	108.2	-103.3	-16.9	0	0	0	119.8
945	P	36	Very low	30.8	Very low	97 Å²	97	134 Å²	134	63%	0.63	74%	0.738	S	S	*	*			cis	-145.1	-155.3	1.5	32.9	-6.3	0	0	0	115.2
946	M	30.2	Very low	31	Very low	160 Å²	160	132.6 Å²	132.6	79%	0.788	74%	0.738	S	S	*	*			trans	83	101.8	149.9	-71.2	-66.9	168.3	0	0	123.1
947	N	29.8	Very low	30.9	Very low	118 Å²	118	133.7 Å²	133.7	63%	0.631	74%	0.738	S	S	*	*				37.4	113	112.3	-177.2	46	0	0	0	121.3
948	N	32.7	Very low	30.9	Very low	135 Å²	135	136.2 Å²	136.2	72%	0.722	74%	0.742	S	S	*	*				-172.7	118.8	118.3	-103	-36.9	0	0	0	115.9
949	K	34.5	Very low	31.2	Very low	154 Å²	154	135.5 Å²	135.5	67%	0.67	74%	0.736	S	S	*	*				29.9	141.4	115	-137.6	175.3	179.4	-177.9	0	121.9
950	F	30.1	Very low	31.2	Very low	187 Å²	187	136.3 Å²	136.3	82%	0.82	74%	0.736	S	S	*	*			trans	66.5	146.9	169.1	-56.3	-67.4	0	0	0	116.1
951	G	29.2	Very low	31.4	Very low	67 Å²	67	138.1 Å²	138.1	69%	0.691	74%	0.741	S	S	*	*			cis	163.8	-162.8	1.5	0	0	0	0	0	110.8
952	S	33.5	Very low	31.4	Very low	103 Å²	103	136.7 Å²	136.7	72%	0.72	74%	0.743	S	S	*	*			trans	72.6	104.2	172.1	-161.9	0	0	0	0	119.4
953	Y	27.3	Very low	31.7	Very low	199 Å²	199	137 Å²	137	78%	0.78	75%	0.751	S	S	*	*			trans	11.5	135.1	132.1	-43.8	-78.4	0	0	0	120
954	F	32.4	Very low	31.9	Very low	202 Å²	202	140.7 Å²	140.7	89%	0.886	76%	0.76	S	S	*	*				-144.4	140.5	109.4	-121.1	-79.2	0	0	0	111.8
955	T	27.8	Very low	32.5	Very low	116 Å²	116	141.9 Å²	141.9	71%	0.712	75%	0.754	S	S	*	*			trans	-117.1	121.3	178.6	-68.8	0	0	0	0	109.8
956	S	34.9	Very low	32.8	Very low	98 Å²	98	142.7 Å²	142.7	69%	0.685	76%	0.761	S	S	*	*			trans	-158	98.2	163.7	41.9	0	0	0	0	107.1
957	Q	31.3	Very low	33.5	Very low	179 Å²	179	138.3 Å²	138.3	84%	0.836	74%	0.744	S	S	*	*				81.3	126.8	84.6	-76.9	172.6	-28.2	0	0	113.6
958	L	30.4	Very low	34.7	Very low	167 Å²	167	140.5 Å²	140.5	87%	0.874	75%	0.751	S	S	*	*			trans	-71.2	173.5	167.5	-72.1	95.9	0	0	0	110.2
959	P	34.4	Very low	35.5	Very low	105 Å²	105	144.6 Å²	144.6	68%	0.682	76%	0.756	S	S	*	*			cis	-139.2	-166.2	14.2	43.4	-24.8	0	0	0	115.9
960	S	32.4	Very low	36.4	Very low	102 Å²	102	140.6 Å²	140.6	71%	0.713	75%	0.745	S	S	*	*			trans	70.1	153.9	155.2	77.4	0	0	0	0	117.4
961	E	31.5	Very low	38	Very low	169 Å²	169	135.5 Å²	135.5	79%	0.79	73%	0.732	S	S	*	*			cis	-157.3	157.3	-17.1	-125.6	173.4	-161	0	0	111.8
962	T	34	Very low	39.9	Very low	129 Å²	129	135.5 Å²	135.5	79%	0.791	73%	0.725	S	S	*	*			trans	65.1	148.3	163	65.2	0	0	0	0	121.5
963	A	34	Very low	41.9	Very low	88 Å²	88	135.6 Å²	135.6	73%	0.727	72%	0.721	S	S	*	*			trans	49.1	98.9	152.6	0	0	0	0	0	120.9
964	F	34.9	Very low	44.1	Very low	224 Å²	224	128.4 Å²	128.4	98%	0.982	70%	0.704	S	S	*	*				-149.3	138.1	113.8	-113.4	-75.5	0	0	0	111.1
965	Y	40.6	Very low	46.2	Very low	180 Å²	180	121.6 Å²	121.6	71%	0.706	69%	0.685	S	S	*	*			trans	-103.6	120.9	-165.4	-174.7	-91	0	0	0	111.1	P967	Y965-P967 HydrophobicContact CD1-CB 4.41Å; Y965-P967 HydrophobicContact CE1-CB 3.97Å
966	C	43.8	Very low	48.6	Very low	115 Å²	115	119 Å²	119	78%	0.777	68%	0.675	S	S	*	*			trans	-121.2	103.4	-178.8	-158.7	0	0	0	0	111	E968	C966-E968 VanDerWaalsContact C-N 3.26Å; C966-E968 PolarHBondContact O-N 3.11Å
967	P	44.7	Very low	50.7	Low	67 Å²	67	117 Å²	117	44%	0.435	66%	0.664	S	S	.	*	T	Hydrogen-bonded Turn	trans	-81.5	23.2	-161.6	32.2	-37.1	0	0	0	115.5	Y965 R969 V970 S971	Y965-P967 HydrophobicContact CD1-CB 4.41Å; Y965-P967 HydrophobicContact CE1-CB 3.97Å; P967-R969 VanDerWaalsContact C-N 3.28Å; P967-R969 PolarHBondContact O-N 3.22Å; P967-V970 HydrophobicContact CB-CB 4.1Å; P967-V970 HydrophobicContact CB-CG2 4.38Å; P967-V970 CarbonylContact O-C 3.29Å; P967-V970 WeakPolarHBondContact O-CA 3.44Å; P967-V970 WeakPolarHBondContact O-CB 3.03Å; P967-V970 PolarHBondContact O-N 3.17Å; P967-S971 PolarHBondContact O-N 3.29Å
968	E	55.2	Low	53.1	Low	165 Å²	165	111.3 Å²	111.3	77%	0.771	65%	0.648	S	S	*	*	H	α-helix	trans	-63.7	-29.9	-171.1	-160.4	177.2	-145.6	0	0	113.6	C966	C966-E968 VanDerWaalsContact C-N 3.26Å; C966-E968 PolarHBondContact O-N 3.11Å
969	R	48.7	Very low	55.5	Low	220 Å²	220	105.7 Å²	105.7	83%	0.83	63%	0.626	S	S	*	*	H	α-helix	trans	-81.5	-30.3	171.2	-60.1	-178.8	-164.2	-121.7	1.8	113	P967 S971 A972 V973	P967-R969 VanDerWaalsContact C-N 3.28Å; P967-R969 PolarHBondContact O-N 3.22Å; R969-S971 VanDerWaalsContact C-N 3.29Å; R969-A972 PolarHBondContact O-N 3.02Å; R969-V973 PolarHBondContact O-N 3.39Å; R969-V973 VanDerWaalsContact O-N 3.12Å
970	V	53.3	Low	57.7	Low	71 Å²	71	103.2 Å²	103.2	43%	0.43	61%	0.614	S	S	.	*	H	α-helix	trans	-66.2	-37.2	172.9	-174	0	0	0	0	109	P967 A972 V973 A974	P967-V970 HydrophobicContact CB-CB 4.1Å; P967-V970 HydrophobicContact CB-CG2 4.38Å; P967-V970 CarbonylContact O-C 3.29Å; P967-V970 WeakPolarHBondContact O-CA 3.44Å; P967-V970 WeakPolarHBondContact O-CB 3.03Å; P967-V970 PolarHBondContact O-N 3.17Å; V970-A972 VanDerWaalsContact C-N 3.32Å; V970-A972 PolarHBondContact O-N 3.27Å; V970-V973 PolarHBondContact O-N 2.75Å; V970-A974 HydrophobicContact CG1-CB 4.41Å; V970-A974 WeakPolarHBondContact O-CA 3.34Å; V970-A974 WeakPolarHBondContact O-CB 3.38Å; V970-A974 PolarHBondContact O-N 3.09Å
971	S	64.1	Low	59.9	Low	80 Å²	80	101.1 Å²	101.1	56%	0.559	60%	0.602	S	S	*	*	H	α-helix	trans	-55.6	-44	172.7	-173.3	0	0	0	0	112.4	P967 R969 A975	P967-S971 PolarHBondContact O-N 3.29Å; R969-S971 VanDerWaalsContact C-N 3.29Å; S971-A975 WeakPolarHBondContact O-CB 3.3Å; S971-A975 PolarHBondContact O-N 2.75Å
972	A	68	Low	62.2	Low	66 Å²	66	94.7 Å²	94.7	55%	0.545	58%	0.579	S	S	.	*	H	α-helix	trans	-69.1	-43.2	177.4	0	0	0	0	0	113.4	R969 V970 A976	R969-A972 PolarHBondContact O-N 3.02Å; V970-A972 VanDerWaalsContact C-N 3.32Å; V970-A972 PolarHBondContact O-N 3.27Å; A972-A976 WeakPolarHBondContact O-CB 3.18Å; A972-A976 PolarHBondContact O-N 3.34Å
973	V	75.3	Confident	64.3	Low	105 Å²	105	95 Å²	95	64%	0.636	57%	0.573	S	S	*	*	H	α-helix	trans	-74.2	-36.6	179.9	177.1	0	0	0	0	111.6	R969 V970 A976 A977	R969-V973 PolarHBondContact O-N 3.39Å; R969-V973 VanDerWaalsContact O-N 3.12Å; V970-V973 PolarHBondContact O-N 2.75Å; V973-A976 PolarHBondContact O-N 2.67Å; V973-A977 VanDerWaalsContact O-CB 3.25Å; V973-A977 WeakPolarHBondContact O-CB 3.39Å; V973-A977 PolarHBondContact O-N 3.32Å
974	A	74.9	Confident	66.3	Low	49 Å²	49	96 Å²	96	41%	0.405	57%	0.569	S	S	.	*	H	α-helix	trans	-73.1	-32.2	174.2	0	0	0	0	0	111.9	V970 A977 A978	V970-A974 HydrophobicContact CG1-CB 4.41Å; V970-A974 WeakPolarHBondContact O-CA 3.34Å; V970-A974 WeakPolarHBondContact O-CB 3.38Å; V970-A974 PolarHBondContact O-N 3.09Å; A974-A977 PolarHBondContact O-N 3.29Å; A974-A978 WeakPolarHBondContact O-CA 3.42Å; A974-A978 WeakPolarHBondContact O-CB 3.09Å; A974-A978 PolarHBondContact O-N 2.65Å
975	A	75.1	Confident	68.1	Low	59 Å²	59	89.5 Å²	89.5	49%	0.488	56%	0.557	S	S	.	*	H	α-helix	trans	-66.6	-40.5	168.6	0	0	0	0	0	111.3	S971 A979	S971-A975 WeakPolarHBondContact O-CB 3.3Å; S971-A975 PolarHBondContact O-N 2.75Å; A975-A979 VanDerWaalsContact O-CB 3.22Å; A975-A979 WeakPolarHBondContact O-CB 3.45Å; A975-A979 PolarHBondContact O-N 3.45Å
976	A	78.9	Confident	69.5	Low	62 Å²	62	83.9 Å²	83.9	51%	0.512	54%	0.538	S	S	.	.	H	α-helix	trans	-66	-42	173.4	0	0	0	0	0	112.2	A972 V973 A979 A980	A972-A976 WeakPolarHBondContact O-CB 3.18Å; A972-A976 PolarHBondContact O-N 3.34Å; V973-A976 PolarHBondContact O-N 2.67Å; A976-A979 PolarHBondContact O-N 3.48Å; A976-A980 WeakPolarHBondContact O-CB 3.12Å; A976-A980 PolarHBondContact O-N 3.49Å
977	A	79.8	Confident	70.5	Confident	55 Å²	55	82.8 Å²	82.8	46%	0.455	53%	0.528	S	S	.	.	H	α-helix	trans	-70.8	-35.7	177.2	0	0	0	0	0	112.4	V973 A974 A980 A981	V973-A977 VanDerWaalsContact O-CB 3.25Å; V973-A977 WeakPolarHBondContact O-CB 3.39Å; V973-A977 PolarHBondContact O-N 3.32Å; A974-A977 PolarHBondContact O-N 3.29Å; A977-A980 PolarHBondContact O-N 3.24Å; A977-A981 WeakPolarHBondContact O-CB 2.93Å; A977-A981 PolarHBondContact O-N 3.08Å
978	A	81.3	Confident	71.1	Confident	60 Å²	60	83.7 Å²	83.7	50%	0.496	53%	0.534	S	S	.	.	H	α-helix	trans	-70.6	-36.3	172.6	0	0	0	0	0	111.5	A974 A982	A974-A978 WeakPolarHBondContact O-CA 3.42Å; A974-A978 WeakPolarHBondContact O-CB 3.09Å; A974-A978 PolarHBondContact O-N 2.65Å; A978-A982 WeakPolarHBondContact O-CB 3.34Å; A978-A982 PolarHBondContact O-N 3.21Å
979	A	79.8	Confident	70.7	Confident	49 Å²	49	79.9 Å²	79.9	41%	0.405	53%	0.531	S	S	.	.	H	α-helix	trans	-65.3	-43.3	171	0	0	0	0	0	111.5	A975 A976 A982 M983	A975-A979 VanDerWaalsContact O-CB 3.22Å; A975-A979 WeakPolarHBondContact O-CB 3.45Å; A975-A979 PolarHBondContact O-N 3.45Å; A976-A979 PolarHBondContact O-N 3.48Å; A979-A982 PolarHBondContact O-N 3.46Å; A979-M983 WeakPolarHBondContact O-CB 3.42Å; A979-M983 VanDerWaalsContact O-CG 3.31Å; A979-M983 WeakPolarHBondContact O-CG 3.13Å; A979-M983 PolarHBondContact O-N 3.5Å
980	A	81.2	Confident	70.6	Confident	52 Å²	52	75.8 Å²	75.8	43%	0.43	52%	0.524	S	S	.	.	H	α-helix	trans	-64.5	-45.9	174.7	0	0	0	0	0	111.9	A976 A977 A982 M983 V984	A976-A980 WeakPolarHBondContact O-CB 3.12Å; A976-A980 PolarHBondContact O-N 3.49Å; A977-A980 PolarHBondContact O-N 3.24Å; A980-A982 VanDerWaalsContact C-N 3.34Å; A980-A982 PolarHBondContact O-N 2.77Å; A980-M983 PolarHBondContact O-N 2.98Å; A980-V984 WeakPolarHBondContact O-CG2 3.28Å; A980-V984 PolarHBondContact O-N 3.46Å
981	A	79	Confident	70	Confident	58 Å²	58	79.1 Å²	79.1	48%	0.479	54%	0.539	S	S	.	.	H	α-helix	trans	-64.3	-36.3	175.8	0	0	0	0	0	112.1	A977 V984 A985	A977-A981 WeakPolarHBondContact O-CB 2.93Å; A977-A981 PolarHBondContact O-N 3.08Å; A981-V984 PolarHBondContact O-N 2.85Å; A981-A985 WeakPolarHBondContact O-CB 3.12Å; A981-A985 PolarHBondContact O-N 3.29Å
982	A	79.4	Confident	68.7	Low	35 Å²	35	82.7 Å²	82.7	29%	0.289	55%	0.552	S	S	.	*	H	α-helix	trans	-68.3	-37	172.2	0	0	0	0	0	112	A978 A979 A980 M986	A978-A982 WeakPolarHBondContact O-CB 3.34Å; A978-A982 PolarHBondContact O-N 3.21Å; A979-A982 PolarHBondContact O-N 3.46Å; A980-A982 VanDerWaalsContact C-N 3.34Å; A980-A982 PolarHBondContact O-N 2.77Å; A982-M986 VanDerWaalsContact O-CB 3.23Å; A982-M986 WeakPolarHBondContact O-CB 3.28Å; A982-M986 WeakPolarHBondContact O-CG 3.32Å; A982-M986 PolarHBondContact O-N 3.44Å
