A0A5K4F133_SCHMA Loading...

Homeobox domain-containing protein

AlphaFold DB , UniProt , Accession A0A5K4F133, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 928 aa.

						>A0A5K4F133_SCHMA|A0A5K4F133
MNLTADYPISNFDNQNYTNSYGSNNSHWYYPFYEYSLNNSSSSSSSPSSSLLLSSNNPSSLVSSTSVCLPFHFYIDSYYTQTNTNDYDMNGLHYNLYSGSDSSTRSLDDTSLLLHSCHSNNNTNNESTRMEYETDYNVLLPTTITNNHLIPTSLSLSSTPTSLSSSSSSSEAGDTVSTTPSTSPIITNTKINDSTPTSSSPSMFTCWSDNLFNEFPLSNNTNINNTNNNNNIYNIEYNKLNIIDLHNNNNTFLSNFSSQFKTDHKQESKLLNPINNSLEKLNNCLFEYQQYNNSNNSIYHQSSSSSPSSSCSDVLKYPLSTSIIPDPFTVISSSSNISNKLYEQQNNLDCFNGIPKVTDTSIKRQNKYDIIDKNYHLSSTIEFNNLTTTNNNNCNIIQGNNYVTSGNHLKNQSINYQFNETNIIKKELSSCKTYLPLLIKSTKNDLNLQIDDAKIDDMPKIKMEKIYFDSMKDSSFWTDIHEELKQQQNNHYLSSTSLSCDSASRETMDHLSYYNSHNQNRNSYIEKEINSHLLHNPQDTCNTKEMNKLENNILSMPGVIHPRTTTISTTVTTVITTTTTITTTNMKSIQPYKWLQIKRQQPRQNIINNNTFTTKSNTIKKSNSSKSIVSSNSNNFLLTNNVKFQDNSEMNKISAISSLETNSSVWMSELSDHMESNQRMFNANRNYDPLPCTTINDSINNLHRDETTLNYNNERSIDCTECNNQSKYDIINNNSLSGRTNFTTRQLTELEKEFHFNRYLSRARRIEIAADLNLTETQVKIWFQNRRMKQKKRIRDKILGSTYHEMEENTTSITTSPPSSISNNLNNKINQSWYLISSQTFNNQLSLEENKQLSHINDNIITLNNNNNNQSTYYHNKPFMDYNTQGLRNRLTFHPSTVYTTTTTIASNMITDNANTNTTNNETNPMNI
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	40	Very low	32.3	Very low	243 Å²	243	153 Å²	153	100%	1.197	84%	0.838	S	S	*	*				0	128.7	0	-78.9	171.7	168.8	0	0	107.1
2	N	27.3	Very low	32.3	Very low	158 Å²	158	157.9 Å²	157.9	85%	0.845	85%	0.846	S	S	*	*			trans	-75.1	154.3	-179.9	-61.3	-13.1	0	0	0	110.5
3	L	34.3	Very low	32.1	Very low	175 Å²	175	155.8 Å²	155.8	92%	0.916	83%	0.834	S	S	*	*				-177	94	119.5	-96.2	161	0	0	0	110.2
4	T	32.2	Very low	31.8	Very low	127 Å²	127	154.8 Å²	154.8	78%	0.779	83%	0.829	S	S	*	*			trans	-76.2	144.2	159	43.4	0	0	0	0	110
5	A	36.7	Very low	31.9	Very low	98 Å²	98	154.5 Å²	154.5	81%	0.81	82%	0.821	S	S	*	*			trans	-153.4	96.6	161	0	0	0	0	0	110.3
6	D	30	Very low	31.6	Very low	143 Å²	143	151.2 Å²	151.2	77%	0.765	80%	0.803	S	S	*	*			trans	-66.1	152.8	163.7	-54.7	-78.2	0	0	0	110.9
7	Y	31.6	Very low	31.6	Very low	232 Å²	232	156.2 Å²	156.2	91%	0.91	81%	0.81	S	S	*	*			trans	-149.4	137.9	146.4	-100.1	-75.3	0	0	0	110.8
8	P	31.9	Very low	31.5	Very low	118 Å²	118	153.8 Å²	153.8	77%	0.766	80%	0.804	S	S	*	*			trans	-106	-177.6	-167.5	41.2	-35.5	0	0	0	115.1
9	I	29.7	Very low	31.3	Very low	144 Å²	144	153.7 Å²	153.7	74%	0.738	80%	0.804	S	S	*	*			trans	-54.2	143.8	-178.5	-60.4	155.9	0	0	0	113.9
10	S	33.3	Very low	31.3	Very low	110 Å²	110	152.3 Å²	152.3	77%	0.769	81%	0.807	S	S	*	*			trans	-139.4	142.6	154.9	59.2	0	0	0	0	112.3
11	N	28.1	Very low	31	Very low	135 Å²	135	156.5 Å²	156.5	72%	0.722	81%	0.814	S	S	*	*			trans	-74.9	153.1	175.8	-69	-23.6	0	0	0	111.4
12	F	31.9	Very low	30.6	Very low	212 Å²	212	148.9 Å²	148.9	93%	0.93	80%	0.797	S	S	*	*			trans	-143.4	124.3	144.7	-106.8	-79.4	0	0	0	110.8
13	D	29.8	Very low	30.6	Very low	130 Å²	130	146.2 Å²	146.2	70%	0.695	79%	0.791	S	S	*	*			trans	-80.1	157.3	176.8	-89.3	-60	0	0	0	112.6
14	N	27.6	Very low	30.4	Very low	142 Å²	142	144.8 Å²	144.8	76%	0.759	78%	0.784	S	S	*	*			trans	42.7	123.4	150	-65.6	-42.4	0	0	0	119.9
15	Q	33.6	Very low	30.2	Very low	151 Å²	151	145.9 Å²	145.9	71%	0.706	79%	0.786	S	S	*	*				-165.2	147.8	113.2	-93.1	-93.7	-4.1	0	0	110.7
16	N	28.2	Very low	29.9	Very low	101 Å²	101	146.6 Å²	146.6	54%	0.54	79%	0.785	S	S	.	*			trans	-52	147.7	-175.4	-59	-52.4	0	0	0	115.1	W207	N16-W207 WeakPolarHBondContact ND2-CZ2 3.22Å
17	Y	30.7	Very low	30	Very low	237 Å²	237	146.6 Å²	146.6	93%	0.929	78%	0.78	S	S	*	*				-156.1	150	122.2	-108	-72.4	0	0	0	111.9
18	T	30.6	Very low	29.9	Very low	112 Å²	112	146.8 Å²	146.8	69%	0.687	78%	0.779	S	S	*	*			trans	-94.3	145.9	-160.7	49.7	0	0	0	0	115.3
19	N	26.4	Very low	29.7	Very low	153 Å²	153	150.9 Å²	150.9	82%	0.818	78%	0.781	S	S	*	*			trans	39.7	109.7	146.7	-65.6	-11.3	0	0	0	119.7
20	S	31.3	Very low	29.6	Very low	124 Å²	124	154.3 Å²	154.3	87%	0.867	79%	0.786	S	S	*	*				-159.5	146.5	117.9	-89	0	0	0	0	113.9
21	Y	26.6	Very low	29.7	Very low	242 Å²	242	153.8 Å²	153.8	95%	0.949	78%	0.78	S	S	*	*			trans	-53.5	141.6	-178.7	-69.1	-103	0	0	0	114.9
22	G	29.8	Very low	29.7	Very low	82 Å²	82	156.6 Å²	156.6	85%	0.845	79%	0.786	S	S	*	*			trans	-175.3	129.8	167.6	0	0	0	0	0	111.2
23	S	29.1	Very low	29.6	Very low	102 Å²	102	156 Å²	156	71%	0.713	78%	0.779	S	S	*	*			trans	-102.5	147.1	-161.5	57.8	0	0	0	0	116.1
24	N	28.8	Very low	29.4	Very low	145 Å²	145	157 Å²	157	78%	0.775	78%	0.779	S	S	*	*			trans	71.4	149.3	142.9	-63.6	-9.3	0	0	0	122.4
25	N	29.3	Very low	29.5	Very low	150 Å²	150	160.4 Å²	160.4	80%	0.802	78%	0.783	S	S	*	*			trans	79.3	78.3	160.3	-61.3	-13.5	0	0	0	119.4	H27	N25-H27 PolarHBondContact O-N 3.33Å
26	S	29.1	Very low	29.4	Very low	113 Å²	113	158 Å²	158	79%	0.79	78%	0.783	S	S	*	*			trans	-80.4	101.8	155.7	43.3	0	0	0	0	111.7
27	H	32	Very low	29.3	Very low	143 Å²	143	161 Å²	161	66%	0.662	80%	0.799	S	S	*	*			trans	-67.8	131.8	166.4	-120.2	85.9	0	0	0	110.1	N25 Y29	N25-H27 PolarHBondContact O-N 3.33Å; H27-Y29 PolarHBondContact O-N 2.68Å
28	W	30.3	Very low	29.4	Very low	236 Å²	236	157.2 Å²	157.2	89%	0.894	79%	0.794	S	S	*	*			trans	-89.1	103.8	165.8	-79.4	86.3	0	0	0	109.3
29	Y	28.5	Very low	29.2	Very low	204 Å²	204	159.5 Å²	159.5	80%	0.8	80%	0.802	S	S	*	*			trans	-71.4	135.4	171.7	-107.5	-103	0	0	0	110.7	H27	H27-Y29 PolarHBondContact O-N 2.68Å
30	Y	27.5	Very low	29.4	Very low	217 Å²	217	157.1 Å²	157.1	85%	0.851	80%	0.798	S	S	*	*			trans	-109.9	125.5	159.9	-115.7	-86.6	0	0	0	107.3	F32	Y30-F32 PolarHBondContact O-N 2.97Å
31	P	34.4	Very low	29.3	Very low	98 Å²	98	156.3 Å²	156.3	64%	0.636	79%	0.792	S	S	*	*			trans	-78.1	123.6	-179	29.8	-32.3	0	0	0	111
32	F	27.4	Very low	29.5	Very low	195 Å²	195	149.9 Å²	149.9	86%	0.855	78%	0.782	S	S	*	*			trans	-73.9	130.3	157.9	-96.7	-100.6	0	0	0	108.6	Y30	Y30-F32 PolarHBondContact O-N 2.97Å
33	Y	29.7	Very low	29.5	Very low	198 Å²	198	150.7 Å²	150.7	78%	0.776	78%	0.775	S	S	*	*			trans	-99.8	105.8	164.2	-94.8	-85.1	0	0	0	108.8
34	E	26.2	Very low	29.6	Very low	152 Å²	152	151.1 Å²	151.1	71%	0.71	78%	0.778	S	S	*	*			trans	-75.4	132	156.7	-74.1	-176.1	128.2	0	0	108.7
35	Y	29.4	Very low	29.8	Very low	213 Å²	213	149.2 Å²	149.2	84%	0.835	78%	0.776	S	S	*	*			trans	-112	98.6	165.8	-112.1	-81.8	0	0	0	109.3	L37	Y35-L37 PolarHBondContact O-N 3.31Å
36	S	31.7	Very low	29.9	Very low	102 Å²	102	147 Å²	147	71%	0.713	77%	0.772	S	S	*	*			trans	-72.9	107.9	176.1	-58.4	0	0	0	0	110.8	N38	S36-N38 PolarHBondContact O-N 2.79Å
37	L	27.4	Very low	30.2	Very low	164 Å²	164	146.6 Å²	146.6	86%	0.859	77%	0.767	S	S	*	*			trans	-73.2	102.7	168.3	-90.1	159.8	0	0	0	110.3	Y35	Y35-L37 PolarHBondContact O-N 3.31Å
38	N	31.7	Very low	30.1	Very low	157 Å²	157	145 Å²	145	84%	0.84	77%	0.772	S	S	*	*			trans	-93.9	109.7	164.9	-98.2	-17.3	0	0	0	110.2	S36	S36-N38 PolarHBondContact O-N 2.79Å