983	M	77.9	Confident	67.4	Low	135 Å²	135	84 Å²	84	67%	0.665	56%	0.558	S	S	*	*	H	α-helix	trans	-66.7	-40.1	172.4	-74.6	178.7	179.2	0	0	112	A979 A980 M986 T987	A979-M983 WeakPolarHBondContact O-CB 3.42Å; A979-M983 VanDerWaalsContact O-CG 3.31Å; A979-M983 WeakPolarHBondContact O-CG 3.13Å; A979-M983 PolarHBondContact O-N 3.5Å; A980-M983 PolarHBondContact O-N 2.98Å; M983-M986 CarbonylContact O-C 2.99Å; M983-M986 PolarHBondContact O-N 2.79Å; M983-T987 PolarHBondContact O-N 3.36Å; M983-T987 PolarHBondContact O-OG1 3.34Å
984	V	77	Confident	65.6	Low	109 Å²	109	85.1 Å²	85.1	66%	0.661	57%	0.566	S	S	*	*	H	α-helix	trans	-66.7	-45.3	174	172.1	0	0	0	0	111	A980 A981 M986 T987	A980-V984 WeakPolarHBondContact O-CG2 3.28Å; A980-V984 PolarHBondContact O-N 3.46Å; A981-V984 PolarHBondContact O-N 2.85Å; V984-M986 VanDerWaalsContact C-N 3.28Å; V984-M986 PolarHBondContact O-N 3.17Å; V984-T987 VanDerWaalsContact O-CB 3.25Å; V984-T987 WeakPolarHBondContact O-CB 3.39Å; V984-T987 PolarHBondContact O-N 2.75Å
985	A	72.8	Confident	63.8	Low	88 Å²	88	94.2 Å²	94.2	73%	0.727	59%	0.59	S	S	*	*	H	α-helix	trans	-69.6	-22.2	177	0	0	0	0	0	113.8	A981	A981-A985 WeakPolarHBondContact O-CB 3.12Å; A981-A985 PolarHBondContact O-N 3.29Å
986	M	69.9	Low	61.9	Low	62 Å²	62	102.5 Å²	102.5	31%	0.305	61%	0.609	S	S	.	*	T	Hydrogen-bonded Turn	trans	-90.3	-5.2	168.3	-77.4	-148.9	155.6	0	0	114	A982 M983 V984 P988 M1067 Y1068	A982-M986 VanDerWaalsContact O-CB 3.23Å; A982-M986 WeakPolarHBondContact O-CB 3.28Å; A982-M986 WeakPolarHBondContact O-CG 3.32Å; A982-M986 PolarHBondContact O-N 3.44Å; M983-M986 CarbonylContact O-C 2.99Å; M983-M986 PolarHBondContact O-N 2.79Å; V984-M986 VanDerWaalsContact C-N 3.28Å; V984-M986 PolarHBondContact O-N 3.17Å; M986-P988 VanDerWaalsContact O-CD 3.26Å; M986-P988 WeakPolarHBondContact O-CD 3.18Å; M986-M1067 HydrophobicContact CB-SD 4.14Å; M986-M1067 HydrophobicContact CE-SD 4.2Å; M986-M1067 HydrophobicContact CG-SD 4.2Å; M986-M1067 HydrophobicContact SD-CB 4.04Å; M986-M1067 HydrophobicContact SD-CG 4.08Å; M986-M1067 HydrophobicContact SD-SD 3.59Å; M986-Y1068 HydrophobicContact CE-CD1 3.55Å; M986-Y1068 HydrophobicContact CE-CD2 4.12Å; M986-Y1068 HydrophobicContact CE-CE1 3.39Å; M986-Y1068 HydrophobicContact CE-CE2 3.98Å; M986-Y1068 HydrophobicContact CE-CG 3.91Å; M986-Y1068 HydrophobicContact SD-CD1 4.19Å; M986-Y1068 HydrophobicContact SD-CD2 3.73Å; M986-Y1068 HydrophobicContact SD-CE1 3.79Å; M986-Y1068 HydrophobicContact SD-CE2 3.27Å; M986-Y1068 WeakPolarHBondContact SD-CE2 3.46Å; M986-Y1068 HydrophobicContact SD-CG 4.16Å
987	T	64.6	Low	59.5	Low	91 Å²	91	105.1 Å²	105.1	56%	0.558	62%	0.622	S	S	*	*	S	Bend	trans	-72.8	114	168.7	-58.6	0	0	0	0	106.5	M983 V984 A989	M983-T987 PolarHBondContact O-N 3.36Å; M983-T987 PolarHBondContact O-OG1 3.34Å; V984-T987 VanDerWaalsContact O-CB 3.25Å; V984-T987 WeakPolarHBondContact O-CB 3.39Å; V984-T987 PolarHBondContact O-N 2.75Å; T987-A989 PolarHBondContact O-N 3.09Å
988	P	57	Low	57.5	Low	87 Å²	87	107.1 Å²	107.1	57%	0.565	63%	0.633	S	S	*	*			trans	-60.3	134.8	176.2	26.6	-33.6	0	0	0	108.4	M986 I990	M986-P988 VanDerWaalsContact O-CD 3.26Å; M986-P988 WeakPolarHBondContact O-CD 3.18Å; P988-I990 VanDerWaalsContact C-N 3.35Å; P988-I990 PolarHBondContact O-N 2.91Å
989	A	47.7	Very low	55.4	Low	85 Å²	85	111.5 Å²	111.5	70%	0.702	64%	0.643	S	S	*	*			trans	-67.5	91.5	-179.2	0	0	0	0	0	110.4	T987 N991	T987-A989 PolarHBondContact O-N 3.09Å; A989-N991 PolarHBondContact O-N 3.36Å
990	I	45.7	Very low	53.4	Low	134 Å²	134	116 Å²	116	69%	0.687	66%	0.655	S	S	*	*			trans	-75.4	74.4	173.1	-53.2	-177.7	0	0	0	108	P988 N992	P988-I990 VanDerWaalsContact C-N 3.35Å; P988-I990 PolarHBondContact O-N 2.91Å; I990-N992 VanDerWaalsContact C-N 3.33Å; I990-N992 PolarHBondContact O-N 3.08Å
991	N	41.2	Very low	51.2	Low	141 Å²	141	120.3 Å²	120.3	75%	0.754	67%	0.666	S	S	*	*			trans	-68.8	89.6	173.5	-78	-6.4	0	0	0	109.5	A989 S993	A989-N991 PolarHBondContact O-N 3.36Å; N991-S993 VanDerWaalsContact C-N 3.26Å; N991-S993 PolarHBondContact O-N 3.48Å
992	N	36.3	Very low	49.2	Very low	154 Å²	154	126.3 Å²	126.3	82%	0.824	68%	0.678	S	S	*	*			trans	-69.5	81.6	168.4	-77.1	-16.6	0	0	0	110.1	I990	I990-N992 VanDerWaalsContact C-N 3.33Å; I990-N992 PolarHBondContact O-N 3.08Å
993	S	41.7	Very low	47.2	Very low	95 Å²	95	130.7 Å²	130.7	66%	0.664	69%	0.692	S	S	*	*			trans	-138.5	109.4	170.9	-164	0	0	0	0	110.8	N991	N991-S993 VanDerWaalsContact C-N 3.26Å; N991-S993 PolarHBondContact O-N 3.48Å
994	P	37.4	Very low	45.2	Very low	127 Å²	127	132 Å²	132	83%	0.825	70%	0.696	S	S	*	*			trans	-94	105.3	-172.6	33.8	-31.9	0	0	0	112.2
995	R	35.6	Very low	43.3	Very low	240 Å²	240	134 Å²	134	91%	0.906	70%	0.698	S	S	*	*			trans	-129.7	146	165.4	-68.4	-168	179.6	-98.6	-1.2	112
996	R	36.1	Very low	41.6	Very low	234 Å²	234	138.4 Å²	138.4	88%	0.883	70%	0.703	S	S	*	*			trans	-106.9	158	-164.7	-78.4	176.1	154.7	-139.9	1.5	112.7
997	C	29	Very low	39.7	Very low	116 Å²	116	140.2 Å²	140.2	78%	0.784	72%	0.72	S	S	*	*			trans	70.3	156.1	160.6	-64.3	0	0	0	0	116.1
998	S	37.6	Very low	38.3	Very low	97 Å²	97	143.9 Å²	143.9	68%	0.678	73%	0.731	S	S	*	*			cis	-145.4	155.4	13.5	-154.3	0	0	0	0	115.8
999	H	36.5	Very low	37.2	Very low	152 Å²	152	143.8 Å²	143.8	70%	0.704	74%	0.737	S	S	*	*			trans	90.1	134.4	145.5	-95.3	37.7	0	0	0	123.6
1000	H	38.8	Very low	36.6	Very low	144 Å²	144	148 Å²	148	67%	0.667	74%	0.742	S	S	*	*			trans	56.5	119.7	171.4	-60.2	-61.6	0	0	0	119.4
1001	H	35.1	Very low	36.1	Very low	142 Å²	142	146.5 Å²	146.5	66%	0.657	74%	0.741	S	S	*	*				64.5	134.7	56.1	-73.2	-127.6	0	0	0	112.8
1002	Y	35.8	Very low	35.8	Very low	185 Å²	185	148.3 Å²	148.3	73%	0.725	75%	0.745	S	S	*	*			cis	-140.5	165.8	6.5	-92.1	-65.1	0	0	0	108.6
1003	H	37.6	Very low	35.5	Very low	126 Å²	126	145.4 Å²	145.4	58%	0.583	74%	0.736	S	S	*	*			cis	-148.1	166.3	1.2	-147.5	-71.6	0	0	0	109.2	H1005	H1003-H1005 AromaticContact CE1-CD2 3.5Å; H1003-H1005 PolarHBondContact CE1-CD2 3.06Å; H1003-H1005 VanDerWaalsContact CE1-CD2 3.5Å; H1003-H1005 AromaticContact CE1-NE2 3.36Å; H1003-H1005 PolarHBondContact CE1-NE2 3.5Å; H1003-H1005 AromaticContact ND1-CD2 3.46Å; H1003-H1005 PolarHBondContact ND1-CD2 2.9Å; H1003-H1005 AromaticContact ND1-NE2 3.84Å; H1003-H1005 AromaticContact NE2-NE2 3.98Å
1004	H	36.5	Very low	35	Very low	163 Å²	163	148.3 Å²	148.3	76%	0.755	74%	0.739	S	S	*	*			trans	-139.4	124.8	161.8	-152.8	-91.4	0	0	0	109.3
1005	H	37.1	Very low	34.7	Very low	152 Å²	152	149 Å²	149	70%	0.704	73%	0.733	S	S	*	*			trans	-103.2	101.5	176.7	-101.2	-84.5	0	0	0	110.5	H1003	H1003-H1005 AromaticContact CE1-CD2 3.5Å; H1003-H1005 PolarHBondContact CE1-CD2 3.06Å; H1003-H1005 VanDerWaalsContact CE1-CD2 3.5Å; H1003-H1005 AromaticContact CE1-NE2 3.36Å; H1003-H1005 PolarHBondContact CE1-NE2 3.5Å; H1003-H1005 AromaticContact ND1-CD2 3.46Å; H1003-H1005 PolarHBondContact ND1-CD2 2.9Å; H1003-H1005 AromaticContact ND1-NE2 3.84Å; H1003-H1005 AromaticContact NE2-NE2 3.98Å
1006	H	36.3	Very low	34.4	Very low	180 Å²	180	143.7 Å²	143.7	83%	0.833	72%	0.723	S	S	*	*			trans	-126.4	102.1	159	-126	57.5	0	0	0	106.4
1007	C	30.5	Very low	34.1	Very low	99 Å²	99	140.2 Å²	140.2	67%	0.669	72%	0.717	S	S	*	*			trans	-153.1	95.8	-177.1	-165	0	0	0	0	110.6
1008	H	35.3	Very low	34	Very low	168 Å²	168	141 Å²	141	78%	0.778	71%	0.713	S	S	*	*				-157.6	103	125.3	-112.8	-67.9	0	0	0	109.6
1009	A	34.3	Very low	33.8	Very low	85 Å²	85	145.8 Å²	145.8	70%	0.702	72%	0.722	S	S	*	*			trans	-73.4	150.3	149	0	0	0	0	0	108.2
1010	H	35.3	Very low	33.5	Very low	173 Å²	173	147.9 Å²	147.9	80%	0.801	72%	0.724	S	S	*	*			trans	-122.3	141.9	146.3	-114.7	-93.2	0	0	0	107.2
1011	P	33.4	Very low	33	Very low	103 Å²	103	147.3 Å²	147.3	67%	0.669	72%	0.722	S	S	*	*			trans	-95	154.1	-159.3	36	-35.4	0	0	0	113.3
1012	H	36.2	Very low	32.9	Very low	179 Å²	179	147.6 Å²	147.6	83%	0.829	73%	0.728	S	S	*	*			trans	-155.2	139.9	130.6	-118.2	-76.1	0	0	0	112
1013	C	30.2	Very low	32.7	Very low	94 Å²	94	144.6 Å²	144.6	64%	0.635	72%	0.723	S	S	*	*			trans	27.5	110.7	165.1	-61.7	0	0	0	0	119.7
1014	H	30.8	Very low	32.4	Very low	156 Å²	156	146.2 Å²	146.2	72%	0.722	73%	0.731	S	S	*	*				77	116.2	76.6	-81.9	-68.4	0	0	0	113
1015	I	29.7	Very low	32.2	Very low	140 Å²	140	144.5 Å²	144.5	72%	0.718	72%	0.724	S	S	*	*				65	123.6	101.5	-67.1	-172.5	0	0	0	111.7
1016	N	29.5	Very low	32	Very low	129 Å²	129	146.8 Å²	146.8	69%	0.69	73%	0.726	S	S	*	*			cis	-143.2	177.4	31.9	-149.1	-7.4	0	0	0	114.8
1017	Q	29.6	Very low	32	Very low	161 Å²	161	147.7 Å²	147.7	75%	0.752	73%	0.73	S	S	*	*			trans	-73.5	176.6	158.4	-65.1	167.6	-42.5	0	0	111.3
1018	N	28.5	Very low	32.1	Very low	132 Å²	132	146.1 Å²	146.1	71%	0.706	73%	0.731	S	S	*	*			trans	98.8	156.7	175.8	-53.2	-39.4	0	0	0	115.9
1019	F	33.4	Very low	32.2	Very low	199 Å²	199	145 Å²	145	87%	0.873	73%	0.726	S	S	*	*			trans	63.8	97.8	-166.8	-57.5	-81.4	0	0	0	112.1
1020	R	28.8	Very low	32.3	Very low	195 Å²	195	142.3 Å²	142.3	74%	0.736	71%	0.707	S	S	*	*			cis	61.5	121.4	31.4	-145.1	-160.3	-152	-119	6	111.6
1021	E	28.3	Very low	32.2	Very low	133 Å²	133	138.3 Å²	138.3	62%	0.621	69%	0.691	S	S	*	*			trans	38.9	101.9	158.4	-66.1	142.2	-164.1	0	0	117.3
1022	D	33	Very low	32.5	Very low	147 Å²	147	137.2 Å²	137.2	79%	0.786	68%	0.679	S	S	*	*				-165.8	135.9	124	-107	-16.7	0	0	0	116.1
1023	I	32.3	Very low	32.8	Very low	122 Å²	122	134.6 Å²	134.6	63%	0.626	67%	0.671	S	S	*	*			trans	56	104.7	137.7	-61.9	163.2	0	0	0	120.5
1024	Q	30.7	Very low	33.4	Very low	160 Å²	160	133.5 Å²	133.5	75%	0.748	66%	0.659	S	S	*	*				29.2	120.1	116	-118.4	79.5	-16.2	0	0	120.2
1025	Q	32.8	Very low	33.9	Very low	128 Å²	128	133.2 Å²	133.2	60%	0.598	66%	0.663	S	S	*	*				163.6	143.2	116.7	-89.8	155.7	88.1	0	0	115.8
1026	R	34.1	Very low	34.6	Very low	199 Å²	199	135.7 Å²	135.7	75%	0.751	67%	0.665	S	S	*	*			trans	61.3	123.3	160	-69.3	179	-77.9	-82	-5.5	116.9
1027	H	36	Very low	35.2	Very low	199 Å²	199	136.9 Å²	136.9	92%	0.921	67%	0.671	S	S	*	*			cis	67.4	132.7	31.1	-75.7	-85.4	0	0	0	117
1028	G	33	Very low	35.8	Very low	67 Å²	67	136.6 Å²	136.6	69%	0.691	68%	0.675	S	S	*	*			trans	97.1	153.2	179.7	0	0	0	0	0	113.4
1029	Q	35.4	Very low	36.7	Very low	143 Å²	143	139.7 Å²	139.7	67%	0.668	69%	0.685	S	S	*	*			cis	-133.8	-148.5	-10.3	-70.9	-172	-78.4	0	0	109.8	K463	K463-Q1029 HydrophobicContact CB-CB 4Å; K463-Q1029 HydrophobicContact CB-CG 4.48Å; K463-Q1029 WeakPolarHBondContact CD-O 3.17Å; K463-Q1029 PolarHBondContact NZ-O 3.24Å; K463-Q1029 VanDerWaalsContact NZ-O 3.09Å; K463-Q1029 PolarHBondContact O-NE2 2.66Å
1030	G	37.1	Very low	37.1	Very low	29 Å²	29	137.9 Å²	137.9	30%	0.299	68%	0.684	S	S	.	*			trans	68.4	112.5	170.1	0	0	0	0	0	120.9	K463	K463-G1030 PolarHBondContact NZ-O 2.88Å
1031	N	33.2	Very low	37.9	Very low	89 Å²	89	135.4 Å²	135.4	48%	0.476	69%	0.685	S	S	.	*			trans	-145.4	167.7	148.6	-68.4	44.1	0	0	0	105.2	M461 N462 K463	M461-N1031 WeakPolarHBondContact CA-O 3.45Å; M461-N1031 WeakPolarHBondContact CG-O 3.3Å; N462-N1031 HydrophobicContact CB-CB 3.83Å; N462-N1031 WeakPolarHBondContact CB-O 3.29Å; N462-N1031 PolarHBondContact N-O 3.27Å; N462-N1031 VanDerWaalsContact ND2-CB 3.3Å; N462-N1031 WeakPolarHBondContact ND2-CB 3.26Å; N462-N1031 VanDerWaalsContact ND2-CG 3.32Å; N462-N1031 PolarHBondContact ND2-OD1 3.24Å; K463-N1031 WeakPolarHBondContact CE-OD1 3.1Å; K463-N1031 PolarHBondContact NZ-OD1 3.16Å
1032	I	41.1	Very low	38.6	Very low	81 Å²	81	136.5 Å²	136.5	42%	0.415	70%	0.695	S	S	.	*			trans	-135.5	149.5	174.4	-78.6	159.9	0	0	0	108.7	K460 M461	K460-I1032 HydrophobicContact CB-CD1 4.12Å; K460-I1032 HydrophobicContact CB-CG1 3.87Å; K460-I1032 HydrophobicContact CB-CG2 4.08Å; K460-I1032 HydrophobicContact CD-CD1 4.1Å; K460-I1032 HydrophobicContact CD-CG2 3.82Å; K460-I1032 HydrophobicContact CG-CD1 4.36Å; K460-I1032 HydrophobicContact CG-CG1 4.28Å; K460-I1032 HydrophobicContact CG-CG2 3.64Å; M461-I1032 HydrophobicContact CB-CG1 3.85Å; M461-I1032 HydrophobicContact CE-CD1 3.71Å; M461-I1032 HydrophobicContact CE-CG1 3.94Å; M461-I1032 HydrophobicContact CG-CD1 4.33Å; M461-I1032 HydrophobicContact CG-CG1 3.84Å; M461-I1032 HydrophobicContact SD-CD1 3.73Å; M461-I1032 HydrophobicContact SD-CG1 3.92Å
1033	D	40.6	Very low	39	Very low	123 Å²	123	135.5 Å²	135.5	66%	0.658	70%	0.695	S	S	*	*			trans	-91.7	-148.5	-179	-46.6	-85.1	0	0	0	111
1034	D	43.8	Very low	39.8	Very low	72 Å²	72	134.6 Å²	134.6	39%	0.385	69%	0.694	S	S	.	*			trans	109.2	107	165.3	-48.2	-26.5	0	0	0	115.4	A459 K460	A459-D1034 WeakPolarHBondContact CA-OD1 3.36Å; A459-D1034 VanDerWaalsContact CB-CG 3.4Å; A459-D1034 WeakPolarHBondContact CB-OD1 3.29Å; A459-D1034 VanDerWaalsContact CB-OD2 3.25Å; A459-D1034 WeakPolarHBondContact CB-OD2 3.26Å; K460-D1034 WeakPolarHBondContact CE-OD2 3.45Å; K460-D1034 IonicContact NZ-OD2 3.92Å
1035	D	41.1	Very low	40.2	Very low	150 Å²	150	132.9 Å²	132.9	80%	0.802	69%	0.69	S	S	*	*			trans	-76.6	148.4	169.3	-51.3	-82.6	0	0	0	111.5
1036	Y	45	Very low	40.7	Very low	192 Å²	192	133.8 Å²	133.8	75%	0.753	70%	0.699	S	S	*	*			trans	-146.3	133.2	157.3	-95.6	-74.5	0	0	0	109.9
1037	D	42.7	Very low	41	Very low	153 Å²	153	129.3 Å²	129.3	82%	0.818	69%	0.69	S	S	*	*			trans	-78	-173.1	-172.8	-65.1	-67.6	0	0	0	114
1038	D	41.4	Very low	41.3	Very low	156 Å²	156	127 Å²	127	83%	0.834	69%	0.685	S	S	*	*			trans	-52.9	150.3	171.7	-54.8	-70.3	0	0	0	113.3
1039	E	46.3	Very low	41.8	Very low	197 Å²	197	132.2 Å²	132.2	92%	0.921	70%	0.696	S	S	*	*				-154.5	160.2	122.7	-80	-138.5	175.3	0	0	109.4
1040	D	41.7	Very low	42.2	Very low	160 Å²	160	132.6 Å²	132.6	86%	0.856	70%	0.702	S	S	*	*			trans	-91.8	-153.4	-176.2	-100.8	-55.2	0	0	0	111.7
1041	D	47.1	Very low	42	Very low	143 Å²	143	138.6 Å²	138.6	77%	0.765	73%	0.727	S	S	*	*			trans	74.1	86.1	161.2	-66.1	-5.3	0	0	0	120.7
1042	D	41.7	Very low	42.2	Very low	156 Å²	156	144.2 Å²	144.2	83%	0.834	75%	0.75	S	S	*	*				73.5	-177.7	120.7	-94.3	-5.9	0	0	0	122.4
1043	V	42.8	Very low	42	Very low	127 Å²	127	144 Å²	144	77%	0.77	76%	0.76	S	S	*	*			trans	88	91.4	160.7	-167.8	0	0	0	0	119.1
1044	V	47.8	Very low	41.7	Very low	102 Å²	102	144.9 Å²	144.9	62%	0.618	77%	0.765	S	S	*	*			trans	70.9	104.6	159.4	-139.1	0	0	0	0	121.8	N1046	V1044-N1046 WeakPolarHBondContact CG1-ND2 3.18Å; V1044-N1046 PolarHBondContact O-N 2.84Å
1045	D	40.2	Very low	41.4	Very low	124 Å²	124	147.9 Å²	147.9	66%	0.663	79%	0.787	S	S	*	*			trans	-72.7	96.8	149.7	-75.1	-39.9	0	0	0	109.8	R358 D1047	R358-D1045 IonicContact CZ-OD1 2.66Å; R358-D1045 IonicContact CZ-OD2 2.75Å; R358-D1045 IonicContact NH1-OD1 2.75Å; R358-D1045 PolarHBondContact NH1-OD1 2.81Å; R358-D1045 IonicContact NH1-OD2 3.7Å; R358-D1045 PolarHBondContact NH1-OD2 3.07Å; D1045-D1047 PolarHBondContact O-N 3.02Å
1046	N	42.4	Very low	41.2	Very low	148 Å²	148	148.5 Å²	148.5	79%	0.791	79%	0.788	S	S	*	*			trans	-91.4	87.5	171.1	-92.8	-56.1	0	0	0	111.6	V1044 D1048	V1044-N1046 WeakPolarHBondContact CG1-ND2 3.18Å; V1044-N1046 PolarHBondContact O-N 2.84Å; N1046-D1048 PolarHBondContact O-N 3.3Å
1047	D	40.9	Very low	40.8	Very low	104 Å²	104	145.2 Å²	145.2	56%	0.556	78%	0.784	S	S	*	*			trans	-93.1	76	-176.9	-157.8	15.2	0	0	0	110.5	R355 D1045	R355-D1047 IonicContact CZ-OD1 2.73Å; R355-D1047 IonicContact CZ-OD2 3.03Å; R355-D1047 IonicContact NH1-OD1 3.55Å; R355-D1047 IonicContact NH1-OD2 3.6Å; R355-D1047 PolarHBondContact NH1-OD2 3.09Å; R355-D1047 VanDerWaalsContact NH2-CG 3.3Å; R355-D1047 IonicContact NH2-OD1 3.65Å; R355-D1047 PolarHBondContact NH2-OD1 3.27Å; R355-D1047 IonicContact NH2-OD2 2.62Å; R355-D1047 PolarHBondContact NH2-OD2 2.98Å; D1045-D1047 PolarHBondContact O-N 3.02Å
1048	D	42.9	Very low	40.3	Very low	150 Å²	150	142.8 Å²	142.8	80%	0.802	79%	0.785	S	S	*	*			trans	-165.1	83.3	166.7	-122.2	-7.8	0	0	0	115.7	N1046	N1046-D1048 PolarHBondContact O-N 3.3Å
1049	L	43.6	Very low	40.1	Very low	178 Å²	178	143.8 Å²	143.8	93%	0.932	78%	0.782	S	S	*	*			trans	-153.4	132	142.9	-91.1	-163.4	0	0	0	110.9
1050	L	42.5	Very low	39.7	Very low	150 Å²	150	145.9 Å²	145.9	79%	0.785	78%	0.781	S	S	*	*			trans	-103.7	145.4	174.1	-73.2	167.9	0	0	0	110.7
1051	N	33.8	Very low	39.4	Very low	156 Å²	156	149.5 Å²	149.5	83%	0.834	78%	0.784	S	S	*	*			trans	60.6	90.5	162.7	-54.8	-28.8	0	0	0	117.3
1052	E	37.2	Very low	38.8	Very low	206 Å²	206	151.9 Å²	151.9	96%	0.963	79%	0.791	S	S	*	*			trans	-134.2	158.6	135.3	-153.1	153.7	-130	0	0	109.2
1053	A	37	Very low	38.7	Very low	76 Å²	76	152.9 Å²	152.9	63%	0.628	79%	0.79	S	S	*	*			trans	-140.1	157.5	-152.9	0	0	0	0	0	115.9
1054	N	33.3	Very low	38.3	Very low	142 Å²	142	157 Å²	157	76%	0.759	79%	0.793	S	S	*	*			trans	82.4	134	162.9	-50.8	-47.2	0	0	0	118.1
1055	T	37.9	Very low	37.7	Very low	136 Å²	136	161.2 Å²	161.2	83%	0.834	81%	0.806	S	S	*	*			trans	59.6	127.5	163.5	60.6	0	0	0	0	115.7
1056	I	37.2	Very low	37.5	Very low	162 Å²	162	163.3 Å²	163.3	83%	0.831	81%	0.811	S	S	*	*	S	Bend	cis	-141.4	143.8	19	-56.5	161.8	0	0	0	104.6
1057	D	36.8	Very low	37.1	Very low	124 Å²	124	161.6 Å²	161.6	66%	0.663	80%	0.8	S	S	*	*			cis	-149	148.1	47.6	-170.8	6.8	0	0	0	111.5	K1059	D1057-K1059 PolarHBondContact OD1-N 3.27Å
1058	A	31.6	Very low	36.9	Very low	102 Å²	102	164 Å²	164	84%	0.843	80%	0.802	S	S	*	*			trans	-136	48.4	-178.2	0	0	0	0	0	111.5
1059	K	37.4	Very low	36.6	Very low	177 Å²	177	164.9 Å²	164.9	77%	0.77	81%	0.807	S	S	*	*			trans	-123.3	149.8	175.5	-67.2	176.5	-178.5	173.6	0	110.9	D1057	D1057-K1059 PolarHBondContact OD1-N 3.27Å
1060	R	37.6	Very low	36.2	Very low	241 Å²	241	165.2 Å²	165.2	91%	0.909	80%	0.804	S	S	*	*	S	Bend	trans	64.7	50.7	175.5	-160.6	-173.3	-96.1	173.9	-7.7	116.9
1061	Y	35.7	Very low	35.9	Very low	235 Å²	235	164 Å²	164	92%	0.922	81%	0.808	S	S	*	*			trans	-154.8	68.1	149.3	-105.9	-68.5	0	0	0	112
1062	H	34.7	Very low	35.9	Very low	194 Å²	194	161.6 Å²	161.6	90%	0.898	81%	0.81	S	S	*	*			trans	-143.2	75.8	177.8	-110.9	-73.2	0	0	0	112.3
1063	H	39.8	Very low	35.8	Very low	176 Å²	176	157 Å²	157	82%	0.815	80%	0.8	S	S	*	*			trans	-154.1	165.4	160.9	-127.4	65	0	0	0	111.1
1064	Y	33.7	Very low	35.6	Very low	213 Å²	213	160.7 Å²	160.7	84%	0.835	81%	0.808	S	S	*	*	S	Bend	trans	64.1	64.7	-177	-73.8	-82.7	0	0	0	116.9
1065	H	35.1	Very low	35.7	Very low	191 Å²	191	162.6 Å²	162.6	88%	0.884	81%	0.812	S	S	*	*			trans	-160.5	66	147.9	-126.3	-69.1	0	0	0	113.4
1066	H	36.1	Very low	35.4	Very low	169 Å²	169	164.4 Å²	164.4	78%	0.782	81%	0.811	S	S	*	*			trans	-152.6	49.5	172.9	-145.3	-74.2	0	0	0	117
1067	M	34.5	Very low	35.6	Very low	111 Å²	111	165.5 Å²	165.5	55%	0.547	81%	0.812	S	S	.	*	S	Bend	trans	-133.2	154.2	157.4	-87.2	-62.3	152.5	0	0	109.6	M986	M986-M1067 HydrophobicContact CB-SD 4.14Å; M986-M1067 HydrophobicContact CE-SD 4.2Å; M986-M1067 HydrophobicContact CG-SD 4.2Å; M986-M1067 HydrophobicContact SD-CB 4.04Å; M986-M1067 HydrophobicContact SD-CG 4.08Å; M986-M1067 HydrophobicContact SD-SD 3.59Å
1068	Y	36.9	Very low	35.4	Very low	154 Å²	154	167.4 Å²	167.4	60%	0.604	82%	0.817	S	S	*	*	S	Bend	trans	61.6	70.1	-173.2	-61.1	-83.1	0	0	0	116.5	M986	M986-Y1068 HydrophobicContact CE-CD1 3.55Å; M986-Y1068 HydrophobicContact CE-CD2 4.12Å; M986-Y1068 HydrophobicContact CE-CE1 3.39Å; M986-Y1068 HydrophobicContact CE-CE2 3.98Å; M986-Y1068 HydrophobicContact CE-CG 3.91Å; M986-Y1068 HydrophobicContact SD-CD1 4.19Å; M986-Y1068 HydrophobicContact SD-CD2 3.73Å; M986-Y1068 HydrophobicContact SD-CE1 3.79Å; M986-Y1068 HydrophobicContact SD-CE2 3.27Å; M986-Y1068 WeakPolarHBondContact SD-CE2 3.46Å; M986-Y1068 HydrophobicContact SD-CG 4.16Å
1069	N	36.8	Very low	35.7	Very low	169 Å²	169	172 Å²	172	90%	0.904	82%	0.821	S	S	*	*				-176	96.1	126.7	-97.8	-27.1	0	0	0	112.1
1070	Q	34.6	Very low	35.7	Very low	186 Å²	186	171.7 Å²	171.7	87%	0.869	82%	0.822	S	S	*	*			trans	-133	123.3	155	-77.4	-169.1	-3.5	0	0	108.5
1071	S	36.1	Very low	35.5	Very low	125 Å²	125	169.8 Å²	169.8	87%	0.874	82%	0.82	S	S	*	*			trans	-97.5	105	176.3	53.2	0	0	0	0	109.7
1072	A	34.9	Very low	35.4	Very low	105 Å²	105	163.2 Å²	163.2	87%	0.868	81%	0.806	S	S	*	*			trans	-89.6	116.8	175.7	0	0	0	0	0	110.8
1073	S	33.3	Very low	35.1	Very low	110 Å²	110	163.7 Å²	163.7	77%	0.769	80%	0.801	S	S	*	*			trans	-151	85.5	162.2	-162.5	0	0	0	0	111.2