39	N	26	Very low	30.3	Very low	159 Å²	159	139.1 Å²	139.1	85%	0.85	77%	0.767	S	S	*	*			trans	-70.4	135.4	170.1	-90.4	-35.2	0	0	0	111.4
40	S	31.3	Very low	30.4	Very low	104 Å²	104	134.2 Å²	134.2	73%	0.727	76%	0.762	S	S	*	*			trans	-147	99.1	153.8	49.4	0	0	0	0	111.6
41	S	28.5	Very low	30.7	Very low	106 Å²	106	131.1 Å²	131.1	74%	0.741	76%	0.76	S	S	*	*			trans	32.7	126.3	142.4	57.9	0	0	0	0	118.5
42	S	31.3	Very low	30.4	Very low	107 Å²	107	133.5 Å²	133.5	75%	0.748	77%	0.766	S	S	*	*				-178.1	135.8	72.1	38	0	0	0	0	114.8
43	S	30.1	Very low	30.6	Very low	99 Å²	99	131.4 Å²	131.4	69%	0.692	76%	0.763	S	S	*	*			trans	48.9	130.9	141.5	60.6	0	0	0	0	124.1
44	S	30.5	Very low	30.6	Very low	112 Å²	112	126.1 Å²	126.1	78%	0.783	76%	0.755	S	S	*	*			trans	66.8	140.1	143.5	52.6	0	0	0	0	119.4
45	S	33.5	Very low	30.8	Very low	104 Å²	104	123.3 Å²	123.3	73%	0.727	75%	0.752	S	S	*	*			cis	-160.1	131.7	1.2	44.2	0	0	0	0	113.4
46	S	32.3	Very low	31	Very low	103 Å²	103	121.2 Å²	121.2	72%	0.72	76%	0.756	S	S	*	*			trans	-8.6	168.1	136.5	52.4	0	0	0	0	120.9
47	P	34.9	Very low	30.9	Very low	106 Å²	106	123.6 Å²	123.6	69%	0.688	76%	0.76	S	S	*	*			cis	-150.7	-174	-33.1	43	-24.3	0	0	0	116.2
48	S	30	Very low	31.2	Very low	110 Å²	110	120.6 Å²	120.6	77%	0.769	75%	0.751	S	S	*	*			trans	54.6	125.9	140.8	-63.2	0	0	0	0	124.1
49	S	34.6	Very low	30.9	Very low	112 Å²	112	118.2 Å²	118.2	78%	0.783	75%	0.746	S	S	*	*				-179.8	128.1	126.8	-82	0	0	0	0	108.8
50	S	30.9	Very low	31	Very low	100 Å²	100	115.8 Å²	115.8	70%	0.699	74%	0.742	S	S	*	*			cis	117.9	157.8	27.2	67.9	0	0	0	0	109.8
51	L	33.3	Very low	30.9	Very low	153 Å²	153	117.9 Å²	117.9	80%	0.801	74%	0.744	S	S	*	*			trans	79.9	109.2	-178.7	-48	174.6	0	0	0	115.4
52	L	29	Very low	31	Very low	147 Å²	147	119.9 Å²	119.9	77%	0.77	75%	0.751	S	S	*	*			cis	90.5	139.1	32.2	-69.9	172.8	0	0	0	116.4
53	L	31.5	Very low	30.8	Very low	152 Å²	152	119.2 Å²	119.2	80%	0.796	75%	0.747	S	S	*	*			trans	65.6	149.6	166.9	-83.9	72	0	0	0	116.7
54	S	29.7	Very low	30.9	Very low	87 Å²	87	119.5 Å²	119.5	61%	0.608	75%	0.749	S	S	*	*			cis	-171.6	149.6	-23.6	47.4	0	0	0	0	109.5
55	S	28.6	Very low	30.6	Very low	93 Å²	93	120.9 Å²	120.9	65%	0.65	75%	0.753	S	S	*	*			trans	21	121	150.3	59.4	0	0	0	0	119.6
56	N	34.6	Very low	30.4	Very low	169 Å²	169	120.9 Å²	120.9	90%	0.904	75%	0.753	S	S	*	*				-161.7	128.5	112.6	-92.4	-27.6	0	0	0	113.2
57	N	28.5	Very low	30.3	Very low	152 Å²	152	122 Å²	122	81%	0.813	76%	0.755	S	S	*	*			trans	-71.8	178.6	167.7	-110.7	-19.3	0	0	0	110.6
58	P	33.9	Very low	29.8	Very low	100 Å²	100	122.5 Å²	122.5	65%	0.649	76%	0.76	S	S	*	*			cis	-138.3	170.9	-3.6	38.3	-19.6	0	0	0	116.4
59	S	26.4	Very low	29.7	Very low	107 Å²	107	123.7 Å²	123.7	75%	0.748	76%	0.757	S	S	*	*			trans	39.6	115.8	142.1	66.2	0	0	0	0	122
60	S	28.1	Very low	29.2	Very low	108 Å²	108	123.7 Å²	123.7	76%	0.755	75%	0.754	S	S	*	*				-167.6	158.6	118.2	61.5	0	0	0	0	112.3
61	L	28.9	Very low	29.2	Very low	148 Å²	148	127.6 Å²	127.6	78%	0.775	76%	0.759	S	S	*	*			trans	65.1	81.1	160.8	-60.1	165.2	0	0	0	119.5
62	V	31.2	Very low	28.8	Very low	148 Å²	148	127 Å²	127	90%	0.897	75%	0.752	S	S	*	*			trans	-129.9	80.3	135.9	-174.1	0	0	0	0	109.5
63	S	27.3	Very low	28.6	Very low	93 Å²	93	128 Å²	128	65%	0.65	75%	0.75	S	S	*	*			trans	-67.2	149.1	136.3	50.5	0	0	0	0	107.7
64	S	30.6	Very low	28.2	Very low	105 Å²	105	127.5 Å²	127.5	73%	0.734	74%	0.739	S	S	*	*			cis	-159.9	151.9	44.4	35.2	0	0	0	0	112.4
65	T	25.4	Very low	28.1	Very low	142 Å²	142	125.9 Å²	125.9	87%	0.871	72%	0.723	S	S	*	*			trans	-73.7	130.5	167.8	46.9	0	0	0	0	111.3
66	S	29.1	Very low	27.9	Very low	103 Å²	103	123.9 Å²	123.9	72%	0.72	70%	0.704	S	S	*	*			trans	-155.5	119.3	157.5	61.7	0	0	0	0	113.4
67	V	29.6	Very low	27.5	Very low	128 Å²	128	118.4 Å²	118.4	78%	0.776	68%	0.679	S	S	*	*			trans	60.5	97.7	139	-174.5	0	0	0	0	116
68	C	24.6	Very low	27.4	Very low	116 Å²	116	117.1 Å²	117.1	78%	0.784	66%	0.664	S	S	*	*				54.7	87.1	78.2	-64.8	0	0	0	0	114.9
69	L	28.4	Very low	27	Very low	135 Å²	135	122.7 Å²	122.7	71%	0.707	67%	0.673	S	S	*	*			trans	-135.6	122.1	141.2	-81.7	177.9	0	0	0	109.3	F71	L69-F71 HydrophobicContact CB-CD2 4.04Å; L69-F71 HydrophobicContact CB-CE2 3.69Å; L69-F71 HydrophobicContact CD1-CE2 3.73Å; L69-F71 HydrophobicContact CD1-CZ 4.14Å; L69-F71 HydrophobicContact CG-CE2 4.28Å; L69-F71 PolarHBondContact O-N 3.49Å
70	P	24.2	Very low	26.9	Very low	112 Å²	112	121 Å²	121	73%	0.727	66%	0.659	S	S	*	*			trans	-85.7	102.2	175	32.7	-29.8	0	0	0	109.8	H72	P70-H72 VanDerWaalsContact C-N 3.3Å; P70-H72 PolarHBondContact O-N 3.14Å; P70-H72 VanDerWaalsContact O-N 3.13Å
71	F	29.9	Very low	26.9	Very low	181 Å²	181	123.1 Å²	123.1	79%	0.794	66%	0.657	S	S	*	*			trans	-89.5	76	171.8	-78.1	-73.7	0	0	0	111.6	L69	L69-F71 HydrophobicContact CB-CD2 4.04Å; L69-F71 HydrophobicContact CB-CE2 3.69Å; L69-F71 HydrophobicContact CD1-CE2 3.73Å; L69-F71 HydrophobicContact CD1-CZ 4.14Å; L69-F71 HydrophobicContact CG-CE2 4.28Å; L69-F71 PolarHBondContact O-N 3.49Å
72	H	24.9	Very low	26.8	Very low	142 Å²	142	121.2 Å²	121.2	66%	0.657	65%	0.652	S	S	*	*			trans	-28.6	161.9	140.3	-129.9	-85.3	0	0	0	114	P70	P70-H72 VanDerWaalsContact C-N 3.3Å; P70-H72 PolarHBondContact O-N 3.14Å; P70-H72 VanDerWaalsContact O-N 3.13Å
73	F	24.8	Very low	26.6	Very low	166 Å²	166	119.8 Å²	119.8	73%	0.728	64%	0.639	S	S	*	*			trans	75.1	140.1	170.8	-58.7	-71.9	0	0	0	115.9
74	Y	24.8	Very low	26.6	Very low	143 Å²	143	121.2 Å²	121.2	56%	0.561	64%	0.644	S	S	*	*			cis	-167.1	117.5	-10.7	-167.3	-114.8	0	0	0	107.9	D76	Y74-D76 WeakPolarHBondContact CE1-OD2 3.37Å; Y74-D76 VanDerWaalsContact CZ-OD2 3.32Å; Y74-D76 PolarHBondContact OH-OD2 3.41Å
75	I	26.5	Very low	26.5	Very low	53 Å²	53	122.5 Å²	122.5	27%	0.272	64%	0.642	S	S	.	*			trans	-134.8	109.6	162.8	-63.3	173.5	0	0	0	108.2	S77 K485 Y834 S838	I75-S77 PolarHBondContact O-N 3.4Å; I75-K485 PolarHBondContact O-NZ 3.23Å; I75-Y834 HydrophobicContact CB-CD1 4.12Å; I75-Y834 HydrophobicContact CB-CE1 3.67Å; I75-Y834 HydrophobicContact CD1-CD1 3.57Å; I75-Y834 HydrophobicContact CD1-CE1 4.05Å; I75-Y834 HydrophobicContact CG1-CD1 4.41Å; I75-Y834 HydrophobicContact CG1-CE1 4.44Å; I75-Y834 HydrophobicContact CG2-CD1 3.73Å; I75-Y834 HydrophobicContact CG2-CE1 3.28Å; I75-S838 WeakPolarHBondContact CD1-OG 3.46Å; I75-S838 WeakPolarHBondContact CG1-OG 3.37Å; I75-S838 WeakPolarHBondContact CG2-OG 3.24Å
76	D	25.5	Very low	26.6	Very low	50 Å²	50	121.6 Å²	121.6	27%	0.267	63%	0.632	S	S	.	*			trans	-73.2	119.1	171.7	-71.9	-36.6	0	0	0	110.5	Y74 Y78	Y74-D76 WeakPolarHBondContact CE1-OD2 3.37Å; Y74-D76 VanDerWaalsContact CZ-OD2 3.32Å; Y74-D76 PolarHBondContact OH-OD2 3.41Å; D76-Y78 HydrophobicContact CB-CD2 3.31Å; D76-Y78 HydrophobicContact CB-CE2 3.95Å; D76-Y78 HydrophobicContact CB-CG 3.92Å; D76-Y78 PolarHBondContact O-N 3.37Å; D76-Y78 WeakPolarHBondContact OD2-CD2 3.37Å; D76-Y78 WeakPolarHBondContact OD2-CE2 3.41Å