1074	I	33.6	Very low	34.9	Very low	152 Å²	152	162.6 Å²	162.6	78%	0.779	80%	0.797	S	S	*	*			trans	31.3	104.2	142.8	-53.1	165.8	0	0	0	116.2
1075	Q	35.7	Very low	35.1	Very low	183 Å²	183	158.2 Å²	158.2	86%	0.855	79%	0.792	S	S	*	*			trans	-83.5	133.7	153.8	-76.9	-172.3	-47.4	0	0	110
1076	H	32.1	Very low	35.1	Very low	174 Å²	174	156.4 Å²	156.4	81%	0.806	79%	0.788	S	S	*	*			trans	-65.6	130.4	162.4	-98.8	51.3	0	0	0	110
1077	Q	39.8	Very low	35	Very low	184 Å²	184	155.6 Å²	155.6	86%	0.86	79%	0.79	S	S	*	*			trans	-130	141.7	149.9	-77.6	-166.2	-10.4	0	0	109.5
1078	Q	33.7	Very low	35.1	Very low	165 Å²	165	155.4 Å²	155.4	77%	0.771	80%	0.797	S	S	*	*			trans	-94.7	133.7	-167.4	-62.2	157.6	-39.5	0	0	110.2
1079	H	38.2	Very low	35.1	Very low	197 Å²	197	156.1 Å²	156.1	91%	0.912	81%	0.806	S	S	*	*			trans	-139.9	134.2	154.3	-104.8	-89.4	0	0	0	109.7
1080	H	36.4	Very low	35.1	Very low	172 Å²	172	155 Å²	155	80%	0.796	80%	0.799	S	S	*	*			trans	-87.7	152	-174.1	-63.6	-107.6	0	0	0	112.2
1081	K	32.8	Very low	34.7	Very low	201 Å²	201	156.2 Å²	156.2	87%	0.874	80%	0.797	S	S	*	*				160.7	155.5	125.2	-93.5	-173.5	175.1	-175.2	0	112.1
1082	P	35.1	Very low	34.3	Very low	96 Å²	96	154.3 Å²	154.3	62%	0.623	78%	0.784	S	S	*	*				-140.4	-175.5	-114.8	36.2	-13.5	0	0	0	116.6
1083	Y	27.1	Very low	34.2	Very low	204 Å²	204	156.3 Å²	156.3	80%	0.8	78%	0.78	S	S	*	*			trans	64.3	160.3	176.5	-69.3	-95.6	0	0	0	113.4
1084	E	36.6	Very low	34	Very low	154 Å²	154	158 Å²	158	72%	0.72	78%	0.78	S	S	*	*			cis	-147.2	157.1	7.9	-147.9	134.1	-129.4	0	0	111.6
1085	T	38.7	Very low	34	Very low	120 Å²	120	154.1 Å²	154.1	74%	0.736	78%	0.776	S	S	*	*			trans	77	96.8	155.3	-45.3	0	0	0	0	117.4
1086	L	33.6	Very low	33.9	Very low	153 Å²	153	153.1 Å²	153.1	80%	0.801	77%	0.772	S	S	*	*				54.9	107.6	56.1	-68	177.6	0	0	0	115.9
1087	D	35.2	Very low	33.9	Very low	153 Å²	153	150 Å²	150	82%	0.818	76%	0.761	S	S	*	*			trans	-151	121.7	137.2	-146.7	-10.9	0	0	0	111
1088	P	35.5	Very low	33.8	Very low	107 Å²	107	151.2 Å²	151.2	70%	0.695	76%	0.758	S	S	*	*			trans	-127	105	-176.6	37.2	-20.7	0	0	0	115
1089	E	37.7	Very low	33.7	Very low	169 Å²	169	149 Å²	149	79%	0.79	76%	0.756	S	S	*	*			trans	-142	148.2	175.8	-76.6	-158.6	155.7	0	0	110.6
1090	L	36.3	Very low	33.7	Very low	144 Å²	144	146 Å²	146	75%	0.754	75%	0.751	S	S	*	*			cis	-126.4	142.9	-15.5	-60.3	91.2	0	0	0	106.6
1091	Y	26.5	Very low	33.5	Very low	213 Å²	213	146.6 Å²	146.6	84%	0.835	75%	0.746	S	S	*	*				56.6	113.3	68.2	-114.7	-92.4	0	0	0	116.5
1092	S	28.1	Very low	33.7	Very low	85 Å²	85	144.4 Å²	144.4	59%	0.594	74%	0.739	S	S	*	*			trans	58.5	123.9	158.2	-62.1	0	0	0	0	120.4
1093	N	32.2	Very low	33.7	Very low	147 Å²	147	143.6 Å²	143.6	79%	0.786	75%	0.748	S	S	*	*				153.2	156.6	113.5	-82.2	-62.5	0	0	0	110.2
1094	L	30	Very low	33.9	Very low	146 Å²	146	140 Å²	140	76%	0.764	75%	0.752	S	S	*	*			cis	163.7	117.6	-20.5	171.2	67.1	0	0	0	104.4
1095	G	32.1	Very low	34	Very low	69 Å²	69	138.3 Å²	138.3	71%	0.711	75%	0.754	S	S	*	*			trans	85	177.8	175.5	0	0	0	0	0	115.7
1096	Q	33.4	Very low	33.8	Very low	162 Å²	162	137.8 Å²	137.8	76%	0.757	76%	0.755	S	S	*	*			cis	-164.9	147.1	3.1	-133.7	175.9	62.9	0	0	112.2
1097	N	33.3	Very low	33.8	Very low	110 Å²	110	138.6 Å²	138.6	59%	0.588	76%	0.758	S	S	*	*			trans	68.8	150.7	167.2	-53.6	-64.7	0	0	0	117.4
1098	R	36.7	Very low	33.7	Very low	209 Å²	209	139 Å²	139	79%	0.789	76%	0.761	S	S	*	*			cis	-157.7	128.8	-15.9	-111	168.5	-157.1	-152.8	0.8	111.1
1099	T	32	Very low	33.7	Very low	118 Å²	118	137.6 Å²	137.6	72%	0.724	77%	0.766	S	S	*	*				16.4	133.4	127.9	62.6	0	0	0	0	119
1100	V	38.2	Very low	33.6	Very low	134 Å²	134	138.4 Å²	138.4	81%	0.812	77%	0.77	S	S	*	*				171.1	149.3	94.7	148.6	0	0	0	0	107.6
1101	R	33.3	Very low	33.5	Very low	185 Å²	185	138.3 Å²	138.3	70%	0.698	77%	0.768	S	S	*	*			cis	178.9	135.3	-15.4	177.1	177.6	-179.3	-136.5	-20	110.4
1102	E	36	Very low	33.9	Very low	154 Å²	154	134.8 Å²	134.8	72%	0.72	76%	0.759	S	S	*	*			trans	56.8	154.6	161.5	-68.2	151.8	-155.1	0	0	118.9
1103	G	35.8	Very low	34.6	Very low	80 Å²	80	134.8 Å²	134.8	83%	0.825	76%	0.755	S	S	*	*			cis	-166.6	-178.7	0.1	0	0	0	0	0	113
1104	C	31.7	Very low	34.9	Very low	129 Å²	129	129.6 Å²	129.6	87%	0.872	73%	0.73	S	S	*	*			trans	-126.9	-173.5	-172	-128.8	0	0	0	0	110.5
1105	P	36.8	Very low	35.4	Very low	118 Å²	118	126.3 Å²	126.3	77%	0.766	72%	0.719	S	S	*	*			cis	-137.2	-152	-10.7	41.3	-19.4	0	0	0	114.4
1106	S	34.9	Very low	35.5	Very low	109 Å²	109	129.5 Å²	129.5	76%	0.762	72%	0.717	S	S	*	*			trans	-82.5	173.2	-172.7	-36.2	0	0	0	0	118.6
1107	I	35.1	Very low	35.6	Very low	169 Å²	169	126.8 Å²	126.8	87%	0.867	71%	0.708	S	S	*	*			trans	-147.9	157.1	155.3	-22.5	174	0	0	0	110.7
1108	D	32.9	Very low	35.8	Very low	162 Å²	162	128.9 Å²	128.9	87%	0.866	71%	0.712	S	S	*	*			trans	-109.1	176	-164.3	-45	-89.8	0	0	0	116.5
1109	G	35.1	Very low	35.8	Very low	78 Å²	78	124.9 Å²	124.9	80%	0.804	71%	0.71	S	S	*	*			trans	172.7	140.6	168.3	0	0	0	0	0	117.1
1110	E	35	Very low	35.8	Very low	186 Å²	186	124.6 Å²	124.6	87%	0.869	71%	0.712	S	S	*	*			trans	-120.2	-170.1	-167.5	-64.2	-177.5	108.4	0	0	114.1
1111	I	34.7	Very low	35.7	Very low	141 Å²	141	123.6 Å²	123.6	72%	0.723	71%	0.706	S	S	*	*				-161.3	159.5	-62.2	-89	159.1	0	0	0	109.9
1112	H	33.7	Very low	35.9	Very low	139 Å²	139	121.8 Å²	121.8	64%	0.644	71%	0.709	S	S	*	*			trans	112.1	153.1	148.8	-129	-102.5	0	0	0	125.7
1113	V	43.1	Very low	35.9	Very low	85 Å²	85	120.8 Å²	120.8	52%	0.515	71%	0.713	S	S	.	*			trans	-140.3	-128.1	173.5	-147.7	0	0	0	0	110.6	N622 N623	N622-V1113 CarbonylContact C-O 3.28Å; N622-V1113 WeakPolarHBondContact CA-O 3.29Å; N622-V1113 PolarHBondContact N-O 2.87Å; N623-V1113 PolarHBondContact N-O 3.48Å
1114	P	39.7	Very low	36	Very low	39 Å²	39	120.3 Å²	120.3	25%	0.253	71%	0.709	S	S	.	*			cis	-85.4	-131	-38.8	-13.1	36.5	0	0	0	114.1	Y621 N622 N623	Y621-P1114 HydrophobicContact CD1-CB 4.04Å; Y621-P1114 HydrophobicContact CD1-CG 4.01Å; Y621-P1114 HydrophobicContact CD2-CG 4.01Å; Y621-P1114 HydrophobicContact CE1-CB 3.89Å; Y621-P1114 HydrophobicContact CE1-CG 3.89Å; Y621-P1114 HydrophobicContact CE2-CG 3.87Å; Y621-P1114 HydrophobicContact CG-CG 4.07Å; N622-P1114 CarbonylContact C-O 3.02Å; N622-P1114 WeakPolarHBondContact CA-O 3.08Å; N622-P1114 PolarHBondContact OD1-O 3.2Å; N622-P1114 VanDerWaalsContact OD1-O 3.12Å; N623-P1114 WeakPolarHBondContact CA-O 3.28Å; N623-P1114 PolarHBondContact N-O 3.1Å; N623-P1114 PolarHBondContact OD1-O 3.09Å
1115	S	38.9	Very low	36.2	Very low	76 Å²	76	121.8 Å²	121.8	53%	0.531	71%	0.708	S	S	.	*			cis	177.1	-159.9	-41.5	-173.1	0	0	0	0	110.2	N622	N622-S1115 PolarHBondContact ND2-O 3.36Å; N622-S1115 PolarHBondContact OD1-N 2.88Å
1116	M	35	Very low	36.1	Very low	136 Å²	136	121.2 Å²	121.2	67%	0.67	71%	0.707	S	S	*	*			trans	84.4	143.6	168.7	-83.6	-164.1	164.6	0	0	121.5
1117	D	36.1	Very low	36.1	Very low	105 Å²	105	124 Å²	124	56%	0.561	71%	0.712	S	S	*	*			cis	-169.1	165.7	-12.9	-144.1	-3.1	0	0	0	117.1
1118	K	37.8	Very low	36	Very low	155 Å²	155	121.1 Å²	121.1	67%	0.674	70%	0.704	S	S	*	*			trans	83.6	135.4	144.4	-86.7	173.6	-174.8	85.3	0	128.4
1119	T	36.6	Very low	35.9	Very low	124 Å²	124	124.3 Å²	124.3	76%	0.761	71%	0.706	S	S	*	*			trans	72.5	157.6	148.4	56.1	0	0	0	0	119.6
1120	C	32.2	Very low	35.8	Very low	112 Å²	112	126.4 Å²	126.4	76%	0.757	70%	0.697	S	S	*	*			cis	-173.9	176.7	-12.4	-102.8	0	0	0	0	109.3
1121	V	36.4	Very low	35.8	Very low	114 Å²	114	122.6 Å²	122.6	69%	0.691	68%	0.683	S	S	*	*			cis	-176.9	173.3	-29.3	70.7	0	0	0	0	110.3
1122	I	36.7	Very low	35.6	Very low	146 Å²	146	124.9 Å²	124.9	75%	0.749	69%	0.691	S	S	*	*			trans	73.1	148.9	164.9	-75.8	167.5	0	0	0	117.5
1123	T	36.5	Very low	35.5	Very low	133 Å²	133	126 Å²	126	82%	0.816	69%	0.69	S	S	*	*			cis	-167.4	163.3	-29.1	42.4	0	0	0	0	110.4
1124	G	37	Very low	35.3	Very low	71 Å²	71	127.6 Å²	127.6	73%	0.732	70%	0.703	S	S	*	*			trans	157.9	83	157.3	0	0	0	0	0	121.5
1125	N	35.6	Very low	34.9	Very low	160 Å²	160	129.1 Å²	129.1	86%	0.856	73%	0.725	S	S	*	*			trans	48.8	120.7	152.1	-64.8	5.3	0	0	0	125.2
1126	S	36.2	Very low	34.5	Very low	106 Å²	106	131.4 Å²	131.4	74%	0.741	74%	0.741	S	S	*	*			trans	81.3	96.2	132.1	-57.6	0	0	0	0	123.9
1127	L	33.5	Very low	34.3	Very low	166 Å²	166	130.1 Å²	130.1	87%	0.869	74%	0.743	S	S	*	*				43.8	151.1	121.9	-66.6	171.4	0	0	0	123
1128	P	34.6	Very low	34.1	Very low	109 Å²	109	131.9 Å²	131.9	71%	0.708	76%	0.757	S	S	*	*			cis	-133.1	167.6	-9.6	40.3	-23.8	0	0	0	116.6
1129	Y	30.8	Very low	33.8	Very low	229 Å²	229	132.7 Å²	132.7	90%	0.898	76%	0.763	S	S	*	*			trans	70.1	136.2	164.3	-132.2	-98.2	0	0	0	118.4
1130	I	31.1	Very low	33.4	Very low	122 Å²	122	135 Å²	135	63%	0.626	77%	0.765	S	S	*	*			trans	-139.6	139.1	-164.8	-70.8	174.8	0	0	0	110.8
1131	D	35.1	Very low	33.3	Very low	106 Å²	106	140.1 Å²	140.1	57%	0.567	77%	0.77	S	S	*	*			trans	19.4	135.5	156.6	-55.1	-29.9	0	0	0	122.4
1132	E	32	Very low	32.9	Very low	190 Å²	190	140.1 Å²	140.1	89%	0.888	78%	0.775	S	S	*	*			trans	-57.2	142.1	154.2	-52.9	174.5	117.2	0	0	111.2
1133	Y	31.9	Very low	32.6	Very low	162 Å²	162	143.3 Å²	143.3	64%	0.635	78%	0.778	S	S	*	*			trans	-128.6	120.4	173.7	-126.2	-82.8	0	0	0	112	I928	I928-Y1133 VanDerWaalsContact CA-OH 3.25Å; I928-Y1133 WeakPolarHBondContact CA-OH 3.4Å; I928-Y1133 PolarHBondContact N-OH 2.7Å
1134	P	37.3	Very low	32.4	Very low	119 Å²	119	144 Å²	144	77%	0.773	77%	0.77	S	S	*	*			trans	-98.9	165.5	-174.6	37.9	-35.9	0	0	0	113.8
1135	G	32	Very low	32.1	Very low	71 Å²	71	148.8 Å²	148.8	73%	0.732	78%	0.779	S	S	*	*			trans	137.3	93.2	153.6	0	0	0	0	0	118
1136	S	30.3	Very low	31.9	Very low	123 Å²	123	150.9 Å²	150.9	86%	0.86	78%	0.775	S	S	*	*			trans	-164.4	152.6	147.6	-94.4	0	0	0	0	111.3
1137	P	30.8	Very low	31.7	Very low	109 Å²	109	150.1 Å²	150.1	71%	0.708	77%	0.769	S	S	*	*			trans	-110.6	154.2	-130.2	38.1	-35	0	0	0	115.7
1138	V	31.1	Very low	31.6	Very low	143 Å²	143	148.4 Å²	148.4	87%	0.867	77%	0.768	S	S	*	*			trans	-136.2	97.8	156.7	-176.6	0	0	0	0	108.1
1139	E	31.7	Very low	31.4	Very low	171 Å²	171	153.5 Å²	153.5	80%	0.799	77%	0.773	S	S	*	*			trans	-72.5	152.6	176.5	-67.8	-169.5	128.6	0	0	112.4
1140	H	29.5	Very low	31.5	Very low	172 Å²	172	149.7 Å²	149.7	80%	0.796	77%	0.768	S	S	*	*			trans	-70.8	129.5	172	-78.9	-149.9	0	0	0	111.6
1141	Y	28.6	Very low	31.6	Very low	221 Å²	221	155.6 Å²	155.6	87%	0.867	78%	0.783	S	S	*	*			trans	-136.3	51.4	150.1	-98.6	-69.8	0	0	0	114.2	R1143	Y1141-R1143 PolarHBondContact O-N 2.75Å; Y1141-R1143 VanDerWaalsContact O-N 3.14Å
1142	S	28.1	Very low	31.5	Very low	114 Å²	114	157.6 Å²	157.6	80%	0.797	79%	0.792	S	S	*	*			trans	-74	89.8	158.9	-71.7	0	0	0	0	110.6
1143	R	31.6	Very low	31.5	Very low	213 Å²	213	155.6 Å²	155.6	80%	0.804	79%	0.787	S	S	*	*			trans	-157.3	127.8	157.3	-112.2	170.8	-167.1	-175.5	4.3	114.4	Y1141	Y1141-R1143 PolarHBondContact O-N 2.75Å; Y1141-R1143 VanDerWaalsContact O-N 3.14Å
1144	F	32.6	Very low	31.6	Very low	147 Å²	147	157.1 Å²	157.1	65%	0.645	80%	0.797	S	S	*	*			trans	60.1	83.6	161.9	-64.8	-65.1	0	0	0	119.6	R1146	F1144-R1146 HydrophobicContact CB-CG 4.36Å; F1144-R1146 PolarHBondContact O-N 3.05Å
1145	N	29.5	Very low	31.6	Very low	171 Å²	171	160.7 Å²	160.7	91%	0.914	80%	0.804	S	S	*	*				-43.9	122.6	129.8	-78.4	-42.2	0	0	0	110
1146	R	32.6	Very low	31.7	Very low	205 Å²	205	162.9 Å²	162.9	77%	0.774	80%	0.803	S	S	*	*			trans	-127.7	147.2	162.3	-78.7	-175.1	179.2	-110.9	-0.4	109.7	F1144	F1144-R1146 HydrophobicContact CB-CG 4.36Å; F1144-R1146 PolarHBondContact O-N 3.05Å
1147	S	30.3	Very low	31.9	Very low	89 Å²	89	164 Å²	164	62%	0.622	80%	0.8	S	S	*	*			trans	-62.9	132.3	-171.6	178.5	0	0	0	0	112.2	R1149	S1147-R1149 PolarHBondContact O-N 3.28Å
1148	P	32.9	Very low	32.2	Very low	131 Å²	131	166.5 Å²	166.5	85%	0.851	81%	0.807	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.8	91.2	173.2	-10.1	26.2	0	0	0	110.5
1149	R	29	Very low	32.4	Very low	216 Å²	216	167.4 Å²	167.4	82%	0.815	81%	0.805	S	S	*	*	T	Hydrogen-bonded Turn	trans	-151.9	-16.9	173.8	-128.4	165.7	-172.2	162.5	0.8	119.5	S1147	S1147-R1149 PolarHBondContact O-N 3.28Å
1150	D	33	Very low	32.5	Very low	149 Å²	149	169.7 Å²	169.7	80%	0.797	81%	0.806	S	S	*	*			trans	-122.9	43.3	-163	-53	-68.8	0	0	0	114.5
1151	W	34	Very low	32.7	Very low	246 Å²	246	166.7 Å²	166.7	93%	0.932	80%	0.795	S	S	*	*			trans	-128.7	42	176	-142	-31.4	0	0	0	113.6
1152	I	33.5	Very low	32.9	Very low	148 Å²	148	162.1 Å²	162.1	76%	0.759	79%	0.793	S	S	*	*	S	Bend	trans	-121.8	132	165.9	-61.1	177.1	0	0	0	106.5
1153	N	31.3	Very low	33.1	Very low	147 Å²	147	164 Å²	164	79%	0.786	79%	0.789	S	S	*	*	S	Bend	trans	86.6	139.9	-171.7	-47.4	-37.9	0	0	0	115.1
1154	K	34.2	Very low	33.4	Very low	195 Å²	195	162.1 Å²	162.1	85%	0.848	79%	0.789	S	S	*	*			trans	62.3	135.4	-159.4	-60.5	-172.5	174.8	-171	0	113.4
1155	E	37.9	Very low	33.7	Very low	193 Å²	193	164.1 Å²	164.1	90%	0.902	80%	0.801	S	S	*	*			cis	-109.2	124	3.5	-68.8	162.6	141.2	0	0	111.1
1156	T	33	Very low	34	Very low	118 Å²	118	163.8 Å²	163.8	72%	0.724	80%	0.798	S	S	*	*			trans	-89.7	175.2	146.4	41.5	0	0	0	0	108.3
1157	D	35.1	Very low	34	Very low	147 Å²	147	160 Å²	160	79%	0.786	80%	0.797	S	S	*	*			trans	73	88	176.8	-43.8	-42.9	0	0	0	113.9
1158	D	36.8	Very low	34.5	Very low	161 Å²	161	161.6 Å²	161.6	86%	0.861	80%	0.804	S	S	*	*				-167.4	163.5	105.8	-122.7	-30.6	0	0	0	115.1
1159	I	34.8	Very low	34.5	Very low	162 Å²	162	162.9 Å²	162.9	83%	0.831	80%	0.803	S	S	*	*			trans	72.4	123.1	174.4	-50.8	-178	0	0	0	117.3
1160	R	33.4	Very low	34.6	Very low	218 Å²	218	160.7 Å²	160.7	82%	0.823	81%	0.805	S	S	*	*			trans	-107.4	146.5	-179	-84	178.2	166.2	-175.2	-3.1	112.8
1161	I	34.8	Very low	34.5	Very low	109 Å²	109	163.7 Å²	163.7	56%	0.559	81%	0.806	S	S	*	*				51.6	121.3	127.7	-54.9	172.6	0	0	0	118.1	Q1163	I1161-Q1163 HydrophobicContact CG2-CB 3.68Å
1162	P	33	Very low	34.7	Very low	126 Å²	126	161.4 Å²	161.4	82%	0.818	81%	0.805	S	S	*	*				-98.5	158.4	98	-24	37.4	0	0	0	115.2
1163	Q	32.5	Very low	34.5	Very low	152 Å²	152	161 Å²	161	71%	0.71	81%	0.809	S	S	*	*			trans	-125.1	43.4	-165	-158.2	-178.7	-41	0	0	113.7	I1161	I1161-Q1163 HydrophobicContact CG2-CB 3.68Å
1164	E	37.4	Very low	34.5	Very low	174 Å²	174	156.9 Å²	156.9	81%	0.813	80%	0.802	S	S	*	*	S	Bend	trans	-119.8	-20.6	-164.8	-68.7	176.6	-147.2	0	0	115.9
1165	E	39.5	Very low	34.3	Very low	190 Å²	190	154.6 Å²	154.6	89%	0.888	80%	0.799	S	S	*	*	S	Bend	trans	-96.3	4.9	178.2	-66.7	-164.9	134.8	0	0	114.8
1166	L	35.8	Very low	34	Very low	164 Å²	164	152 Å²	152	86%	0.859	79%	0.791	S	S	*	*	S	Bend	trans	-97	6.8	-172.3	-140.7	84.7	0	0	0	115.5
1167	T	33	Very low	33.7	Very low	124 Å²	124	151.3 Å²	151.3	76%	0.761	79%	0.791	S	S	*	*	S	Bend	trans	-132.8	23.9	-168.8	22.2	0	0	0	0	116
1168	T	39.6	Very low	33.6	Very low	124 Å²	124	155.7 Å²	155.7	76%	0.761	80%	0.797	S	S	*	*			trans	-134.3	113.5	162.3	48.9	0	0	0	0	108.1
1169	L	32.4	Very low	33.3	Very low	157 Å²	157	156.2 Å²	156.2	82%	0.822	79%	0.791	S	S	*	*				-148.7	72.2	55.6	-170.3	76.3	0	0	0	113.1	R1171	L1169-R1171 PolarHBondContact O-N 2.77Å
1170	I	31.9	Very low	33.2	Very low	171 Å²	171	154.7 Å²	154.7	88%	0.877	78%	0.78	S	S	*	*			trans	-87.2	81.2	163.3	-57.2	-178.8	0	0	0	108.9
1171	R	31.8	Very low	33.2	Very low	212 Å²	212	151.3 Å²	151.3	80%	0.8	77%	0.774	S	S	*	*			trans	-164.9	104.7	163.9	-120.7	176	178.8	179.6	-0.8	111.2	L1169	L1169-R1171 PolarHBondContact O-N 2.77Å
1172	H	37.2	Very low	33.2	Very low	197 Å²	197	148.1 Å²	148.1	91%	0.912	76%	0.758	S	S	*	*			trans	-174.7	67.7	132.9	-96.5	-63	0	0	0	108.9
1173	T	28.8	Very low	33.3	Very low	139 Å²	139	147.2 Å²	147.2	85%	0.853	75%	0.752	S	S	*	*			trans	-70.4	135.6	170.7	45.8	0	0	0	0	110.9
1174	G	31.4	Very low	33.1	Very low	62 Å²	62	144.8 Å²	144.8	64%	0.639	74%	0.743	S	S	*	*			trans	-165.6	110.1	170.2	0	0	0	0	0	113.4
1175	N	29.3	Very low	33	Very low	146 Å²	146	141.5 Å²	141.5	78%	0.781	74%	0.735	S	S	*	*				44.4	123.6	123.5	-57.9	5.4	0	0	0	117.8
1176	N	32.5	Very low	32.7	Very low	139 Å²	139	137.7 Å²	137.7	74%	0.743	73%	0.726	S	S	*	*			cis	-151.3	153.4	11.2	-68.4	-52.1	0	0	0	107.5
1177	S	27.7	Very low	32.6	Very low	103 Å²	103	135.5 Å²	135.5	72%	0.72	72%	0.719	S	S	*	*			cis	84.3	85.1	39.8	-58.2	0	0	0	0	116.4
1178	R	31.9	Very low	32.5	Very low	239 Å²	239	137.7 Å²	137.7	90%	0.902	72%	0.718	S	S	*	*			trans	172.7	136.8	148.4	-89.3	149.1	-165.2	-152.9	2.9	107.4
1179	K	29.6	Very low	32.2	Very low	172 Å²	172	139.6 Å²	139.6	75%	0.748	72%	0.718	S	S	*	*			cis	78.4	115.8	20.9	-66.6	-163.4	168.4	-159.8	0	116.8	D117	D117-K1179 WeakPolarHBondContact OD2-CA 2.77Å; D117-K1179 PolarHBondContact OD2-N 2.86Å
1180	H	33.4	Very low	32.3	Very low	130 Å²	130	137.1 Å²	137.1	60%	0.602	71%	0.712	S	S	*	*				-175.3	87.3	125.1	-102.3	-75.4	0	0	0	115.9	D117	D117-H1180 PolarHBondContact OD1-N 3.33Å; D117-H1180 PolarHBondContact OD2-N 3.03Å
1181	E	33.1	Very low	32.3	Very low	147 Å²	147	135.1 Å²	135.1	69%	0.687	71%	0.708	S	S	*	*				85.6	121.5	124.5	-72.4	171.1	167.2	0	0	125.2
1182	L	36	Very low	32.2	Very low	42 Å²	42	130 Å²	130	22%	0.22	70%	0.704	C	S	.	*			trans	-56.5	168	146.1	-101.6	177.5	0	0	0	116.9	H113 H114 D115 L1184	H113-L1182 HydrophobicContact CB-CD2 3.43Å; H113-L1182 VanDerWaalsContact CB-CD2 3.43Å; H113-L1182 WeakPolarHBondContact ND1-CD2 3.25Å; H114-L1182 VanDerWaalsContact C-CD2 3.47Å; H114-L1182 WeakPolarHBondContact O-CD2 3Å; H114-L1182 VanDerWaalsContact O-CG 3.31Å; H114-L1182 WeakPolarHBondContact O-CG 3.44Å; D115-L1182 HydrophobicContact CB-CD1 4.18Å; D115-L1182 HydrophobicContact CB-CG 4.12Å; D115-L1182 WeakPolarHBondContact OD1-CB 3.44Å; D115-L1182 PolarHBondContact OD1-N 2.62Å; L1182-L1184 HydrophobicContact CD1-CD1 4.18Å; L1182-L1184 HydrophobicContact CD1-CG 4.48Å
1183	P	34.4	Very low	32	Very low	108 Å²	108	124.8 Å²	124.8	70%	0.701	69%	0.69	S	S	*	*				-135.5	158.2	123.4	31.1	-16.3	0	0	0	116.1
1184	L	29.1	Very low	32.2	Very low	100 Å²	100	124.4 Å²	124.4	52%	0.524	69%	0.687	S	S	.	*			trans	-128.6	148.1	178.7	-84.8	155.1	0	0	0	110.3	D112 H113 L1182	D112-L1184 HydrophobicContact CB-CD2 3.82Å; H113-L1184 HydrophobicContact CB-CD2 4.03Å; H113-L1184 HydrophobicContact CB-CG 4.28Å; L1182-L1184 HydrophobicContact CD1-CD1 4.18Å; L1182-L1184 HydrophobicContact CD1-CG 4.48Å
1185	T	34.3	Very low	32	Very low	105 Å²	105	128.9 Å²	128.9	64%	0.644	70%	0.697	S	S	*	*			trans	-146.1	98.4	161.6	53.3	0	0	0	0	110.7
1186	T	33.4	Very low	32.2	Very low	111 Å²	111	132.4 Å²	132.4	68%	0.681	70%	0.701	S	S	*	*				58.9	127.2	92.1	61.4	0	0	0	0	114.9
1187	T	33.5	Very low	32	Very low	118 Å²	118	133.2 Å²	133.2	72%	0.724	70%	0.702	S	S	*	*				-174.2	135.7	84.6	-71.9	0	0	0	0	114.6
1188	F	32	Very low	31.9	Very low	170 Å²	170	132.4 Å²	132.4	75%	0.746	70%	0.696	S	S	*	*			trans	19.5	151.3	141.3	-62.7	-115.9	0	0	0	121.8
1189	Q	32.7	Very low	31.7	Very low	163 Å²	163	128.7 Å²	128.7	76%	0.762	69%	0.693	S	S	*	*			cis	-166.6	176.9	-7.8	-113.9	-167.1	1.8	0	0	111.6
1190	P	34.6	Very low	31.9	Very low	106 Å²	106	125.5 Å²	125.5	69%	0.688	70%	0.699	S	S	*	*			trans	-102.8	-175	-176.5	42.1	-37.3	0	0	0	114.7
1191	V	32.5	Very low	31.6	Very low	129 Å²	129	127.9 Å²	127.9	78%	0.782	71%	0.708	S	S	*	*			trans	173.6	133.4	138.6	146.1	0	0	0	0	114.2
1192	S	29.5	Very low	31.4	Very low	103 Å²	103	126.8 Å²	126.8	72%	0.72	71%	0.707	S	S	*	*			trans	37.7	174.3	154.7	81.8	0	0	0	0	122.4
1193	S	31.6	Very low	31.2	Very low	89 Å²	89	132.8 Å²	132.8	62%	0.622	73%	0.734	S	S	*	*			cis	-162.3	163.9	9.1	2.3	0	0	0	0	113.7
1194	T	33.5	Very low	30.9	Very low	130 Å²	130	134.3 Å²	134.3	80%	0.798	74%	0.735	S	S	*	*			trans	64.9	130.6	149.4	47.7	0	0	0	0	122.7
1195	N	28.3	Very low	31	Very low	156 Å²	156	135 Å²	135	83%	0.834	74%	0.744	S	S	*	*			trans	-91.1	142.1	163	-53.1	-67	0	0	0	111.5
1196	Y	32.8	Very low	30.7	Very low	220 Å²	220	136.2 Å²	136.2	86%	0.863	75%	0.751	S	S	*	*			trans	-153.6	114.8	147.7	-94.1	-87.6	0	0	0	106.7
1197	M	27.5	Very low	30.5	Very low	156 Å²	156	134 Å²	134	77%	0.768	75%	0.751	S	S	*	*				73.2	111.3	75.3	-81.4	-78.3	108.9	0	0	115.8
1198	S	26.8	Very low	30.4	Very low	87 Å²	87	136.7 Å²	136.7	61%	0.608	75%	0.752	S	S	*	*			trans	76.6	116.1	135.4	-61.2	0	0	0	0	122.4