77	S	25	Very low	26.6	Very low	54 Å²	54	126.3 Å²	126.3	38%	0.378	64%	0.636	S	S	.	*			trans	-70.9	51.5	150.3	54.3	0	0	0	0	110.1	I75 Y79	I75-S77 PolarHBondContact O-N 3.4Å; S77-Y79 VanDerWaalsContact C-N 3.3Å; S77-Y79 PolarHBondContact O-N 3.32Å
78	Y	26.6	Very low	26.7	Very low	125 Å²	125	127.7 Å²	127.7	49%	0.49	64%	0.639	S	S	.	*			trans	-71.1	93.8	175	-96.7	-48.9	0	0	0	109.4	D76 T80	D76-Y78 HydrophobicContact CB-CD2 3.31Å; D76-Y78 HydrophobicContact CB-CE2 3.95Å; D76-Y78 HydrophobicContact CB-CG 3.92Å; D76-Y78 PolarHBondContact O-N 3.37Å; D76-Y78 WeakPolarHBondContact OD2-CD2 3.37Å; D76-Y78 WeakPolarHBondContact OD2-CE2 3.41Å; Y78-T80 HydrophobicContact CD1-CG2 3.8Å; Y78-T80 HydrophobicContact CG-CG2 3.88Å; Y78-T80 PolarHBondContact O-N 2.84Å
79	Y	25.7	Very low	26.9	Very low	217 Å²	217	130.3 Å²	130.3	85%	0.851	64%	0.642	S	S	*	*			trans	-64.1	56.7	147.6	-122.8	-84.8	0	0	0	109.1	S77 Q81	S77-Y79 VanDerWaalsContact C-N 3.3Å; S77-Y79 PolarHBondContact O-N 3.32Å; Y79-Q81 PolarHBondContact O-N 3.5Å
80	T	25.1	Very low	27	Very low	71 Å²	71	132.1 Å²	132.1	44%	0.436	65%	0.652	S	S	.	*			trans	-68.8	87.8	167.4	40.9	0	0	0	0	107.7	Y78 T82	Y78-T80 HydrophobicContact CD1-CG2 3.8Å; Y78-T80 HydrophobicContact CG-CG2 3.88Å; Y78-T80 PolarHBondContact O-N 2.84Å; T80-T82 PolarHBondContact O-N 2.64Å
81	Q	26.6	Very low	27.2	Very low	153 Å²	153	130 Å²	130	72%	0.715	65%	0.65	S	S	*	*			trans	-56.5	83.4	153.6	-175	170.1	31.5	0	0	107.3	Y79 N83	Y79-Q81 PolarHBondContact O-N 3.5Å; Q81-N83 PolarHBondContact O-N 2.69Å
82	T	26.5	Very low	27.3	Very low	109 Å²	109	128.9 Å²	128.9	67%	0.669	65%	0.651	S	S	*	*			trans	-69.9	74	169.5	41.7	0	0	0	0	108.8	T80 T84	T80-T82 PolarHBondContact O-N 2.64Å; T82-T84 PolarHBondContact O-N 2.85Å
83	N	26.7	Very low	27.4	Very low	118 Å²	118	131.1 Å²	131.1	63%	0.631	66%	0.662	S	S	*	*			trans	-63.4	73.5	145.5	-83.1	-7	0	0	0	107.5	Q81 N85	Q81-N83 PolarHBondContact O-N 2.69Å; N83-N85 PolarHBondContact O-N 2.68Å
84	T	29.2	Very low	27.7	Very low	122 Å²	122	132.9 Å²	132.9	75%	0.748	67%	0.665	S	S	*	*			trans	-65.9	85.2	145.6	53.2	0	0	0	0	105.8	T82 D86	T82-T84 PolarHBondContact O-N 2.85Å; T84-D86 PolarHBondContact O-N 3.16Å
85	N	27.8	Very low	28	Very low	132 Å²	132	132.9 Å²	132.9	71%	0.706	68%	0.675	S	S	*	*			trans	-54	131	146.8	-66.4	-36.3	0	0	0	106.2	N83	N83-N85 PolarHBondContact O-N 2.68Å
86	D	28	Very low	28.1	Very low	124 Å²	124	138.9 Å²	138.9	66%	0.663	71%	0.706	S	S	*	*			trans	-173.6	109.7	142.5	-94.6	-10.4	0	0	0	107.2	T84	T84-D86 PolarHBondContact O-N 3.16Å
87	Y	27.9	Very low	28.3	Very low	202 Å²	202	147 Å²	147	79%	0.792	74%	0.735	S	S	*	*			trans	47.7	132.1	156.4	-44.5	-78.7	0	0	0	118.5
88	D	31.5	Very low	28.4	Very low	157 Å²	157	150.1 Å²	150.1	84%	0.84	76%	0.757	S	S	*	*			cis	-139.1	156.1	33	-95.4	-44.6	0	0	0	114.3
89	M	28.8	Very low	28.6	Very low	171 Å²	171	147.5 Å²	147.5	84%	0.842	77%	0.768	S	S	*	*			trans	-110.9	119.6	165.2	-86.3	-78.9	-154.3	0	0	109.2
90	N	31.1	Very low	28.6	Very low	173 Å²	173	142.5 Å²	142.5	93%	0.925	77%	0.765	S	S	*	*			trans	167.7	127.4	148.6	-85.6	-27.8	0	0	0	108.3
91	G	29.3	Very low	28.8	Very low	66 Å²	66	147.3 Å²	147.3	68%	0.68	79%	0.788	S	S	*	*			cis	178.9	-155.3	-2.6	0	0	0	0	0	112
92	L	31.8	Very low	28.7	Very low	158 Å²	158	145.4 Å²	145.4	83%	0.827	79%	0.791	S	S	*	*			trans	68.3	84.9	169.4	-58.1	175.7	0	0	0	117.4	Y94	L92-Y94 HydrophobicContact CD2-CD2 4.35Å; L92-Y94 HydrophobicContact CD2-CE2 4.23Å
93	H	27	Very low	29	Very low	190 Å²	190	145.1 Å²	145.1	88%	0.88	79%	0.794	S	S	*	*			trans	-108	116.1	149.1	-152.3	-111.2	0	0	0	107.3
94	Y	31.5	Very low	29	Very low	203 Å²	203	145.7 Å²	145.7	80%	0.796	80%	0.802	S	S	*	*			trans	-99.1	148	175	-110.7	-85.5	0	0	0	110.8	L92	L92-Y94 HydrophobicContact CD2-CD2 4.35Å; L92-Y94 HydrophobicContact CD2-CE2 4.23Å
95	N	30.6	Very low	29.1	Very low	142 Å²	142	151.9 Å²	151.9	76%	0.759	81%	0.811	S	S	*	*			trans	-69.4	135.3	-166	-62.7	-54.8	0	0	0	114	Y97	N95-Y97 PolarHBondContact O-N 3.21Å
96	L	28.8	Very low	29	Very low	179 Å²	179	150.4 Å²	150.4	94%	0.937	81%	0.812	S	S	*	*			trans	-76.7	108.6	153.7	-86.1	165.1	0	0	0	108.6
97	Y	29	Very low	29.3	Very low	220 Å²	220	151.6 Å²	151.6	86%	0.863	82%	0.817	S	S	*	*			trans	-84.1	116.8	170.1	-146.2	-93.7	0	0	0	108.4	N95 G99	N95-Y97 PolarHBondContact O-N 3.21Å; Y97-G99 PolarHBondContact O-N 3.4Å; Y97-G99 VanDerWaalsContact O-N 3.14Å
98	S	27.9	Very low	29.6	Very low	120 Å²	120	148.2 Å²	148.2	84%	0.839	81%	0.813	S	S	*	*			trans	-82	92.1	176.2	50.5	0	0	0	0	110.1
99	G	29.2	Very low	29.7	Very low	70 Å²	70	147.2 Å²	147.2	72%	0.722	81%	0.807	S	S	*	*			trans	-81.7	120.9	164.8	0	0	0	0	0	110.2	Y97	Y97-G99 PolarHBondContact O-N 3.4Å; Y97-G99 VanDerWaalsContact O-N 3.14Å
100	S	26	Very low	30.1	Very low	113 Å²	113	145 Å²	145	79%	0.79	80%	0.803	S	S	*	*			trans	-78.8	136.4	166.5	42.1	0	0	0	0	109
101	D	29.6	Very low	30.2	Very low	171 Å²	171	141 Å²	141	91%	0.914	79%	0.789	S	S	*	*			trans	-156.8	142.5	148.8	-104.3	-33.9	0	0	0	111.4
102	S	25.8	Very low	30.3	Very low	113 Å²	113	144.9 Å²	144.9	79%	0.79	79%	0.793	S	S	*	*			trans	-121.4	115.2	-167.9	55.8	0	0	0	0	111.9
103	S	30.9	Very low	30.4	Very low	104 Å²	104	144 Å²	144	73%	0.727	79%	0.789	S	S	*	*			trans	-163.9	101.5	163.2	56.1	0	0	0	0	109.8
104	T	27.9	Very low	30.7	Very low	129 Å²	129	141 Å²	141	79%	0.791	78%	0.778	S	S	*	*				49	106.1	94.6	65.4	0	0	0	0	115.3
105	R	30	Very low	30.8	Very low	252 Å²	252	138.5 Å²	138.5	95%	0.951	77%	0.774	S	S	*	*				-170.1	143.7	120.2	-103.8	165.2	-178.9	-141.2	-2.3	112
106	S	27.1	Very low	30.8	Very low	102 Å²	102	136 Å²	136	71%	0.713	77%	0.767	S	S	*	*			trans	-96.9	-161.3	175.4	60.3	0	0	0	0	110.7
107	L	34.4	Very low	31	Very low	148 Å²	148	132.8 Å²	132.8	78%	0.775	76%	0.759	S	S	*	*			trans	89.7	137.7	-179.8	-51.8	164.9	0	0	0	113.1
108	D	32.8	Very low	31.1	Very low	132 Å²	132	130.5 Å²	130.5	71%	0.706	76%	0.756	S	S	*	*			cis	-165.4	165.4	-28.6	-112.5	-4.7	0	0	0	106.6
109	D	35	Very low	31.4	Very low	136 Å²	136	129.4 Å²	129.4	73%	0.727	75%	0.748	S	S	*	*			trans	148.4	107.5	133.2	-83.7	-23.5	0	0	0	114.8
110	T	36.1	Very low	31.4	Very low	123 Å²	123	132.8 Å²	132.8	76%	0.755	75%	0.749	S	S	*	*			trans	64.1	140	134	71	0	0	0	0	119.7
111	S	32.9	Very low	31.8	Very low	90 Å²	90	133.2 Å²	133.2	63%	0.629	74%	0.743	S	S	*	*			cis	-169.9	145.4	7.2	-118.7	0	0	0	0	112.2
112	L	32.9	Very low	31.9	Very low	147 Å²	147	131.5 Å²	131.5	77%	0.77	73%	0.734	S	S	*	*			trans	65.9	144.9	147.4	-55.9	172.1	0	0	0	118
113	L	33	Very low	32.2	Very low	141 Å²	141	131 Å²	131	74%	0.738	73%	0.726	S	S	*	*			cis	-167	161	-5.4	-94.4	165.8	0	0	0	105.6
114	L	32.7	Very low	32.2	Very low	125 Å²	125	132.4 Å²	132.4	65%	0.654	73%	0.725	S	S	*	*			cis	-162.9	160.8	-8.2	173.8	59.1	0	0	0	109.4
115	H	34.3	Very low	32.3	Very low	152 Å²	152	132.6 Å²	132.6	70%	0.704	72%	0.722	S	S	*	*			trans	78.6	146.1	174	-67.8	-41.8	0	0	0	118.1
116	S	31	Very low	32.4	Very low	88 Å²	88	129.4 Å²	129.4	62%	0.615	72%	0.717	S	S	*	*			cis	93	128.1	21.8	-47	0	0	0	0	113.3
117	C	33	Very low	32.4	Very low	113 Å²	113	130.1 Å²	130.1	76%	0.764	72%	0.722	S	S	*	*			cis	-143.2	142.5	35.2	-70.4	0	0	0	0	111.9
118	H	31.1	Very low	32.3	Very low	172 Å²	172	130.3 Å²	130.3	80%	0.796	73%	0.73	S	S	*	*				54.1	143.1	91.9	-65	51.3	0	0	0	115
119	S	32.8	Very low	32	Very low	97 Å²	97	133.1 Å²	133.1	68%	0.678	73%	0.731	S	S	*	*			cis	-162.3	139.3	14	-115.2	0	0	0	0	108.1
120	N	31.2	Very low	31.9	Very low	140 Å²	140	134.9 Å²	134.9	75%	0.749	74%	0.737	S	S	*	*				102	154.2	70.1	-126.7	4.8	0	0	0	115
121	N	33.5	Very low	31.5	Very low	122 Å²	122	135 Å²	135	65%	0.652	73%	0.729	S	S	*	*			trans	82.1	112.9	163.1	-61.5	-11.6	0	0	0	118.3
122	N	31.1	Very low	31.5	Very low	136 Å²	136	140.2 Å²	140.2	73%	0.727	74%	0.736	S	S	*	*				86.7	143.7	75.7	-76.4	-7.3	0	0	0	112
123	T	31.9	Very low	31.5	Very low	102 Å²	102	141.2 Å²	141.2	63%	0.626	74%	0.737	S	S	*	*			cis	-175.7	158.1	6.7	19.1	0	0	0	0	109.8
124	N	31.9	Very low	31.5	Very low	133 Å²	133	139.5 Å²	139.5	71%	0.711	73%	0.733	S	S	*	*			trans	66.7	160	152.7	-57.4	-8.5	0	0	0	117.5
125	N	28.5	Very low	31.3	Very low	133 Å²	133	139.5 Å²	139.5	71%	0.711	73%	0.733	S	S	*	*			cis	-164.2	-175.4	-18.3	-104.9	-9.9	0	0	0	108.9
126	E	32.6	Very low	31.3	Very low	185 Å²	185	143.5 Å²	143.5	86%	0.864	74%	0.744	S	S	*	*			trans	74.7	117.5	166.7	-61.6	170.8	165.8	0	0	115.8
127	S	26.5	Very low	31.3	Very low	117 Å²	117	146 Å²	146	82%	0.818	75%	0.75	S	S	*	*			cis	76.4	96.8	37	-60.1	0	0	0	0	116.7
128	T	33.3	Very low	31.4	Very low	153 Å²	153	147.2 Å²	147.2	94%	0.939	75%	0.754	S	S	*	*			trans	-142.9	130.2	149.1	37.5	0	0	0	0	111.1
129	R	26.5	Very low	31.5	Very low	190 Å²	190	146.4 Å²	146.4	72%	0.717	75%	0.754	S	S	*	*			trans	-100.6	144.3	178.2	162.8	-172.6	178.2	169.6	3.3	109	E131	R129-E131 IonicContact CZ-OE1 2.65Å; R129-E131 IonicContact CZ-OE2 2.75Å; R129-E131 VanDerWaalsContact NE-CD 3.27Å; R129-E131 IonicContact NE-OE1 2.67Å; R129-E131 PolarHBondContact NE-OE1 3.33Å; R129-E131 IonicContact NE-OE2 2.68Å; R129-E131 PolarHBondContact NE-OE2 3.21Å; R129-E131 IonicContact NH2-OE1 2.97Å; R129-E131 PolarHBondContact NH2-OE1 3.2Å; R129-E131 IonicContact NH2-OE2 2.68Å; R129-E131 PolarHBondContact NH2-OE2 2.65Å
130	M	33.7	Very low	31.5	Very low	174 Å²	174	148.4 Å²	148.4	86%	0.857	76%	0.757	S	S	*	*			trans	-140.8	130.6	153.5	-78.6	-145.6	-66.1	0	0	110.1
131	E	26.8	Very low	31.8	Very low	126 Å²	126	147.1 Å²	147.1	59%	0.589	76%	0.756	S	S	*	*			trans	-115.9	149.7	172.5	-69.6	157.1	144.8	0	0	108.9	R129	R129-E131 IonicContact CZ-OE1 2.65Å; R129-E131 IonicContact CZ-OE2 2.75Å; R129-E131 VanDerWaalsContact NE-CD 3.27Å; R129-E131 IonicContact NE-OE1 2.67Å; R129-E131 PolarHBondContact NE-OE1 3.33Å; R129-E131 IonicContact NE-OE2 2.68Å; R129-E131 PolarHBondContact NE-OE2 3.21Å; R129-E131 IonicContact NH2-OE1 2.97Å; R129-E131 PolarHBondContact NH2-OE1 3.2Å; R129-E131 IonicContact NH2-OE2 2.68Å; R129-E131 PolarHBondContact NH2-OE2 2.65Å
132	Y	34.1	Very low	31.7	Very low	198 Å²	198	146.1 Å²	146.1	78%	0.776	76%	0.755	S	S	*	*			trans	-147.2	117.2	153.6	-77.2	-83.6	0	0	0	103.7
133	E	31.2	Very low	31.7	Very low	168 Å²	168	144.9 Å²	144.9	79%	0.785	75%	0.752	S	S	*	*				54.3	130.9	74.7	-67.4	-160.8	151.8	0	0	112.3
134	T	33.2	Very low	31.7	Very low	106 Å²	106	146.4 Å²	146.4	65%	0.65	76%	0.755	S	S	*	*			cis	-164.5	157.3	7.7	10	0	0	0	0	110.4
135	D	29.5	Very low	31.9	Very low	124 Å²	124	146.1 Å²	146.1	66%	0.663	76%	0.758	S	S	*	*			trans	47	132.4	146.3	-57.3	-24.9	0	0	0	123.2
136	Y	33.9	Very low	32.2	Very low	236 Å²	236	145.7 Å²	145.7	93%	0.925	76%	0.756	S	S	*	*				-163.4	128	101.6	-110.1	-79.1	0	0	0	112
137	N	30.4	Very low	32.4	Very low	142 Å²	142	143.2 Å²	143.2	76%	0.759	75%	0.749	S	S	*	*			trans	-85	162.8	175.5	-72.7	-72.6	0	0	0	112.2
138	V	35.2	Very low	32.9	Very low	137 Å²	137	144.6 Å²	144.6	83%	0.83	74%	0.742	S	S	*	*			trans	153.4	132.7	155.7	153	0	0	0	0	108.1
139	L	33.3	Very low	33.1	Very low	155 Å²	155	144.2 Å²	144.2	81%	0.812	73%	0.733	S	S	*	*			cis	-164.9	145.8	-24.1	-126.5	153.5	0	0	0	106.9
140	L	33.9	Very low	33.5	Very low	140 Å²	140	142 Å²	142	73%	0.733	73%	0.734	S	S	*	*			trans	-83.7	163.2	174.6	-117.7	81.4	0	0	0	112.1	T142	L140-T142 HydrophobicContact CB-CG2 4.39Å; L140-T142 HydrophobicContact CD2-CG2 3.98Å
141	P	36.5	Very low	33.6	Very low	113 Å²	113	139.2 Å²	139.2	73%	0.734	73%	0.729	S	S	*	*				-135.8	135.1	112.7	36.7	-25.4	0	0	0	111.5
142	T	30.9	Very low	33.9	Very low	101 Å²	101	138.5 Å²	138.5	62%	0.62	73%	0.734	S	S	*	*				56.1	130.9	57.2	75.3	0	0	0	0	111.7	L140	L140-T142 HydrophobicContact CB-CG2 4.39Å; L140-T142 HydrophobicContact CD2-CG2 3.98Å
143	T	32	Very low	33.8	Very low	110 Å²	110	133.6 Å²	133.6	68%	0.675	73%	0.728	S	S	*	*			cis	-176	153.3	49.9	32	0	0	0	0	112.3
144	I	31.6	Very low	34	Very low	133 Å²	133	133.5 Å²	133.5	68%	0.682	73%	0.732	S	S	*	*			trans	60.1	124.5	136.3	-57.9	163.5	0	0	0	117.8
145	T	35.3	Very low	33.8	Very low	127 Å²	127	133.2 Å²	133.2	78%	0.779	74%	0.735	S	S	*	*				-150.1	129.1	66.7	46.5	0	0	0	0	111.7
146	N	34.7	Very low	34.1	Very low	125 Å²	125	135.2 Å²	135.2	67%	0.668	74%	0.744	S	S	*	*				88.6	132.9	67	-86.5	1.6	0	0	0	116.5
147	N	37.9	Very low	34	Very low	133 Å²	133	127.9 Å²	127.9	71%	0.711	73%	0.728	S	S	*	*			trans	80.3	139.5	156.9	-56.3	-9.3	0	0	0	118.1
148	H	37.8	Very low	34.3	Very low	146 Å²	146	125.6 Å²	125.6	68%	0.676	72%	0.723	S	S	*	*			cis	-167.1	156.1	-7.6	-130.6	-72.3	0	0	0	110.8
149	L	36.4	Very low	34.4	Very low	145 Å²	145	125.1 Å²	125.1	76%	0.759	72%	0.72	S	S	*	*			trans	72.6	129.1	157.6	-56.6	162.3	0	0	0	117.7
150	I	35.7	Very low	34.8	Very low	144 Å²	144	122.9 Å²	122.9	74%	0.738	72%	0.715	S	S	*	*			cis	68.8	137.5	26.9	-52.3	179.8	0	0	0	112.3
151	P	36.3	Very low	34.9	Very low	115 Å²	115	122.6 Å²	122.6	75%	0.747	72%	0.719	S	S	*	*			cis	-119.4	168.4	15.2	13.4	13.5	0	0	0	115
152	T	33	Very low	34.7	Very low	111 Å²	111	121.8 Å²	121.8	68%	0.681	72%	0.717	S	S	*	*			cis	86	118.7	45.2	-36.1	0	0	0	0	115.1
153	S	32.1	Very low	35	Very low	95 Å²	95	124.8 Å²	124.8	66%	0.664	73%	0.728	S	S	*	*			trans	55.4	131.7	153.4	63.5	0	0	0	0	121.5
154	L	34.4	Very low	35.2	Very low	165 Å²	165	123.7 Å²	123.7	86%	0.864	73%	0.725	S	S	*	*				-177.9	140.5	94.8	-92.5	167.1	0	0	0	112.1
155	S	29.5	Very low	35.5	Very low	101 Å²	101	122.7 Å²	122.7	71%	0.706	73%	0.73	S	S	*	*			trans	-106	139.8	170.4	55.1	0	0	0	0	110.2
156	L	34.5	Very low	35.5	Very low	165 Å²	165	121.5 Å²	121.5	86%	0.864	73%	0.726	S	S	*	*			trans	163.6	145.2	162.3	-88.9	143.4	0	0	0	105.4