1199	L	27.1	Very low	30.6	Very low	160 Å²	160	137.1 Å²	137.1	84%	0.838	75%	0.754	S	S	*	*				53.2	108.4	124.1	-65.7	159.2	0	0	0	119.5
1200	A	33.2	Very low	30.8	Very low	105 Å²	105	137.3 Å²	137.3	87%	0.868	76%	0.755	S	S	*	*			trans	-140	145.6	140.1	0	0	0	0	0	110
1201	F	27.6	Very low	30.9	Very low	181 Å²	181	138.8 Å²	138.8	79%	0.794	76%	0.756	S	S	*	*			trans	-99.5	167.8	-175.7	-121.1	-96.7	0	0	0	111.6
1202	N	28.7	Very low	31.4	Very low	123 Å²	123	137.3 Å²	137.3	66%	0.658	75%	0.75	S	S	*	*			trans	89.3	144.4	140.4	-94	-29.2	0	0	0	122.5
1203	Q	33	Very low	31.7	Very low	169 Å²	169	138.8 Å²	138.8	79%	0.79	75%	0.749	S	S	*	*			trans	70.8	143.5	161.2	-66.5	165.4	110.9	0	0	118.5
1204	L	28	Very low	31.8	Very low	140 Å²	140	141.2 Å²	141.2	73%	0.733	76%	0.755	S	S	*	*			cis	165.4	165.8	-33.1	-107.1	165.8	0	0	0	107.7
1205	T	29.7	Very low	31.8	Very low	113 Å²	113	140.3 Å²	140.3	69%	0.693	75%	0.749	S	S	*	*			trans	69.3	113.1	151.5	43.2	0	0	0	0	121.8
1206	V	28.4	Very low	31.8	Very low	131 Å²	131	138.3 Å²	138.3	79%	0.794	74%	0.743	S	S	*	*				66.6	127.4	125.1	179.4	0	0	0	0	118.4
1207	G	28.8	Very low	31.9	Very low	66 Å²	66	133.9 Å²	133.9	68%	0.68	74%	0.739	S	S	*	*			cis	142.9	-160.5	4.3	0	0	0	0	0	112
1208	K	33.1	Very low	32.2	Very low	173 Å²	173	131.1 Å²	131.1	75%	0.752	73%	0.734	S	S	*	*			trans	94.3	149.9	171.2	-53.1	174.8	-179.4	177.9	0	118.3
1209	F	34.7	Very low	32.3	Very low	179 Å²	179	131.8 Å²	131.8	79%	0.785	74%	0.739	S	S	*	*			trans	72.2	132.2	168.2	-55.4	-79	0	0	0	118.7
1210	H	37.8	Very low	32.4	Very low	168 Å²	168	128.5 Å²	128.5	78%	0.778	74%	0.735	S	S	*	*			cis	-162.3	142.3	-27.5	-142.5	-87.4	0	0	0	111.9
1211	D	36.8	Very low	32.5	Very low	136 Å²	136	128.6 Å²	128.6	73%	0.727	73%	0.727	S	S	*	*			trans	-64.2	161.7	160.7	-85	-62	0	0	0	111.6
1212	P	42.5	Very low	32.4	Very low	99 Å²	99	125.1 Å²	125.1	64%	0.643	73%	0.725	S	S	*	*			cis	-148.5	-174.3	46.6	42.9	-20.5	0	0	0	115.4
1213	N	35.6	Very low	32.2	Very low	133 Å²	133	127.9 Å²	127.9	71%	0.711	73%	0.732	S	S	*	*			cis	-136.2	143.2	15.8	-83.6	-73.3	0	0	0	113.5
1214	L	33	Very low	32	Very low	140 Å²	140	125.8 Å²	125.8	73%	0.733	72%	0.723	S	S	*	*				24.4	142.2	129.4	-71.7	74.8	0	0	0	119.2
1215	T	34	Very low	32.1	Very low	111 Å²	111	125.2 Å²	125.2	68%	0.681	73%	0.728	S	S	*	*			cis	-155.1	147.5	34.7	-21	0	0	0	0	112.5
1216	T	29.8	Very low	32	Very low	115 Å²	115	125 Å²	125	71%	0.706	72%	0.722	S	S	*	*			trans	14.8	140.7	145.5	53.4	0	0	0	0	120.1
1217	V	33.4	Very low	31.9	Very low	127 Å²	127	125.4 Å²	125.4	77%	0.77	72%	0.715	S	S	*	*			cis	-166.1	160.3	11.7	-97.8	0	0	0	0	107.5
1218	S	33.2	Very low	31.8	Very low	97 Å²	97	127.5 Å²	127.5	68%	0.678	71%	0.71	S	S	*	*			cis	-161.5	172.3	-4.4	-115	0	0	0	0	112.2
1219	S	29.8	Very low	31.5	Very low	101 Å²	101	126 Å²	126	71%	0.706	71%	0.71	S	S	*	*			trans	-21.4	138.7	141.9	-28.1	0	0	0	0	115
1220	A	29.2	Very low	31.2	Very low	91 Å²	91	121.8 Å²	121.8	75%	0.752	70%	0.703	S	S	*	*			cis	63.1	152	36.6	0	0	0	0	0	114.2
1221	P	34.7	Very low	30.8	Very low	107 Å²	107	118.7 Å²	118.7	70%	0.695	70%	0.7	S	S	*	*				-126.5	-178.1	-61.2	39.1	-28.2	0	0	0	111.6
1222	S	25.5	Very low	30.4	Very low	109 Å²	109	120 Å²	120	76%	0.762	71%	0.706	S	S	*	*			trans	72.6	149.6	-175.1	-25	0	0	0	0	113.8
1223	F	25.4	Very low	29.8	Very low	181 Å²	181	120 Å²	120	79%	0.794	71%	0.706	S	S	*	*				173.6	148.1	118.4	-107.1	-79.2	0	0	0	110.7
1224	M	28.5	Very low	29.3	Very low	124 Å²	124	120.9 Å²	120.9	61%	0.611	71%	0.709	S	S	*	*			trans	67	152.7	170.4	-61.3	-49	179.7	0	0	117	L1226	M1224-L1226 HydrophobicContact SD-CB 3.96Å; M1224-L1226 HydrophobicContact SD-CD1 4.29Å; M1224-L1226 PolarHBondContact SD-N 2.73Å; M1224-L1226 VanDerWaalsContact SD-N 3.42Å
1225	P	29.9	Very low	29	Very low	129 Å²	129	119.6 Å²	119.6	84%	0.838	71%	0.712	S	S	*	*			cis	-92.1	121.5	3.9	34.1	-31.2	0	0	0	115.7
1226	L	26.9	Very low	28.8	Very low	107 Å²	107	123.5 Å²	123.5	56%	0.56	72%	0.72	S	S	*	*				-70.3	146.4	113.5	-72.7	69.5	0	0	0	105.6	M1224 I1228	M1224-L1226 HydrophobicContact SD-CB 3.96Å; M1224-L1226 HydrophobicContact SD-CD1 4.29Å; M1224-L1226 PolarHBondContact SD-N 2.73Å; M1224-L1226 VanDerWaalsContact SD-N 3.42Å; L1226-I1228 HydrophobicContact CD2-CD1 4.38Å
1227	E	27.6	Very low	29	Very low	141 Å²	141	123.7 Å²	123.7	66%	0.659	72%	0.723	S	S	*	*				-133.3	134.6	53.4	-70	-71.6	108.4	0	0	109.2
1228	I	26.3	Very low	28.7	Very low	110 Å²	110	128.3 Å²	128.3	56%	0.564	73%	0.726	S	S	*	*				60.1	105.4	82	-62.6	175.4	0	0	0	112.2	L1226	L1226-I1228 HydrophobicContact CD2-CD1 4.38Å
1229	N	27.7	Very low	28.6	Very low	140 Å²	140	131.2 Å²	131.2	75%	0.749	73%	0.733	S	S	*	*			trans	149.4	101.3	148.1	-77.6	-40.7	0	0	0	107.9
1230	S	27.3	Very low	28.6	Very low	92 Å²	92	131.4 Å²	131.4	64%	0.643	73%	0.733	S	S	*	*				76.1	141	65.5	76.9	0	0	0	0	113.5
1231	S	29.9	Very low	28.4	Very low	103 Å²	103	132.2 Å²	132.2	72%	0.72	73%	0.728	S	S	*	*			trans	70.3	135.6	-166.3	-15.1	0	0	0	0	112.3
1232	L	27.9	Very low	28	Very low	162 Å²	162	133.4 Å²	133.4	85%	0.848	73%	0.729	S	S	*	*			cis	64.1	137.3	41.9	-61.1	160.6	0	0	0	112.9
1233	P	29.3	Very low	28.3	Very low	99 Å²	99	135.4 Å²	135.4	64%	0.643	73%	0.729	S	S	*	*			cis	-140.5	-171.1	-21.6	40.7	-22.1	0	0	0	113.7
1234	I	25.7	Very low	28.6	Very low	153 Å²	153	132 Å²	132	79%	0.785	73%	0.725	S	S	*	*			trans	23	118.2	140	-56.9	156.5	0	0	0	117.7
1235	S	26.5	Very low	28.6	Very low	112 Å²	112	131.2 Å²	131.2	78%	0.783	73%	0.732	S	S	*	*				177	145.4	122.6	-81.3	0	0	0	0	114.9
1236	F	31.1	Very low	28.6	Very low	194 Å²	194	129.2 Å²	129.2	85%	0.851	72%	0.721	S	S	*	*			trans	-79.7	152.5	155.7	-78.8	-99.9	0	0	0	110
1237	P	33.5	Very low	28.8	Very low	118 Å²	118	135 Å²	135	77%	0.766	74%	0.735	S	S	*	*				-115.7	140.3	105.6	-7.8	27.1	0	0	0	110.4
1238	R	26.2	Very low	28.9	Very low	224 Å²	224	134.2 Å²	134.2	85%	0.845	74%	0.74	S	S	*	*				66.5	125.4	58.8	-71.6	-168.5	170.9	-156.1	-1.7	114.5
1239	L	31.3	Very low	29.2	Very low	158 Å²	158	135.5 Å²	135.5	83%	0.827	75%	0.748	S	S	*	*			trans	-13.6	152.6	153.6	-80.8	77.3	0	0	0	116.5
1240	P	29.6	Very low	29.4	Very low	106 Å²	106	134.3 Å²	134.3	69%	0.688	74%	0.742	S	S	*	*				-158.2	162	51.7	46	-25.6	0	0	0	121.4
1241	T	25.9	Very low	29.6	Very low	107 Å²	107	139.5 Å²	139.5	66%	0.656	75%	0.748	S	S	*	*			trans	48.5	146	135.1	63.1	0	0	0	0	125.7
1242	N	25.1	Very low	29.5	Very low	133 Å²	133	138.7 Å²	138.7	71%	0.711	74%	0.742	S	S	*	*			trans	73.9	124.5	148.2	-60.4	-16.9	0	0	0	117.5
1243	I	32.9	Very low	29.6	Very low	151 Å²	151	137.4 Å²	137.4	77%	0.774	74%	0.736	S	S	*	*				59.8	112.6	56.1	-54.2	173.4	0	0	0	109.8
1244	P	31.6	Very low	29.7	Very low	108 Å²	108	137.8 Å²	137.8	70%	0.701	74%	0.739	S	S	*	*				-156.5	174.3	67.6	42.8	-23.3	0	0	0	118.7
1245	S	29.4	Very low	29.9	Very low	109 Å²	109	137.2 Å²	137.2	76%	0.762	74%	0.736	S	S	*	*			trans	67.9	154.5	139	-85.6	0	0	0	0	120.8
1246	S	28.3	Very low	29.9	Very low	86 Å²	86	141.3 Å²	141.3	60%	0.601	73%	0.734	S	S	*	*			cis	-169.4	158.1	-4.9	-116	0	0	0	0	111.4
1247	R	31.4	Very low	29.7	Very low	228 Å²	228	140.7 Å²	140.7	86%	0.86	73%	0.727	S	S	*	*			trans	68.8	141.4	162.8	-61.9	161.5	-171.6	-153.7	-0.2	114.1
1248	T	31.1	Very low	29.3	Very low	125 Å²	125	140.7 Å²	140.7	77%	0.767	72%	0.72	S	S	*	*			cis	-158.5	-178.1	5.2	2.2	0	0	0	0	108.1
1249	L	32.2	Very low	29.3	Very low	137 Å²	137	138.1 Å²	138.1	72%	0.717	72%	0.717	S	S	*	*			cis	-151.7	173.2	11.5	-125	167.9	0	0	0	108.8
1250	D	30.6	Very low	29.1	Very low	116 Å²	116	136 Å²	136	62%	0.62	72%	0.716	S	S	*	*			trans	6.1	139.4	146.7	-73.3	16	0	0	0	121.4
1251	Y	32.7	Very low	28.8	Very low	201 Å²	201	138 Å²	138	79%	0.788	72%	0.721	S	S	*	*			cis	-139.5	109.2	-2.3	-124.8	-99.1	0	0	0	106.8
1252	S	27.9	Very low	28.9	Very low	85 Å²	85	138.8 Å²	138.8	59%	0.594	72%	0.72	S	S	*	*				66.5	95.1	88.7	-63.4	0	0	0	0	114
1253	N	30	Very low	29	Very low	135 Å²	135	136.6 Å²	136.6	72%	0.722	70%	0.704	S	S	*	*				69.7	141.7	86.7	-98.9	-53.9	0	0	0	114.6
1254	P	31.5	Very low	28.9	Very low	107 Å²	107	137.5 Å²	137.5	70%	0.695	71%	0.707	S	S	*	*				-148.8	153.8	65.5	41.2	-22.7	0	0	0	119.8
1255	I	28.3	Very low	28.8	Very low	142 Å²	142	136.7 Å²	136.7	73%	0.728	70%	0.697	S	S	*	*			trans	-83.3	118	159.6	-59.1	159.6	0	0	0	109.9
1256	W	28.4	Very low	29	Very low	197 Å²	197	140.3 Å²	140.3	75%	0.746	70%	0.702	S	S	*	*			trans	-140.3	118.8	156	-74.1	85	0	0	0	107.7
1257	R	25.4	Very low	29	Very low	182 Å²	182	142 Å²	142	69%	0.687	70%	0.703	S	S	*	*				80.7	117.2	64.6	-82.2	-162.1	-175.4	-179.8	2.2	114.3
1258	N	25.5	Very low	28.8	Very low	117 Å²	117	138.1 Å²	138.1	63%	0.626	70%	0.699	S	S	*	*			trans	59.2	125.7	133.4	-63.7	23.9	0	0	0	121.8
1259	H	26.3	Very low	28.7	Very low	171 Å²	171	137 Å²	137	79%	0.792	70%	0.696	S	S	*	*			trans	66.6	163.8	162.6	-37.5	-56.7	0	0	0	113.8
1260	S	27.3	Very low	28.7	Very low	113 Å²	113	136.5 Å²	136.5	79%	0.79	69%	0.694	S	S	*	*			cis	-143.6	169.8	8	-57.2	0	0	0	0	111
1261	N	24.2	Very low	28.6	Very low	149 Å²	149	137.3 Å²	137.3	80%	0.797	70%	0.696	S	S	*	*			trans	-81.8	166.6	158.4	-71.5	-70.8	0	0	0	111.1
1262	L	26.2	Very low	28.4	Very low	122 Å²	122	135.1 Å²	135.1	64%	0.639	69%	0.692	S	S	*	*			trans	85.1	123.2	157.5	-58.4	157.8	0	0	0	120.3	G50	G50-L1262 VanDerWaalsContact N-CD2 3.32Å; G50-L1262 WeakPolarHBondContact O-CD2 3.4Å
1263	K	27	Very low	28.6	Very low	87 Å²	87	136.8 Å²	136.8	38%	0.378	70%	0.699	S	S	.	*			trans	33.4	129.7	133.7	178.7	177.6	-86.6	154.9	0	120.3	G50 T51	G50-K1263 VanDerWaalsContact C-NZ 3.26Å; G50-K1263 WeakPolarHBondContact O-CB 3.46Å; G50-K1263 VanDerWaalsContact O-CD 3.29Å; G50-K1263 WeakPolarHBondContact O-CD 3.23Å; G50-K1263 VanDerWaalsContact O-CE 3.28Å; G50-K1263 WeakPolarHBondContact O-CE 3.46Å; G50-K1263 PolarHBondContact O-NZ 3.42Å; T51-K1263 VanDerWaalsContact N-CE 3.25Å; T51-K1263 VanDerWaalsContact O-CB 3.27Å; T51-K1263 WeakPolarHBondContact O-CB 2.88Å; T51-K1263 WeakPolarHBondContact O-CE 3.03Å; T51-K1263 WeakPolarHBondContact OG1-CE 3.27Å; T51-K1263 PolarHBondContact OG1-NZ 3.17Å
1264	M	31.4	Very low	28.4	Very low	170 Å²	170	135 Å²	135	84%	0.837	70%	0.697	S	S	*	*				-155.9	145.9	122.8	-100.6	-49.4	-167.2	0	0	112.3
1265	N	29.6	Very low	28.4	Very low	91 Å²	91	137.5 Å²	137.5	49%	0.487	70%	0.703	S	S	.	*			trans	-103.3	147.6	175.2	-52.4	-57.1	0	0	0	110.5
1266	H	33	Very low	28.2	Very low	186 Å²	186	137.8 Å²	137.8	86%	0.861	71%	0.706	S	S	*	*			trans	-166.9	142.4	152.1	-113.8	-88.8	0	0	0	109.7
1267	L	28.4	Very low	28.3	Very low	120 Å²	120	135.1 Å²	135.1	63%	0.628	71%	0.705	S	S	*	*			cis	178.6	134.2	-40.9	-108.3	165.6	0	0	0	106.7
1268	L	28.6	Very low	28.4	Very low	148 Å²	148	130.8 Å²	130.8	78%	0.775	70%	0.703	S	S	*	*			trans	65.5	156.9	173.6	-82.7	69.6	0	0	0	114.8
1269	S	28.5	Very low	28.7	Very low	101 Å²	101	131.9 Å²	131.9	71%	0.706	71%	0.709	S	S	*	*			cis	-170.8	151.7	-2	38.1	0	0	0	0	109.2
1270	D	31.6	Very low	28.8	Very low	127 Å²	127	130.7 Å²	130.7	68%	0.679	71%	0.708	S	S	*	*			cis	-172.9	-173	-19.9	-146.3	-74.5	0	0	0	109.3
1271	M	29.1	Very low	29	Very low	133 Å²	133	131.2 Å²	131.2	66%	0.655	71%	0.706	S	S	*	*			trans	70.6	116.1	157.5	-63.9	-78.1	99.8	0	0	122.4
1272	H	28.9	Very low	29.4	Very low	155 Å²	155	130.4 Å²	130.4	72%	0.718	70%	0.698	S	S	*	*			trans	65.4	149.2	132.9	-76	-132.7	0	0	0	119.6
1273	T	31	Very low	29.7	Very low	119 Å²	119	126.8 Å²	126.8	73%	0.73	68%	0.68	S	S	*	*			cis	-149.6	162.8	6.6	-17.1	0	0	0	0	111.9
1274	S	25.8	Very low	30.3	Very low	99 Å²	99	126.1 Å²	126.1	69%	0.692	69%	0.687	S	S	*	*			trans	-65.7	156.4	165.8	54.7	0	0	0	0	114.9
1275	I	31	Very low	30.6	Very low	158 Å²	158	120.8 Å²	120.8	81%	0.81	66%	0.662	S	S	*	*			trans	-162.9	160.6	137.9	-103.6	151.7	0	0	0	110.9
1276	N	25.2	Very low	31	Very low	148 Å²	148	122.1 Å²	122.1	79%	0.791	67%	0.669	S	S	*	*			trans	-86	-158.5	-173.3	-54	-63.3	0	0	0	113.6
1277	I	30.2	Very low	31.3	Very low	142 Å²	142	120.4 Å²	120.4	73%	0.728	67%	0.666	S	S	*	*			trans	90.6	105.3	173.5	-53.7	155.9	0	0	0	110.2
1278	S	27.5	Very low	31.8	Very low	91 Å²	91	123 Å²	123	64%	0.636	68%	0.678	S	S	*	*				66	145.7	62.9	81.4	0	0	0	0	112.3
1279	D	31.2	Very low	32.3	Very low	140 Å²	140	123.1 Å²	123.1	75%	0.749	68%	0.68	S	S	*	*			cis	-149.3	-171.3	30.7	-88.4	-72.7	0	0	0	113.8
1280	N	28.7	Very low	33.1	Very low	146 Å²	146	126.4 Å²	126.4	78%	0.781	69%	0.69	S	S	*	*			trans	-70.6	171.9	167.2	-52.4	-76.5	0	0	0	111.2
1281	T	31.4	Very low	33.4	Very low	123 Å²	123	129 Å²	129	76%	0.755	70%	0.698	S	S	*	*				-159.9	163.5	65.6	49.2	0	0	0	0	110.9
1282	H	34.1	Very low	34	Very low	133 Å²	133	128.8 Å²	128.8	62%	0.616	70%	0.699	S	S	*	*				47.8	139.6	70.6	-135.5	-115.5	0	0	0	112	S1284	H1282-S1284 PolarHBondContact NE2-OG 2.76Å
1283	V	32.1	Very low	34.4	Very low	45 Å²	45	126.4 Å²	126.4	27%	0.273	69%	0.692	S	S	.	*			cis	-152.6	168	38.5	-151.6	0	0	0	0	108.3	S729 Y730	S729-V1283 VanDerWaalsContact C-CG1 3.48Å; S729-V1283 VanDerWaalsContact CA-CG1 3.48Å; Y730-V1283 WeakPolarHBondContact O-CG2 3.41Å
1284	S	39.6	Very low	34.6	Very low	73 Å²	73	127.1 Å²	127.1	51%	0.51	69%	0.691	S	S	.	*			cis	82	166	22.4	-12.8	0	0	0	0	117	H1282	H1282-S1284 PolarHBondContact NE2-OG 2.76Å
1285	D	37.3	Very low	35.1	Very low	59 Å²	59	130.2 Å²	130.2	32%	0.316	69%	0.692	S	S	.	*			trans	67.1	151.2	-159.5	-25.1	-59.2	0	0	0	113.1	S729 Y730	S729-D1285 WeakPolarHBondContact CA-OD1 3.07Å; S729-D1285 WeakPolarHBondContact CA-OD2 3.36Å; S729-D1285 WeakPolarHBondContact CB-OD1 3.47Å; S729-D1285 WeakPolarHBondContact CB-OD2 3.37Å; S729-D1285 PolarHBondContact OG-OD1 3.19Å; Y730-D1285 WeakPolarHBondContact CD1-OD2 3.16Å; Y730-D1285 PolarHBondContact N-OD2 3.28Å
1286	D	38.4	Very low	35.2	Very low	118 Å²	118	130.6 Å²	130.6	63%	0.631	69%	0.69	S	S	*	*			cis	-141.1	150.3	-5.8	-39.5	-104.1	0	0	0	107
1287	D	38.7	Very low	35.6	Very low	151 Å²	151	130.5 Å²	130.5	81%	0.807	70%	0.695	S	S	*	*			cis	99.2	119.1	8.8	-59.8	-54.9	0	0	0	118.3
1288	I	39.5	Very low	35.6	Very low	173 Å²	173	130.8 Å²	130.8	89%	0.887	70%	0.698	S	S	*	*			trans	-158.6	128.1	167.5	-96.5	156.3	0	0	0	112.5
1289	D	38.8	Very low	35.9	Very low	152 Å²	152	132.2 Å²	132.2	81%	0.813	71%	0.708	S	S	*	*			trans	-99.2	173.4	170.6	-66.6	-74.5	0	0	0	112.4
1290	D	44.1	Very low	35.7	Very low	169 Å²	169	135.2 Å²	135.2	90%	0.904	71%	0.709	S	S	*	*			trans	-158.8	146.4	140.6	-112.3	-31.2	0	0	0	110.8
1291	E	38.6	Very low	35.9	Very low	182 Å²	182	134.9 Å²	134.9	85%	0.85	71%	0.712	S	S	*	*			trans	-80.7	-166.8	179.7	-50.2	-168.6	101.3	0	0	111.1
1292	D	42.1	Very low	35.7	Very low	128 Å²	128	133.5 Å²	133.5	68%	0.684	71%	0.708	S	S	*	*				179.7	163.9	51.3	-168.2	12.4	0	0	0	113
1293	N	36.6	Very low	35.6	Very low	105 Å²	105	134.7 Å²	134.7	56%	0.561	72%	0.718	S	S	*	*			trans	64.2	89	151	-103.1	-80.8	0	0	0	121.7	K1295	N1293-K1295 PolarHBondContact OD1-NZ 3.38Å
1294	D	35.3	Very low	35.3	Very low	134 Å²	134	139 Å²	139	72%	0.717	74%	0.739	S	S	*	*				31.7	122.8	109.9	-104.3	-0.5	0	0	0	120.6
1295	K	37.6	Very low	34.9	Very low	165 Å²	165	143.7 Å²	143.7	72%	0.717	75%	0.753	S	S	*	*				-173.8	144	104.8	-96.9	145	-148.7	67.4	0	115.6	N1293	N1293-K1295 PolarHBondContact OD1-NZ 3.38Å
1296	Q	31.6	Very low	34.3	Very low	165 Å²	165	147.1 Å²	147.1	77%	0.771	77%	0.77	S	S	*	*			trans	-84.6	163.8	170.9	-54	171.4	4.3	0	0	111.7
1297	T	34.7	Very low	33.9	Very low	146 Å²	146	148.4 Å²	148.4	90%	0.896	77%	0.774	S	S	*	*				-172.6	152.8	119.6	19.5	0	0	0	0	113
1298	N	29.3	Very low	33.4	Very low	148 Å²	148	147.2 Å²	147.2	79%	0.791	77%	0.768	S	S	*	*			trans	-99.9	158.5	178.9	-72	-73.2	0	0	0	112.2
1299	S	34.4	Very low	32.7	Very low	121 Å²	121	145.7 Å²	145.7	85%	0.846	76%	0.762	S	S	*	*			trans	-164	146	133.9	45.2	0	0	0	0	112.7
1300	R	27.5	Very low	32.4	Very low	204 Å²	204	143.6 Å²	143.6	77%	0.77	76%	0.759	S	S	*	*			trans	-136.6	116.2	177.8	-69.6	167.4	69.2	-176.4	-0.4	109.7
1301	V	32.7	Very low	31.5	Very low	138 Å²	138	144.3 Å²	144.3	84%	0.836	75%	0.754	S	S	*	*			trans	-146.2	118	168.2	-178.3	0	0	0	0	105.8
1302	S	27	Very low	31.1	Very low	95 Å²	95	142.7 Å²	142.7	66%	0.664	75%	0.75	S	S	*	*			cis	78.7	93	32.3	-54.1	0	0	0	0	114.7
1303	L	31	Very low	30.4	Very low	158 Å²	158	140.5 Å²	140.5	83%	0.827	74%	0.736	S	S	*	*			trans	176.3	125	150.2	-111.4	58.7	0	0	0	105.3
1304	N	27.2	Very low	30.2	Very low	135 Å²	135	144 Å²	144	72%	0.722	74%	0.743	S	S	*	*				79.8	146	70.6	-72.6	-19.4	0	0	0	115.1
1305	H	29.6	Very low	29.9	Very low	172 Å²	172	139.9 Å²	139.9	80%	0.796	72%	0.724	S	S	*	*			trans	62.9	161.3	-179.4	-68	-79.4	0	0	0	115.3
1306	L	26	Very low	29.6	Very low	130 Å²	130	143 Å²	143	68%	0.681	73%	0.731	S	S	*	*			cis	166.4	171.5	-25.9	-160.6	72.3	0	0	0	103.2
1307	M	29.8	Very low	29.5	Very low	146 Å²	146	143.1 Å²	143.1	72%	0.719	73%	0.731	S	S	*	*			trans	74.3	129.8	161.5	-64.6	173.5	169.6	0	0	119.1
1308	N	28.4	Very low	29.3	Very low	126 Å²	126	143.6 Å²	143.6	67%	0.674	73%	0.727	S	S	*	*			trans	63.8	109.3	132.3	-57.4	-7.2	0	0	0	118.6
1309	N	25.7	Very low	29.3	Very low	141 Å²	141	142.7 Å²	142.7	75%	0.754	72%	0.721	S	S	*	*				88.5	155.2	78.9	-75	-25.7	0	0	0	113.4
1310	S	31	Very low	29.1	Very low	107 Å²	107	142.7 Å²	142.7	75%	0.748	71%	0.711	S	S	*	*			trans	65.3	128.8	-166.4	74.8	0	0	0	0	112.8
1311	K	25.6	Very low	29.2	Very low	184 Å²	184	141.2 Å²	141.2	80%	0.8	71%	0.713	S	S	*	*			cis	63.4	91.8	17.3	-161.3	-164.6	178.1	-171	0	114.4
1312	L	30.6	Very low	29.1	Very low	149 Å²	149	138.7 Å²	138.7	78%	0.78	70%	0.702	S	S	*	*			trans	-148	121.7	158.8	-108.5	163	0	0	0	110	Y1314	L1312-Y1314 HydrophobicContact CD2-CD2 4.35Å
1313	E	27.7	Very low	29.3	Very low	82 Å²	82	142.1 Å²	142.1	38%	0.383	71%	0.707	S	S	.	*			trans	-83.4	159.8	164	-59.1	153.3	76.8	0	0	108.5	F247	F247-E1313 HydrophobicContact CB-CB 4.38Å; F247-E1313 HydrophobicContact CB-CG 4.32Å; F247-E1313 HydrophobicContact CD1-CG 3.68Å; F247-E1313 WeakPolarHBondContact CD1-OE1 3.42Å; F247-E1313 HydrophobicContact CD2-CB 4.23Å; F247-E1313 HydrophobicContact CD2-CG 3.89Å; F247-E1313 HydrophobicContact CE1-CG 3.93Å; F247-E1313 HydrophobicContact CE2-CG 4.11Å; F247-E1313 HydrophobicContact CG-CB 4.17Å; F247-E1313 HydrophobicContact CG-CG 3.71Å; F247-E1313 WeakPolarHBondContact CG-OE1 3.48Å; F247-E1313 HydrophobicContact CZ-CG 4.15Å
1314	Y	31.6	Very low	29.3	Very low	179 Å²	179	143.5 Å²	143.5	70%	0.702	71%	0.709	S	S	*	*			trans	-156.2	94.2	154	-124.8	-73.4	0	0	0	113.2	L1312	L1312-Y1314 HydrophobicContact CD2-CD2 4.35Å
1315	S	29.5	Very low	29.5	Very low	46 Å²	46	139.8 Å²	139.8	32%	0.322	70%	0.702	S	S	.	*			trans	-73.3	155.9	163.5	-55.9	0	0	0	0	111.1	K246 F247	K246-S1315 VanDerWaalsContact C-OG 3.26Å; K246-S1315 PolarHBondContact O-OG 3.42Å; F247-S1315 PolarHBondContact N-OG 3.26Å; F247-S1315 PolarHBondContact O-OG 2.88Å
1316	R	30.6	Very low	29.6	Very low	230 Å²	230	134.6 Å²	134.6	87%	0.868	69%	0.686	S	S	*	*			trans	-146.4	110.4	153	-113.7	176.1	-175.6	-176.6	0.9	111.8
1317	H	29.7	Very low	29.8	Very low	168 Å²	168	134.3 Å²	134.3	78%	0.778	69%	0.685	S	S	*	*			trans	-71.7	159	162.2	-81.5	-92.6	0	0	0	111.1
1318	I	31	Very low	29.9	Very low	157 Å²	157	131.1 Å²	131.1	81%	0.805	67%	0.674	S	S	*	*			trans	-174.3	143.6	142.5	-97.7	147.5	0	0	0	107.5
1319	I	28.9	Very low	29.9	Very low	128 Å²	128	131.7 Å²	131.7	66%	0.656	68%	0.677	S	S	*	*			cis	-169.6	170.5	-35	-120.7	166.4	0	0	0	107.8
1320	N	29.6	Very low	30.1	Very low	121 Å²	121	132.6 Å²	132.6	65%	0.647	68%	0.68	S	S	*	*			trans	89.9	116.7	178.2	-59.3	-25.4	0	0	0	115.4
1321	Q	30.1	Very low	30	Very low	173 Å²	173	131.4 Å²	131.4	81%	0.808	67%	0.672	S	S	*	*				82.3	135.1	68.3	-75.2	179.9	83.8	0	0	111.9
1322	S	30.1	Very low	30	Very low	86 Å²	86	126.6 Å²	126.6	60%	0.601	67%	0.667	S	S	*	*			cis	-165.8	157.2	3.2	44.1	0	0	0	0	113.3
1323	E	31.9	Very low	29.9	Very low	166 Å²	166	130.9 Å²	130.9	78%	0.776	67%	0.673	S	S	*	*			trans	72.2	138.1	146.3	-71.4	164.1	-158.2	0	0	124.1
1324	H	31.8	Very low	29.9	Very low	187 Å²	187	130.7 Å²	130.7	87%	0.866	68%	0.681	S	S	*	*			trans	3.6	146.1	158.5	-48.9	-70.4	0	0	0	123.1
1325	G	31.2	Very low	29.7	Very low	57 Å²	57	128.6 Å²	128.6	59%	0.588	68%	0.681	S	S	*	*			cis	157.7	179.6	-6.8	0	0	0	0	0	115.4
1326	S	30.5	Very low	29.7	Very low	63 Å²	63	132.5 Å²	132.5	44%	0.441	70%	0.697	S	S	.	*			trans	77.4	166.6	165.8	62.2	0	0	0	0	120.9	I262 G263 T264 P265	I262-S1326 WeakPolarHBondContact O-CB 3.48Å; G263-S1326 WeakPolarHBondContact CA-OG 3Å; T264-S1326 CarbonylContact C-O 3.25Å; T264-S1326 PolarHBondContact N-OG 3.31Å; T264-S1326 CarbonylContact O-C 2.96Å; P265-S1326 WeakPolarHBondContact CA-O 3.18Å