157	S	32.2	Very low	35.6	Very low	83 Å²	83	120.5 Å²	120.5	58%	0.58	73%	0.729	S	S	*	*			cis	169.6	171.4	-13.1	51.1	0	0	0	0	105.3
158	S	36.4	Very low	35.7	Very low	93 Å²	93	119.5 Å²	119.5	65%	0.65	73%	0.732	S	S	*	*			trans	60.9	108.9	163.5	42.2	0	0	0	0	118.5
159	T	37.2	Very low	35.7	Very low	127 Å²	127	118.3 Å²	118.3	78%	0.779	74%	0.74	S	S	*	*				65.2	152.8	72.9	64.8	0	0	0	0	115.7
160	P	41.7	Very low	35.7	Very low	108 Å²	108	116.5 Å²	116.5	70%	0.701	74%	0.74	S	S	*	*			cis	-142.6	-153.9	-32.3	37.8	-16.7	0	0	0	112.9
161	T	35.7	Very low	35.9	Very low	134 Å²	134	118.7 Å²	118.7	82%	0.822	75%	0.747	S	S	*	*			trans	95.4	142.3	149.6	13.8	0	0	0	0	121.9
162	S	34.2	Very low	36	Very low	97 Å²	97	118.2 Å²	118.2	68%	0.678	75%	0.753	S	S	*	*			trans	-89.4	164.1	-174	51.8	0	0	0	0	115
163	L	36.7	Very low	36.3	Very low	163 Å²	163	116.2 Å²	116.2	85%	0.853	76%	0.755	S	S	*	*			trans	176.1	110.4	145.3	-90.1	147.7	0	0	0	106.5
164	S	36.5	Very low	36.8	Very low	88 Å²	88	119 Å²	119	62%	0.615	76%	0.762	S	S	*	*				85.4	133	76.3	72	0	0	0	0	115.9
165	S	37.2	Very low	37.1	Very low	112 Å²	112	117.4 Å²	117.4	78%	0.783	76%	0.759	S	S	*	*			trans	63.5	151.1	157	57.8	0	0	0	0	118.9
166	S	35.3	Very low	37.6	Very low	102 Å²	102	118.9 Å²	118.9	71%	0.713	76%	0.764	S	S	*	*			cis	-176.9	-176.1	-12.5	51.3	0	0	0	0	110
167	S	37.9	Very low	37.7	Very low	104 Å²	104	115.5 Å²	115.5	73%	0.727	75%	0.754	S	S	*	*			trans	79.5	116.9	164.8	81.4	0	0	0	0	115.7
168	S	38.4	Very low	38	Very low	111 Å²	111	117 Å²	117	78%	0.776	76%	0.76	S	S	*	*				98.6	148.2	73.6	71.4	0	0	0	0	110.6
169	S	38.9	Very low	38.3	Very low	121 Å²	121	118.8 Å²	118.8	85%	0.846	77%	0.767	S	S	*	*			cis	-157.6	-178.7	17.3	45.3	0	0	0	0	111.8
170	S	35.6	Very low	38.5	Very low	107 Å²	107	118 Å²	118	75%	0.748	76%	0.764	S	S	*	*			trans	-113.5	154	-171.6	53.7	0	0	0	0	115.3
171	E	39.9	Very low	38.1	Very low	190 Å²	190	117.9 Å²	117.9	89%	0.888	77%	0.765	S	S	*	*			trans	-169.5	125.4	155.3	-102.7	155.5	-170.5	0	0	107.5
172	A	38.8	Very low	38.1	Very low	106 Å²	106	117.7 Å²	117.7	88%	0.876	76%	0.764	S	S	*	*				65.4	129.7	73.4	0	0	0	0	0	113.9
173	G	39.3	Very low	38.2	Very low	69 Å²	69	118.1 Å²	118.1	71%	0.711	77%	0.768	S	S	*	*			cis	-166.9	-152.1	2.8	0	0	0	0	0	113
174	D	42.3	Very low	38.4	Very low	154 Å²	154	116.7 Å²	116.7	82%	0.824	77%	0.768	S	S	*	*			trans	79.6	98.3	176.9	-57.5	-17.7	0	0	0	118.4
175	T	40.1	Very low	38	Very low	131 Å²	131	119.4 Å²	119.4	80%	0.804	77%	0.774	S	S	*	*				63.5	130.1	89.2	70	0	0	0	0	115.1
176	V	40.9	Very low	37.7	Very low	132 Å²	132	120.8 Å²	120.8	80%	0.8	77%	0.771	S	S	*	*				-153.8	162.8	52.6	166.2	0	0	0	0	112.9
177	S	37.2	Very low	37.7	Very low	93 Å²	93	122.2 Å²	122.2	65%	0.65	78%	0.776	S	S	*	*			trans	-58.5	162.4	178	52.3	0	0	0	0	116.7
178	T	38.7	Very low	37.2	Very low	115 Å²	115	124.3 Å²	124.3	71%	0.706	78%	0.779	S	S	*	*				-165.9	119.8	63.2	43.2	0	0	0	0	117.1
179	T	41.7	Very low	37	Very low	131 Å²	131	124.9 Å²	124.9	80%	0.804	78%	0.778	S	S	*	*				59.8	155.3	125.4	52.9	0	0	0	0	123.8
180	P	40.5	Very low	36.7	Very low	110 Å²	110	128.1 Å²	128.1	71%	0.714	78%	0.776	S	S	*	*				-141	-167.2	-124.5	47.1	-30	0	0	0	117.9
181	S	33.8	Very low	36.8	Very low	105 Å²	105	130 Å²	130	73%	0.734	78%	0.777	S	S	*	*			trans	72.9	154.3	156.9	80.3	0	0	0	0	117.4
182	T	36.7	Very low	36.6	Very low	130 Å²	130	127.3 Å²	127.3	80%	0.798	77%	0.769	S	S	*	*			cis	-151.3	146	22.7	9.7	0	0	0	0	111.7
183	S	34.9	Very low	36.3	Very low	107 Å²	107	128.9 Å²	128.9	75%	0.748	76%	0.762	S	S	*	*			trans	-87.1	170.2	151.2	-45.4	0	0	0	0	109.5
184	P	41.3	Very low	36.2	Very low	133 Å²	133	130.8 Å²	130.8	86%	0.864	77%	0.765	S	S	*	*				-154.6	-172.3	96.1	40.1	-20.2	0	0	0	116.3
185	I	29.5	Very low	35.8	Very low	145 Å²	145	130 Å²	130	74%	0.744	77%	0.765	S	S	*	*			trans	-122.9	139.9	-168.4	-90.1	173.1	0	0	0	110
186	I	29.5	Very low	35.3	Very low	141 Å²	141	129 Å²	129	72%	0.723	76%	0.761	S	S	*	*			trans	46.9	123.4	153.6	-55.4	165.8	0	0	0	119.5
187	T	35.2	Very low	34.8	Very low	131 Å²	131	129.8 Å²	129.8	80%	0.804	77%	0.767	S	S	*	*				-179.2	123.2	113.4	37	0	0	0	0	114.3
188	N	27.7	Very low	34.5	Very low	149 Å²	149	130 Å²	130	80%	0.797	77%	0.768	S	S	*	*			trans	3.9	157.1	149.1	-77.5	-18.6	0	0	0	125.2
189	T	34.4	Very low	34.1	Very low	122 Å²	122	129 Å²	129	75%	0.748	77%	0.765	S	S	*	*			trans	95.3	103.5	143.5	31	0	0	0	0	122.6
190	K	33.6	Very low	33.5	Very low	189 Å²	189	128.1 Å²	128.1	82%	0.822	77%	0.765	S	S	*	*				69.5	109.1	124	-93.8	-176.1	178.3	-179.2	0	120.2
191	I	36.6	Very low	33.2	Very low	148 Å²	148	128.9 Å²	128.9	76%	0.759	77%	0.77	S	S	*	*				175.3	141.9	99.2	-89.3	148.9	0	0	0	110.8
192	N	34.9	Very low	33	Very low	133 Å²	133	129.7 Å²	129.7	71%	0.711	78%	0.776	S	S	*	*			trans	-3	153.3	161.1	-44.5	-5.2	0	0	0	119.7
193	D	34.1	Very low	32.5	Very low	139 Å²	139	131.5 Å²	131.5	74%	0.743	78%	0.777	S	S	*	*			cis	-155.4	158.6	42.6	-96.6	-55.2	0	0	0	113.9
194	S	36.1	Very low	31.9	Very low	109 Å²	109	135 Å²	135	76%	0.762	78%	0.779	S	S	*	*			trans	57.4	133.6	155.4	55.9	0	0	0	0	119.7
195	T	33.7	Very low	31.2	Very low	136 Å²	136	135 Å²	135	83%	0.834	78%	0.777	S	S	*	*			cis	-148.4	162.7	-2.2	19.1	0	0	0	0	109.5
196	P	30.3	Very low	31	Very low	110 Å²	110	132.4 Å²	132.4	71%	0.714	77%	0.771	S	S	*	*			trans	-104.1	152	-154.2	38.1	-34.5	0	0	0	116
197	T	30.3	Very low	30.8	Very low	150 Å²	150	134.1 Å²	134.1	92%	0.92	77%	0.768	S	S	*	*			trans	-127.3	119.6	150.9	47.2	0	0	0	0	108.7
198	S	31.1	Very low	30.5	Very low	96 Å²	96	131.2 Å²	131.2	67%	0.671	75%	0.753	S	S	*	*			trans	-134.4	129.9	-168.5	57.9	0	0	0	0	113.1
199	S	30.5	Very low	30.5	Very low	94 Å²	94	130.2 Å²	130.2	66%	0.657	75%	0.748	S	S	*	*			trans	51.6	97.9	139.9	64.3	0	0	0	0	120.1
200	S	28.5	Very low	30.3	Very low	113 Å²	113	131 Å²	131	79%	0.79	75%	0.747	S	S	*	*				60.4	175.9	113.3	75.6	0	0	0	0	118.9
201	P	34.1	Very low	30.1	Very low	127 Å²	127	128.1 Å²	128.1	83%	0.825	74%	0.74	S	S	*	*				-117.4	145.3	-112.5	26.4	-5.6	0	0	0	115
202	S	30.2	Very low	29.6	Very low	122 Å²	122	129.5 Å²	129.5	85%	0.853	74%	0.741	S	S	*	*			trans	-148.5	137	171.4	62.9	0	0	0	0	115.2
203	M	25.2	Very low	29.4	Very low	168 Å²	168	128.4 Å²	128.4	83%	0.828	74%	0.735	S	S	*	*			trans	-27.8	141.4	167.8	-73.6	-171.4	-167.3	0	0	120.9
204	F	24.3	Very low	29.2	Very low	180 Å²	180	129.7 Å²	129.7	79%	0.789	74%	0.737	S	S	*	*			trans	72.7	144.2	134.6	-89.7	-88.4	0	0	0	123.4
205	T	26.6	Very low	28.8	Very low	134 Å²	134	134.1 Å²	134.1	82%	0.822	74%	0.743	S	S	*	*			trans	69.5	151	163.4	60.7	0	0	0	0	118.8
206	C	24.8	Very low	28.8	Very low	90 Å²	90	132.5 Å²	132.5	61%	0.608	74%	0.735	S	S	*	*			cis	-173.8	143.2	-27.3	-170.5	0	0	0	0	108.3
207	W	25.4	Very low	28.9	Very low	176 Å²	176	135.3 Å²	135.3	67%	0.667	74%	0.743	S	S	*	*			trans	57.3	165.9	158.9	-75.7	-7.8	0	0	0	119.2	N16	N16-W207 WeakPolarHBondContact ND2-CZ2 3.22Å