1327	D	30	Very low	29.6	Very low	124 Å²	124	127.9 Å²	127.9	66%	0.663	69%	0.686	S	S	*	*			trans	-148.8	127.6	-173.7	68.2	-67.5	0	0	0	118.9	G263 P265	G263-D1327 VanDerWaalsContact C-N 3.26Å; G263-D1327 CarbonylContact O-C 3.45Å; G263-D1327 WeakPolarHBondContact O-CA 2.87Å; G263-D1327 PolarHBondContact O-N 3.07Å; P265-D1327 HydrophobicContact CB-CB 4.04Å
1328	V	33.1	Very low	29.6	Very low	80 Å²	80	127.7 Å²	127.7	49%	0.485	68%	0.683	S	S	.	*			trans	-126.9	131.1	-176.6	159.9	0	0	0	0	112.5	G263 T264	G263-V1328 WeakPolarHBondContact O-CG2 3.17Å; G263-V1328 PolarHBondContact O-N 3.09Å; G263-V1328 VanDerWaalsContact O-N 3.07Å; T264-V1328 HydrophobicContact CG2-CB 4.13Å; T264-V1328 HydrophobicContact CG2-CG2 3.96Å
1329	N	27.6	Very low	29.6	Very low	138 Å²	138	125 Å²	125	74%	0.738	68%	0.678	S	S	*	*			trans	-100.2	154.1	156.1	-75.7	-91.8	0	0	0	109.6
1330	L	29.8	Very low	29.7	Very low	159 Å²	159	123.1 Å²	123.1	83%	0.832	67%	0.669	S	S	*	*			trans	-167.7	137.6	130.1	-124.7	72.2	0	0	0	113.2
1331	S	28.4	Very low	29.9	Very low	83 Å²	83	121.8 Å²	121.8	58%	0.58	66%	0.662	S	S	*	*			trans	-1.1	125.2	143.8	61.6	0	0	0	0	117.7
1332	A	27.3	Very low	30.2	Very low	83 Å²	83	118.2 Å²	118.2	69%	0.686	65%	0.649	S	S	*	*				76.4	164.9	78.8	0	0	0	0	0	113.8
1333	W	26.7	Very low	30.3	Very low	239 Å²	239	116.8 Å²	116.8	91%	0.905	63%	0.634	S	S	*	*			trans	67.5	145.1	-161.9	-50.8	75.6	0	0	0	111.2
1334	S	28.1	Very low	30.2	Very low	78 Å²	78	114.3 Å²	114.3	55%	0.545	62%	0.623	S	S	.	*			cis	-154.1	143.2	10.1	-124.6	0	0	0	0	112.5
1335	L	29	Very low	30.2	Very low	135 Å²	135	111.4 Å²	111.4	71%	0.707	61%	0.609	S	S	*	*			trans	61.3	121.5	134.4	-63.6	171.5	0	0	0	122.1
1336	L	27.7	Very low	30.1	Very low	128 Å²	128	114.9 Å²	114.9	67%	0.67	61%	0.612	S	S	*	*				73.6	150.3	127.8	-58.1	177.7	0	0	0	118.2
1337	Q	29.2	Very low	30	Very low	133 Å²	133	118 Å²	118	62%	0.621	62%	0.622	S	S	*	*			cis	-159.6	165.8	4.6	-124.8	167.1	9.2	0	0	113.8
1338	F	28.8	Very low	30	Very low	164 Å²	164	118.2 Å²	118.2	72%	0.719	62%	0.624	S	S	*	*			trans	12	153	156.2	-47.5	-42.8	0	0	0	121.8
1339	S	31.7	Very low	29.8	Very low	101 Å²	101	120.6 Å²	120.6	71%	0.706	63%	0.633	S	S	*	*			cis	-141.3	152.1	27	-69.8	0	0	0	0	110.7
1340	N	31.9	Very low	29.8	Very low	87 Å²	87	120.7 Å²	120.7	47%	0.465	63%	0.634	S	S	.	*				47.4	124	78.5	-60.2	-14	0	0	0	112.5	T468 R469	T468-N1340 PolarHBondContact O-OD1 2.62Å; R469-N1340 PolarHBondContact N-OD1 2.98Å; R469-N1340 VanDerWaalsContact O-CB 3.29Å; R469-N1340 WeakPolarHBondContact O-CB 3.11Å; R469-N1340 PolarHBondContact O-ND2 3.08Å; R469-N1340 VanDerWaalsContact O-ND2 3.13Å; R469-N1340 PolarHBondContact O-OD1 2.92Å
1341	D	32.6	Very low	29.6	Very low	93 Å²	93	120.4 Å²	120.4	50%	0.497	63%	0.633	S	S	.	*				-126.6	-172.9	67.9	-70.8	-6.6	0	0	0	115	R469 N470 T471	R469-D1341 WeakPolarHBondContact CA-O 3.34Å; N470-D1341 VanDerWaalsContact O-OD1 3.13Å; T471-D1341 VanDerWaalsContact CA-OD2 3.29Å; T471-D1341 WeakPolarHBondContact CA-OD2 3.07Å; T471-D1341 PolarHBondContact N-OD1 3.34Å; T471-D1341 PolarHBondContact N-OD2 2.85Å
1342	D	36.2	Very low	29.5	Very low	99 Å²	99	122.9 Å²	122.9	53%	0.529	64%	0.64	S	S	.	*			cis	-148.8	133.8	8.8	-80.2	-63.2	0	0	0	114.2	R469 T471	R469-D1342 WeakPolarHBondContact CD-O 3.07Å; R469-D1342 WeakPolarHBondContact CG-O 3.43Å; R469-D1342 PolarHBondContact NE-O 3.42Å; T471-D1342 VanDerWaalsContact CA-OD1 3.29Å; T471-D1342 WeakPolarHBondContact CA-OD1 3.2Å; T471-D1342 HydrophobicContact CG2-CB 4.04Å; T471-D1342 WeakPolarHBondContact CG2-OD1 3.2Å; T471-D1342 PolarHBondContact N-OD1 2.93Å
1343	N	32.3	Very low	29.4	Very low	56 Å²	56	123 Å²	123	30%	0.299	64%	0.636	S	S	.	*			trans	-109	161.5	157.6	-89.4	-66.1	0	0	0	109.3	R469 N470 T471	R469-N1343 VanDerWaalsContact CD-ND2 3.3Å; R469-N1343 WeakPolarHBondContact CD-ND2 3.46Å; R469-N1343 WeakPolarHBondContact CD-OD1 3.05Å; R469-N1343 PolarHBondContact NE-OD1 3.26Å; R469-N1343 PolarHBondContact NH1-OD1 2.96Å; N470-N1343 WeakPolarHBondContact ND2-CB 3.46Å; N470-N1343 PolarHBondContact ND2-N 3.36Å; N470-N1343 WeakPolarHBondContact OD1-CB 3.37Å; N470-N1343 VanDerWaalsContact OD1-CG 3.26Å; N470-N1343 PolarHBondContact OD1-N 2.72Å; N470-N1343 PolarHBondContact OD1-ND2 2.81Å; T471-N1343 WeakPolarHBondContact CG2-O 3.46Å
1344	Q	31.4	Very low	29.4	Very low	114 Å²	114	118.2 Å²	118.2	53%	0.533	63%	0.628	S	S	.	*				-164.8	128.9	113.2	-113.9	25.6	30.3	0	0	105.6	N470	N470-Q1344 PolarHBondContact ND2-OE1 2.75Å
1345	E	30.4	Very low	29.3	Very low	125 Å²	125	121 Å²	121	58%	0.584	64%	0.637	S	S	*	*				66.3	142.3	84.4	-67.1	-168.6	165.3	0	0	113.4
1346	M	29.2	Very low	29.3	Very low	130 Å²	130	120 Å²	120	64%	0.64	63%	0.632	S	S	*	*			cis	-155.9	161.4	-3.5	-119	-179.9	-172.3	0	0	109.6
1347	I	29.7	Very low	29.4	Very low	128 Å²	128	120.2 Å²	120.2	66%	0.656	63%	0.634	S	S	*	*				37	111.5	97.7	-55.6	178.5	0	0	0	110.2
1348	D	28.5	Very low	29.4	Very low	130 Å²	130	118.7 Å²	118.7	70%	0.695	64%	0.638	S	S	*	*			cis	-169.6	-174.9	44.7	-121.6	-14.9	0	0	0	108.6
1349	N	29.3	Very low	29.5	Very low	129 Å²	129	117.3 Å²	117.3	69%	0.69	64%	0.638	S	S	*	*			cis	-153.5	169.7	2.7	-137.9	-48.9	0	0	0	110.6
1350	N	27.4	Very low	29.5	Very low	141 Å²	141	118.7 Å²	118.7	75%	0.754	64%	0.636	S	S	*	*			trans	-77	149	161.9	-94.9	-53.3	0	0	0	111.2
1351	N	26.4	Very low	29.3	Very low	153 Å²	153	120.3 Å²	120.3	82%	0.818	65%	0.649	S	S	*	*			trans	157.5	159.9	145.7	-85.2	-35.7	0	0	0	111.2
1352	N	25.5	Very low	29.1	Very low	134 Å²	134	123.2 Å²	123.2	72%	0.717	66%	0.664	S	S	*	*			cis	-172.9	162.7	-32.3	-167.2	7.9	0	0	0	107.7
1353	S	26	Very low	28.7	Very low	87 Å²	87	122.4 Å²	122.4	61%	0.608	67%	0.666	S	S	*	*			trans	63.7	134.9	171.6	-71.1	0	0	0	0	116
1354	N	26.4	Very low	28.4	Very low	137 Å²	137	127.4 Å²	127.4	73%	0.733	69%	0.691	S	S	*	*				63.1	126.4	59.1	-67.3	-26.2	0	0	0	113.7
1355	N	26.6	Very low	28.3	Very low	138 Å²	138	124.9 Å²	124.9	74%	0.738	70%	0.696	S	S	*	*			trans	67.5	151	156	-74.1	38.5	0	0	0	116.7
1356	D	28.9	Very low	28	Very low	113 Å²	113	126.8 Å²	126.8	60%	0.604	71%	0.71	S	S	*	*			cis	-144.2	146.5	9.5	-113.4	-33.2	0	0	0	113
1357	N	28.2	Very low	28	Very low	132 Å²	132	126.6 Å²	126.6	71%	0.706	72%	0.716	S	S	*	*			trans	51.2	164	140.2	-61.7	-39.8	0	0	0	123.3
1358	S	30.4	Very low	27.8	Very low	102 Å²	102	128.6 Å²	128.6	71%	0.713	72%	0.723	S	S	*	*			trans	75.9	133.5	168	80.6	0	0	0	0	116.8
1359	N	30.1	Very low	27.8	Very low	134 Å²	134	126.9 Å²	126.9	72%	0.717	72%	0.72	S	S	*	*			cis	-157.3	154.6	-12.7	-116	-18.6	0	0	0	112.3
1360	I	31.8	Very low	27.7	Very low	130 Å²	130	126.3 Å²	126.3	67%	0.667	72%	0.722	S	S	*	*			trans	43.8	98.1	141.5	-58.8	162.5	0	0	0	115.5
1361	V	28	Very low	27.7	Very low	121 Å²	121	126 Å²	126	73%	0.733	72%	0.72	S	S	*	*				66.4	139.8	58.2	-167.6	0	0	0	0	112.9
1362	L	28.1	Very low	27.8	Very low	155 Å²	155	124.6 Å²	124.6	81%	0.812	70%	0.703	S	S	*	*			trans	77.7	145.4	-179.6	-47.4	-176.7	0	0	0	115
1363	S	28.1	Very low	28	Very low	82 Å²	82	123.4 Å²	123.4	57%	0.573	70%	0.696	S	S	*	*			cis	-164.8	152.4	-11.8	-111.4	0	0	0	0	113.8
1364	I	26.9	Very low	28.4	Very low	161 Å²	161	129.1 Å²	129.1	83%	0.826	70%	0.704	S	S	*	*			trans	49.1	108.3	137.6	-55.4	163.3	0	0	0	118.6
1365	G	27.5	Very low	28.8	Very low	61 Å²	61	128.5 Å²	128.5	63%	0.629	70%	0.701	S	S	*	*				110.6	111.3	100.7	0	0	0	0	0	120.3
1366	N	25.8	Very low	29.2	Very low	165 Å²	165	129.7 Å²	129.7	88%	0.882	70%	0.702	S	S	*	*			trans	63.8	179.3	149.4	-67.5	-3	0	0	0	118.7
1367	V	27.9	Very low	29.5	Very low	126 Å²	126	129.2 Å²	129.2	76%	0.764	70%	0.699	S	S	*	*			trans	74	75.9	170	-162.7	0	0	0	0	116.3
1368	E	26.8	Very low	29.8	Very low	170 Å²	170	127 Å²	127	79%	0.794	70%	0.699	S	S	*	*				73.3	132	111.1	-152.3	155.3	-128.6	0	0	121.2
1369	S	27.2	Very low	30.1	Very low	93 Å²	93	129.5 Å²	129.5	65%	0.65	70%	0.703	S	S	*	*			trans	66.5	98.2	150.4	62.9	0	0	0	0	122
1370	T	27.5	Very low	30.2	Very low	118 Å²	118	130.3 Å²	130.3	72%	0.724	71%	0.706	S	S	*	*				70.3	131.3	126.4	64.2	0	0	0	0	122.9
1371	N	28	Very low	30.1	Very low	133 Å²	133	131.9 Å²	131.9	71%	0.711	72%	0.716	S	S	*	*			trans	65.8	138.2	146.8	-67.3	-46.6	0	0	0	117.3
1372	R	28.7	Very low	30.4	Very low	124 Å²	124	141.4 Å²	141.4	47%	0.468	74%	0.739	S	S	.	*			cis	-175.4	-173.3	8.6	-125.3	171.4	180	-158.8	-8.7	110	K176 K178	K176-R1372 PolarHBondContact O-NH1 2.7Å; K178-R1372 PolarHBondContact O-NH2 2.98Å
1373	I	30.2	Very low	30.5	Very low	109 Å²	109	140.7 Å²	140.7	56%	0.559	74%	0.735	S	S	*	*			trans	80.9	124.3	164.9	-66.6	147	0	0	0	113.5
1374	R	34.1	Very low	30.7	Very low	208 Å²	208	143.8 Å²	143.8	79%	0.785	74%	0.744	S	S	*	*			cis	85.1	146.1	34	-178.8	-162.2	-97.7	-157.9	-1.4	111.5
1375	D	33.4	Very low	30.9	Very low	124 Å²	124	142.8 Å²	142.8	66%	0.663	74%	0.739	S	S	*	*			cis	-119.9	-154.5	18.7	-125	-32.7	0	0	0	111.3
1376	E	36.3	Very low	31.1	Very low	162 Å²	162	147.6 Å²	147.6	76%	0.757	75%	0.746	S	S	*	*			cis	-141.9	167.6	12.2	-131.9	-164.2	-135.7	0	0	108.2
1377	N	35.4	Very low	31.4	Very low	104 Å²	104	146.6 Å²	146.6	56%	0.556	74%	0.737	S	S	*	*			cis	-151.1	170.2	0.5	-160.6	-29.5	0	0	0	108.6
1378	A	33.3	Very low	31.6	Very low	85 Å²	85	147.9 Å²	147.9	70%	0.702	74%	0.736	S	S	*	*			trans	-153.1	134.5	164.6	0	0	0	0	0	112.4
1379	I	36.4	Very low	32	Very low	154 Å²	154	146.4 Å²	146.4	79%	0.79	73%	0.731	S	S	*	*			trans	-142.5	134.2	174.4	-59.6	179.7	0	0	0	108.7
1380	L	33.2	Very low	32.3	Very low	151 Å²	151	150.5 Å²	150.5	79%	0.791	74%	0.738	S	S	*	*			cis	-162.3	146.9	-30.5	-152.9	135.6	0	0	0	106.5
1381	N	30.2	Very low	32.7	Very low	163 Å²	163	153.2 Å²	153.2	87%	0.872	74%	0.739	S	S	*	*			trans	-66.4	138.9	-179.5	-87.2	-2.1	0	0	0	113.1
1382	R	33.6	Very low	33.2	Very low	321 Å²	321	155 Å²	155	100%	1.211	74%	0.741	S	S	*	*			trans	-143	0	148.2	-160.4	179.8	-158.8	-146.7	4.6	110.1

Retrieved 1,382 of 1,382 residues in 1334.4 ms (Link to these results)

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