208	S	28.8	Very low	28.7	Very low	71 Å²	71	132.2 Å²	132.2	50%	0.497	73%	0.727	S	S	.	*			cis	-166.4	171.4	-39.4	50.8	0	0	0	0	109.3
209	D	27.5	Very low	28.6	Very low	127 Å²	127	134 Å²	134	68%	0.679	73%	0.729	S	S	*	*			trans	86.3	144.6	151.3	-51.7	-43.1	0	0	0	123.7
210	N	30.7	Very low	28.4	Very low	139 Å²	139	135.9 Å²	135.9	74%	0.743	73%	0.732	S	S	*	*			trans	96	140.9	152.8	-52.1	-51.4	0	0	0	119.9
211	L	27.7	Very low	28.4	Very low	129 Å²	129	136.3 Å²	136.3	68%	0.675	73%	0.73	S	S	*	*			cis	-169.4	137.4	-16.2	-107.3	168.7	0	0	0	109.8
212	F	27.2	Very low	28.1	Very low	176 Å²	176	136.6 Å²	136.6	77%	0.772	73%	0.725	S	S	*	*			trans	70.9	146.3	136.8	-88.3	-145	0	0	0	126.7
213	N	29.7	Very low	27.9	Very low	110 Å²	110	137.1 Å²	137.1	59%	0.588	72%	0.716	S	S	*	*			trans	75.5	145.6	146.4	-68.2	15	0	0	0	121.6
214	E	30.8	Very low	28.2	Very low	167 Å²	167	136.1 Å²	136.1	78%	0.78	71%	0.714	S	S	*	*			cis	-161.7	172.3	-12.9	-116.9	168.4	157.9	0	0	111.8
215	F	27.1	Very low	28.3	Very low	202 Å²	202	134.6 Å²	134.6	89%	0.886	71%	0.714	S	S	*	*			trans	-79.1	-162.7	-178.9	-85.4	-86	0	0	0	114.4
216	P	34.8	Very low	28.2	Very low	102 Å²	102	133.6 Å²	133.6	66%	0.662	71%	0.708	S	S	*	*				-130.7	178	-53	34.8	-18.6	0	0	0	113.6
217	L	31.5	Very low	28.3	Very low	169 Å²	169	135.9 Å²	135.9	89%	0.885	72%	0.715	S	S	*	*				176	163.7	124.8	-96.7	159	0	0	0	115.1
218	S	27.1	Very low	28.4	Very low	84 Å²	84	133.6 Å²	133.6	59%	0.587	72%	0.715	S	S	*	*			trans	-95.3	147.3	-161.5	54.4	0	0	0	0	116.7
219	N	28.5	Very low	28.3	Very low	134 Å²	134	136.6 Å²	136.6	72%	0.717	73%	0.726	S	S	*	*				175.9	136.2	103.9	-97.2	-34.3	0	0	0	114.5
220	N	26.5	Very low	28.2	Very low	134 Å²	134	136.9 Å²	136.9	72%	0.717	73%	0.727	S	S	*	*			trans	23	127.4	138.1	-64.5	-12.4	0	0	0	117.8
221	T	28.4	Very low	28.2	Very low	121 Å²	121	138 Å²	138	74%	0.742	73%	0.733	S	S	*	*			cis	174.7	162.9	38	12.3	0	0	0	0	106
222	N	26.5	Very low	28.1	Very low	134 Å²	134	137.5 Å²	137.5	72%	0.717	73%	0.73	S	S	*	*			cis	-160.3	169.5	4.8	-141.3	-15.5	0	0	0	110
223	I	27.8	Very low	28	Very low	133 Å²	133	138.7 Å²	138.7	68%	0.682	73%	0.731	S	S	*	*			trans	80.5	86.7	158.3	-57.5	152.8	0	0	0	117.8
224	N	30.3	Very low	27.7	Very low	146 Å²	146	140.2 Å²	140.2	78%	0.781	74%	0.739	S	S	*	*			trans	80.9	78.5	131.1	-58.9	-0.5	0	0	0	121.4
225	N	26.6	Very low	27.6	Very low	149 Å²	149	140.6 Å²	140.6	80%	0.797	74%	0.744	S	S	*	*			trans	-13.2	140.1	139.6	-59.1	-2.5	0	0	0	116.2
226	T	25.5	Very low	27.5	Very low	113 Å²	113	138.1 Å²	138.1	69%	0.693	74%	0.736	S	S	*	*			cis	68.8	117.5	28.2	77.6	0	0	0	0	118.4
227	N	26.4	Very low	27.1	Very low	138 Å²	138	141.9 Å²	141.9	74%	0.738	74%	0.738	S	S	*	*			trans	76.4	138.5	134.7	-69	-0.6	0	0	0	123.9
228	N	26.9	Very low	26.8	Very low	128 Å²	128	140.8 Å²	140.8	68%	0.684	73%	0.733	S	S	*	*			trans	84.9	107.3	140.8	-68.6	-7.4	0	0	0	121.3
229	N	26.4	Very low	27	Very low	134 Å²	134	146.8 Å²	146.8	72%	0.717	75%	0.749	S	S	*	*				56.8	138.4	114.5	-61.7	-10.7	0	0	0	121.5
230	N	26.6	Very low	26.9	Very low	133 Å²	133	148 Å²	148	71%	0.711	75%	0.754	S	S	*	*			trans	81.1	89.9	158.2	-57	-15.8	0	0	0	118
231	N	30.5	Very low	26.9	Very low	162 Å²	162	149.2 Å²	149.2	87%	0.866	76%	0.761	S	S	*	*			trans	-161.4	105.8	135.1	-84.3	-32.4	0	0	0	104.7
232	I	25.6	Very low	26.8	Very low	119 Å²	119	150.6 Å²	150.6	61%	0.61	76%	0.762	S	S	*	*				65.7	103.6	53.3	-59.7	-173.1	0	0	0	112.6
233	Y	24.2	Very low	26.8	Very low	201 Å²	201	151.1 Å²	151.1	79%	0.788	76%	0.763	S	S	*	*			trans	67.9	137.4	167.3	-69.8	-63.8	0	0	0	122.3
234	N	24	Very low	26.8	Very low	142 Å²	142	152 Å²	152	76%	0.759	77%	0.769	S	S	*	*			trans	61.3	104.1	155.3	-59.5	-10	0	0	0	119.1
235	I	29	Very low	26.6	Very low	174 Å²	174	153.4 Å²	153.4	89%	0.892	78%	0.776	S	S	*	*				-152.9	132.5	104.6	-95.3	149.9	0	0	0	109
236	E	25.3	Very low	26.6	Very low	151 Å²	151	154.3 Å²	154.3	71%	0.706	78%	0.775	S	S	*	*			trans	-98	169.1	-178	-154.5	-177	-176.4	0	0	109.8
237	Y	25.4	Very low	26.7	Very low	180 Å²	180	155 Å²	155	71%	0.706	77%	0.774	S	S	*	*			trans	57.1	95.3	170.2	-69.4	-82.7	0	0	0	118.6
238	N	25.9	Very low	26.8	Very low	146 Å²	146	155.6 Å²	155.6	78%	0.781	78%	0.778	S	S	*	*				175.9	97.6	107.8	-88.3	-34.2	0	0	0	111.7
239	K	30.3	Very low	27	Very low	211 Å²	211	154.8 Å²	154.8	92%	0.917	77%	0.773	S	S	*	*			trans	-114	98.1	155	-98.1	-172.8	173.9	-177.5	0	108.6	N241	K239-N241 PolarHBondContact O-N 3.47Å
240	L	26.9	Very low	27.1	Very low	158 Å²	158	156.4 Å²	156.4	83%	0.827	78%	0.782	S	S	*	*			trans	-58.2	114.2	170.6	-78.3	152.1	0	0	0	109.2	I242	L240-I242 PolarHBondContact O-N 3.43Å
241	N	26.6	Very low	27.5	Very low	161 Å²	161	154.8 Å²	154.8	86%	0.861	78%	0.777	S	S	*	*			trans	-81.6	105.1	161.5	-130.4	37.9	0	0	0	106.5	K239 I243	K239-N241 PolarHBondContact O-N 3.47Å; N241-I243 PolarHBondContact O-N 3.47Å
242	I	25.8	Very low	27.4	Very low	149 Å²	149	154.3 Å²	154.3	76%	0.764	77%	0.768	S	S	*	*			trans	-74.5	118.3	168.8	-63.8	171.1	0	0	0	107	L240	L240-I242 PolarHBondContact O-N 3.43Å
243	I	26.7	Very low	27.6	Very low	145 Å²	145	155.7 Å²	155.7	74%	0.744	78%	0.775	S	S	*	*			trans	171.8	151.6	152.4	-89.8	151.1	0	0	0	106.9	N241	N241-I243 PolarHBondContact O-N 3.47Å
244	D	28	Very low	27.9	Very low	152 Å²	152	149.8 Å²	149.8	81%	0.813	76%	0.764	S	S	*	*			trans	74	53.1	-177.8	-58.2	-17.6	0	0	0	117.4
245	L	26.4	Very low	28.3	Very low	176 Å²	176	149.3 Å²	149.3	92%	0.921	76%	0.761	S	S	*	*			trans	-95.4	86.1	150.2	-96.6	167.3	0	0	0	110
246	H	27	Very low	28.3	Very low	168 Å²	168	148.9 Å²	148.9	78%	0.778	75%	0.753	S	S	*	*			trans	-153.3	138.7	157.9	-126.1	-80.8	0	0	0	112
247	N	27.3	Very low	28.4	Very low	126 Å²	126	146.3 Å²	146.3	67%	0.674	75%	0.752	S	S	*	*	S	Bend	trans	64.2	79	169.2	-55.3	-12.5	0	0	0	117.2
248	N	28.2	Very low	28.7	Very low	151 Å²	151	142.4 Å²	142.4	81%	0.807	75%	0.75	S	S	*	*				175.8	164.1	104	-84.8	-32.5	0	0	0	112.5
249	N	30.9	Very low	29	Very low	112 Å²	112	143.3 Å²	143.3	60%	0.599	75%	0.75	S	S	*	*			trans	84.2	64.6	169.6	-54.6	-15.2	0	0	0	118.4	T251	N249-T251 PolarHBondContact O-N 3.48Å
250	N	28.6	Very low	28.9	Very low	168 Å²	168	143 Å²	143	90%	0.898	75%	0.749	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.3	67.4	148	-80.4	-24.2	0	0	0	111.5
251	T	34.1	Very low	28.9	Very low	99 Å²	99	144.5 Å²	144.5	61%	0.607	75%	0.749	S	S	*	*	T	Hydrogen-bonded Turn	trans	-159.6	-25.7	174.2	29.9	0	0	0	0	112.7	N249 S254	N249-T251 PolarHBondContact O-N 3.48Å; T251-S254 PolarHBondContact O-OG 2.66Å
252	F	29.4	Very low	29.1	Very low	152 Å²	152	143 Å²	143	67%	0.667	75%	0.745	S	S	*	*	S	Bend	trans	-85.5	-22.7	-175.8	-130.6	-98.9	0	0	0	114	F256	F252-F256 HydrophobicContact CE1-CE2 4.23Å
253	L	30.4	Very low	29.3	Very low	147 Å²	147	143.7 Å²	143.7	77%	0.77	75%	0.751	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.8	-10.5	-176	-81.4	162.6	0	0	0	114.8
254	S	30.6	Very low	29.3	Very low	78 Å²	78	145.4 Å²	145.4	55%	0.545	76%	0.755	S	S	.	*	T	Hydrogen-bonded Turn	trans	-81.9	-29.9	176.9	55.3	0	0	0	0	113.5	T251	T251-S254 PolarHBondContact O-OG 2.66Å
255	N	30.7	Very low	29.3	Very low	132 Å²	132	147 Å²	147	71%	0.706	76%	0.755	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92	-19.3	-174.3	-69.3	0.4	0	0	0	113.5	S257	N255-S257 VanDerWaalsContact C-N 3.32Å
256	F	29.3	Very low	29.4	Very low	165 Å²	165	147.8 Å²	147.8	72%	0.724	75%	0.754	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.7	-9.5	175.2	-105.3	-94.5	0	0	0	114.2	F252	F252-F256 HydrophobicContact CE1-CE2 4.23Å
257	S	28.7	Very low	29.4	Very low	97 Å²	97	148 Å²	148	68%	0.678	76%	0.755	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.4	-3.6	-172.6	-161	0	0	0	0	114.8	N255	N255-S257 VanDerWaalsContact C-N 3.32Å
258	S	31	Very low	29.4	Very low	97 Å²	97	147.8 Å²	147.8	68%	0.678	76%	0.764	S	S	*	*	S	Bend	trans	-108.7	-8	-172.6	-64.1	0	0	0	0	115.7
259	Q	32.2	Very low	29.6	Very low	165 Å²	165	149.8 Å²	149.8	77%	0.771	77%	0.765	S	S	*	*	S	Bend	trans	-102.6	-2.2	-167.9	-144.9	67.6	18.9	0	0	115.7
260	F	28.7	Very low	29.6	Very low	205 Å²	205	150.5 Å²	150.5	90%	0.899	77%	0.768	S	S	*	*			trans	-128.2	53.1	-175.7	-95.5	-83.1	0	0	0	113.6
261	K	27	Very low	29.8	Very low	190 Å²	190	148.7 Å²	148.7	83%	0.826	76%	0.758	S	S	*	*			trans	-128.4	68.7	170.5	-86.8	-172.7	175.3	175	0	112.3
262	T	29.5	Very low	29.8	Very low	128 Å²	128	150 Å²	150	79%	0.785	76%	0.761	S	S	*	*			trans	-179.7	94.7	152.8	39.4	0	0	0	0	109.3
263	D	29.9	Very low	29.9	Very low	165 Å²	165	146.7 Å²	146.7	88%	0.882	76%	0.755	S	S	*	*				174.5	148.4	109.6	-89.5	-16	0	0	0	111.8
264	H	28.1	Very low	30.2	Very low	180 Å²	180	144.6 Å²	144.6	83%	0.833	74%	0.744	S	S	*	*			trans	-126.4	155.5	-157	-133	-69.9	0	0	0	110.6
265	K	27.7	Very low	30.4	Very low	186 Å²	186	145.9 Å²	145.9	81%	0.809	74%	0.744	S	S	*	*			trans	77	84.3	165.2	-55.1	168.7	175.9	173.8	0	117.5
266	Q	27.8	Very low	30.5	Very low	192 Å²	192	143.8 Å²	143.8	90%	0.897	73%	0.733	S	S	*	*	S	Bend		-170.2	106.2	123	-104.9	172.5	18.7	0	0	108.9
267	E	27.2	Very low	30.9	Very low	173 Å²	173	138.8 Å²	138.8	81%	0.808	72%	0.718	S	S	*	*			trans	159	51	154.9	-89.8	-175.5	165.5	0	0	113.2	K269	E267-K269 VanDerWaalsContact C-N 3.25Å; E267-K269 PolarHBondContact O-N 2.76Å
268	S	27.3	Very low	31.3	Very low	121 Å²	121	139.1 Å²	139.1	85%	0.846	71%	0.712	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.8	36.5	175.1	53.3	0	0	0	0	113.8
269	K	32	Very low	31.7	Very low	194 Å²	194	140.3 Å²	140.3	84%	0.843	71%	0.707	S	S	*	*	T	Hydrogen-bonded Turn	trans	-135	-4.9	-173.1	-83.2	-170.1	174.7	-178.1	0	118	E267	E267-K269 VanDerWaalsContact C-N 3.25Å; E267-K269 PolarHBondContact O-N 2.76Å
270	L	32.4	Very low	32.2	Very low	126 Å²	126	139.7 Å²	139.7	66%	0.66	70%	0.702	S	S	*	*	S	Bend	trans	-118.7	-11.8	-175.2	-88.5	154.6	0	0	0	116	P273	L270-P273 WeakPolarHBondContact O-CD 3.38Å
271	L	31.4	Very low	32.9	Very low	130 Å²	130	135.5 Å²	135.5	68%	0.681	69%	0.688	S	S	*	*	S	Bend	trans	-97.8	-11	-172.4	-130.9	70.4	0	0	0	116
272	N	34.6	Very low	33.5	Very low	127 Å²	127	131 Å²	131	68%	0.679	67%	0.673	S	S	*	*	H	α-helix	trans	-76.7	-25.8	178.8	-82.8	-6.3	0	0	0	116.8	N276	N272-N276 PolarHBondContact O-ND2 3.48Å
273	P	31.4	Very low	34.3	Very low	82 Å²	82	129.6 Å²	129.6	53%	0.532	66%	0.661	S	S	.	*	H	α-helix	trans	-72.3	-34.4	179.5	-19.8	33	0	0	0	113.8	L270 S277	L270-P273 WeakPolarHBondContact O-CD 3.38Å; P273-S277 PolarHBondContact O-N 3.48Å; P273-S277 VanDerWaalsContact O-N 3.1Å; P273-S277 PolarHBondContact O-OG 2.96Å; P273-S277 VanDerWaalsContact O-OG 3.06Å
274	I	36.1	Very low	34.8	Very low	104 Å²	104	125.4 Å²	125.4	53%	0.533	64%	0.644	S	S	.	*	H	α-helix	trans	-76.4	-41.1	-170.3	-61.9	175.2	0	0	0	111.5	S277 L278	I274-S277 WeakPolarHBondContact CA-OG 3.41Å; I274-S277 PolarHBondContact O-N 3.41Å; I274-S277 PolarHBondContact O-OG 2.84Å; I274-L278 PolarHBondContact O-N 3.44Å
275	N	34.6	Very low	35.4	Very low	105 Å²	105	121.4 Å²	121.4	56%	0.561	63%	0.628	S	S	*	*	H	α-helix	trans	-70.2	-38.1	177.5	-68.2	-14.4	0	0	0	111.7	S277 L278 E279	N275-S277 VanDerWaalsContact C-N 3.33Å; N275-S277 PolarHBondContact O-N 3.12Å; N275-L278 PolarHBondContact O-N 3.47Å; N275-E279 WeakPolarHBondContact O-CB 3.03Å; N275-E279 PolarHBondContact O-N 2.82Å
276	N	34.5	Very low	36.2	Very low	88 Å²	88	118.6 Å²	118.6	47%	0.471	62%	0.616	S	S	.	*	H	α-helix	trans	-65.9	-30.6	173.6	-89.2	-73.5	0	0	0	113.4	N272 K280	N272-N276 PolarHBondContact O-ND2 3.48Å; N276-K280 WeakPolarHBondContact O-CB 3.23Å; N276-K280 VanDerWaalsContact O-CG 3.27Å; N276-K280 WeakPolarHBondContact O-CG 3.48Å; N276-K280 PolarHBondContact O-N 3.16Å
277	S	37.6	Very low	37.1	Very low	59 Å²	59	116.2 Å²	116.2	41%	0.413	61%	0.605	S	S	.	*	H	α-helix	trans	-80.5	-32.8	175.7	56.8	0	0	0	0	112.3	P273 I274 N275 L281	P273-S277 PolarHBondContact O-N 3.48Å; P273-S277 VanDerWaalsContact O-N 3.1Å; P273-S277 PolarHBondContact O-OG 2.96Å; P273-S277 VanDerWaalsContact O-OG 3.06Å; I274-S277 WeakPolarHBondContact CA-OG 3.41Å; I274-S277 PolarHBondContact O-N 3.41Å; I274-S277 PolarHBondContact O-OG 2.84Å; N275-S277 VanDerWaalsContact C-N 3.33Å; N275-S277 PolarHBondContact O-N 3.12Å; S277-L281 WeakPolarHBondContact O-CB 3.41Å; S277-L281 PolarHBondContact O-N 2.9Å
278	L	37.2	Very low	37.7	Very low	104 Å²	104	115 Å²	115	55%	0.545	59%	0.594	S	S	.	*	H	α-helix	trans	-66.3	-42	172.4	-144.7	88.2	0	0	0	111.9	I274 N275 L281 N282	I274-L278 PolarHBondContact O-N 3.44Å; N275-L278 PolarHBondContact O-N 3.47Å; L278-L281 PolarHBondContact O-N 3.26Å; L278-N282 PolarHBondContact O-N 3.33Å
279	E	38.6	Very low	38.5	Very low	123 Å²	123	114.3 Å²	114.3	58%	0.575	58%	0.577	S	S	*	*	H	α-helix	trans	-68.5	-38.4	177.5	-167.5	169.6	-164.8	0	0	111.7	N275 N283	N275-E279 WeakPolarHBondContact O-CB 3.03Å; N275-E279 PolarHBondContact O-N 2.82Å; E279-N283 WeakPolarHBondContact O-CB 3.36Å; E279-N283 VanDerWaalsContact O-CG 3.3Å; E279-N283 PolarHBondContact O-N 2.78Å; E279-N283 PolarHBondContact O-ND2 3.22Å
280	K	43	Very low	39.1	Very low	152 Å²	152	110.3 Å²	110.3	66%	0.661	56%	0.562	S	S	*	*	H	α-helix	trans	-66.1	-37.1	169.8	-77.1	178.8	179.1	-175.2	0	113.2	N276 C284	N276-K280 WeakPolarHBondContact O-CB 3.23Å; N276-K280 VanDerWaalsContact O-CG 3.27Å; N276-K280 WeakPolarHBondContact O-CG 3.48Å; N276-K280 PolarHBondContact O-N 3.16Å; K280-C284 WeakPolarHBondContact O-CB 3.18Å; K280-C284 PolarHBondContact O-N 3.2Å
281	L	42.3	Very low	39.3	Very low	116 Å²	116	111.5 Å²	111.5	61%	0.607	56%	0.558	S	S	*	*	H	α-helix	trans	-66.6	-44.5	175.5	-102.2	162.1	0	0	0	111.6	S277 L278 C284 L285	S277-L281 WeakPolarHBondContact O-CB 3.41Å; S277-L281 PolarHBondContact O-N 2.9Å; L278-L281 PolarHBondContact O-N 3.26Å; L281-C284 PolarHBondContact O-N 2.8Å; L281-L285 VanDerWaalsContact O-CB 3.31Å; L281-L285 WeakPolarHBondContact O-CB 3.3Å; L281-L285 PolarHBondContact O-N 2.95Å
282	N	41	Very low	39.7	Very low	97 Å²	97	108.8 Å²	108.8	52%	0.519	54%	0.544	S	S	.	.	H	α-helix	trans	-65.6	-40.3	177.3	-75.6	-17.8	0	0	0	112	L278 L285 F286	L278-N282 PolarHBondContact O-N 3.33Å; N282-L285 PolarHBondContact O-N 3.29Å; N282-F286 VanDerWaalsContact O-CB 3.31Å; N282-F286 WeakPolarHBondContact O-CB 3.36Å; N282-F286 PolarHBondContact O-N 2.79Å
283	N	46.2	Very low	40	Very low	97 Å²	97	108.9 Å²	108.9	52%	0.519	55%	0.545	S	S	.	.	H	α-helix	trans	-66.5	-39.9	174.1	-71.9	-19	0	0	0	112.1	E279 F286 E287	E279-N283 WeakPolarHBondContact O-CB 3.36Å; E279-N283 VanDerWaalsContact O-CG 3.3Å; E279-N283 PolarHBondContact O-N 2.78Å; E279-N283 PolarHBondContact O-ND2 3.22Å; N283-F286 PolarHBondContact O-N 3.13Å; N283-E287 WeakPolarHBondContact O-CG 3.45Å; N283-E287 PolarHBondContact O-N 2.88Å
284	C	39.3	Very low	40.4	Very low	78 Å²	78	108.9 Å²	108.9	53%	0.527	55%	0.547	S	S	.	.	H	α-helix	trans	-67.2	-37.3	176.2	-163	0	0	0	0	112	K280 L281 Y288	K280-C284 WeakPolarHBondContact O-CB 3.18Å; K280-C284 PolarHBondContact O-N 3.2Å; L281-C284 PolarHBondContact O-N 2.8Å; C284-Y288 VanDerWaalsContact O-CB 3.26Å; C284-Y288 WeakPolarHBondContact O-CB 3.45Å; C284-Y288 PolarHBondContact O-N 3.21Å
285	L	41.7	Very low	40.5	Very low	95 Å²	95	108.4 Å²	108.4	50%	0.497	55%	0.546	S	S	.	.	H	α-helix	trans	-68.1	-38.2	174.6	-166.5	71.3	0	0	0	111.6	L281 N282 Y288 Q289	L281-L285 VanDerWaalsContact O-CB 3.31Å; L281-L285 WeakPolarHBondContact O-CB 3.3Å; L281-L285 PolarHBondContact O-N 2.95Å; N282-L285 PolarHBondContact O-N 3.29Å; L285-Y288 PolarHBondContact O-N 2.86Å; L285-Q289 WeakPolarHBondContact O-CB 3.3Å; L285-Q289 WeakPolarHBondContact O-CG 3.45Å; L285-Q289 PolarHBondContact O-N 3.11Å
286	F	44	Very low	40.4	Very low	127 Å²	127	110.9 Å²	110.9	56%	0.557	56%	0.559	S	S	*	*	H	α-helix	trans	-68.6	-42.2	175.7	-163.5	-97.8	0	0	0	111.8	N282 N283 Q289 Q290	N282-F286 VanDerWaalsContact O-CB 3.31Å; N282-F286 WeakPolarHBondContact O-CB 3.36Å; N282-F286 PolarHBondContact O-N 2.79Å; N283-F286 PolarHBondContact O-N 3.13Å; F286-Q289 PolarHBondContact O-N 2.97Å; F286-Q290 HydrophobicContact CD1-CG 4.28Å; F286-Q290 HydrophobicContact CE1-CG 4.22Å; F286-Q290 WeakPolarHBondContact O-CB 3.47Å; F286-Q290 WeakPolarHBondContact O-CG 2.78Å; F286-Q290 PolarHBondContact O-N 2.96Å
287	E	46.7	Very low	40.2	Very low	142 Å²	142	111.1 Å²	111.1	66%	0.664	57%	0.567	S	S	*	*	H	α-helix	trans	-63.1	-39.9	171.2	-75.9	-172.9	163.6	0	0	111.8	N283 Q290 Y291	N283-E287 WeakPolarHBondContact O-CG 3.45Å; N283-E287 PolarHBondContact O-N 2.88Å; E287-Q290 PolarHBondContact O-N 3.05Å; E287-Y291 VanDerWaalsContact O-CB 3.25Å; E287-Y291 WeakPolarHBondContact O-CB 3.39Å; E287-Y291 PolarHBondContact O-N 3.38Å
288	Y	39.9	Very low	39.9	Very low	148 Å²	148	115.5 Å²	115.5	58%	0.58	59%	0.585	S	S	*	*	H	α-helix	trans	-66.9	-38.7	177.6	-162.6	-103.2	0	0	0	112.7	C284 L285 Y291 N292	C284-Y288 VanDerWaalsContact O-CB 3.26Å; C284-Y288 WeakPolarHBondContact O-CB 3.45Å; C284-Y288 PolarHBondContact O-N 3.21Å; L285-Y288 PolarHBondContact O-N 2.86Å; Y288-Y291 PolarHBondContact O-N 3.1Å; Y288-N292 VanDerWaalsContact CE1-ND2 3.25Å; Y288-N292 WeakPolarHBondContact CE1-ND2 3.34Å; Y288-N292 PolarHBondContact O-N 3.14Å
289	Q	43.8	Very low	39.5	Very low	107 Å²	107	120.4 Å²	120.4	50%	0.5	60%	0.597	S	S	.	*	H	α-helix	trans	-67.3	-40.5	173.3	-75.8	177.7	-17.6	0	0	112	L285 F286 N292 N293	L285-Q289 WeakPolarHBondContact O-CB 3.3Å; L285-Q289 WeakPolarHBondContact O-CG 3.45Å; L285-Q289 PolarHBondContact O-N 3.11Å; F286-Q289 PolarHBondContact O-N 2.97Å; Q289-N292 PolarHBondContact O-N 2.93Å; Q289-N293 WeakPolarHBondContact O-CB 3.42Å; Q289-N293 PolarHBondContact O-N 2.63Å; Q289-N293 PolarHBondContact O-ND2 2.92Å
290	Q	45.3	Very low	39.1	Very low	110 Å²	110	123.4 Å²	123.4	51%	0.514	61%	0.611	S	S	.	*	H	α-helix	trans	-67.5	-35	174.5	-67.4	-76.3	46.2	0	0	112.2	F286 E287 S294	F286-Q290 HydrophobicContact CD1-CG 4.28Å; F286-Q290 HydrophobicContact CE1-CG 4.22Å; F286-Q290 WeakPolarHBondContact O-CB 3.47Å; F286-Q290 WeakPolarHBondContact O-CG 2.78Å; F286-Q290 PolarHBondContact O-N 2.96Å; E287-Q290 PolarHBondContact O-N 3.05Å; Q290-S294 WeakPolarHBondContact O-CB 3.36Å; Q290-S294 PolarHBondContact O-N 3.48Å; Q290-S294 PolarHBondContact O-OG 3.26Å
291	Y	37.2	Very low	38.7	Very low	150 Å²	150	125.2 Å²	125.2	59%	0.588	62%	0.622	S	S	*	*	H	α-helix	trans	-69.8	-38	176.1	-170.6	-96.2	0	0	0	112.7	E287 Y288 S294 N295	E287-Y291 VanDerWaalsContact O-CB 3.25Å; E287-Y291 WeakPolarHBondContact O-CB 3.39Å; E287-Y291 PolarHBondContact O-N 3.38Å; Y288-Y291 PolarHBondContact O-N 3.1Å; Y291-S294 PolarHBondContact O-N 3.44Å; Y291-S294 PolarHBondContact O-OG 3.21Å; Y291-N295 WeakPolarHBondContact CE1-ND2 3.34Å; Y291-N295 PolarHBondContact O-ND2 2.93Å
292	N	39.6	Very low	38.1	Very low	73 Å²	73	125 Å²	125	39%	0.39	63%	0.63	S	S	.	*	H	α-helix	trans	-73.4	-34	175.3	-74.9	-21.1	0	0	0	112.6	Y288 Q289 S294	Y288-N292 VanDerWaalsContact CE1-ND2 3.25Å; Y288-N292 WeakPolarHBondContact CE1-ND2 3.34Å; Y288-N292 PolarHBondContact O-N 3.14Å; Q289-N292 PolarHBondContact O-N 2.93Å; N292-S294 PolarHBondContact O-N 3.06Å
293	N	39.3	Very low	37.7	Very low	130 Å²	130	125.6 Å²	125.6	70%	0.695	64%	0.642	S	S	*	*	H	α-helix	trans	-73.6	-11.6	175.4	-74.4	-23	0	0	0	114.2	Q289	Q289-N293 WeakPolarHBondContact O-CB 3.42Å; Q289-N293 PolarHBondContact O-N 2.63Å; Q289-N293 PolarHBondContact O-ND2 2.92Å
294	S	40.9	Very low	37	Very low	81 Å²	81	126.2 Å²	126.2	57%	0.566	65%	0.653	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107	-1.1	-179.9	48.5	0	0	0	0	115	Q290 Y291 N292	Q290-S294 WeakPolarHBondContact O-CB 3.36Å; Q290-S294 PolarHBondContact O-N 3.48Å; Q290-S294 PolarHBondContact O-OG 3.26Å; Y291-S294 PolarHBondContact O-N 3.44Å; Y291-S294 PolarHBondContact O-OG 3.21Å; N292-S294 PolarHBondContact O-N 3.06Å
295	N	37	Very low	36.8	Very low	95 Å²	95	127.3 Å²	127.3	51%	0.508	66%	0.662	S	S	.	*	S	Bend	trans	-111	6.9	-179.5	-78.4	-60.7	0	0	0	115.1	Y291	Y291-N295 WeakPolarHBondContact CE1-ND2 3.34Å; Y291-N295 PolarHBondContact O-ND2 2.93Å
296	N	33.4	Very low	36.4	Very low	156 Å²	156	128.3 Å²	128.3	83%	0.834	68%	0.677	S	S	*	*	S	Bend	trans	-93.2	17.1	-178.6	-96.6	-18.8	0	0	0	115.4
297	S	30.2	Very low	35.9	Very low	93 Å²	93	127.9 Å²	127.9	65%	0.65	69%	0.687	S	S	*	*	S	Bend	trans	-141.1	108.9	163.2	65.9	0	0	0	0	109.9
298	I	30.9	Very low	35.2	Very low	152 Å²	152	126.4 Å²	126.4	78%	0.779	69%	0.692	S	S	*	*	S	Bend	trans	163.9	130.6	148.1	-87.7	155.9	0	0	0	110.6
299	Y	28.4	Very low	34.9	Very low	206 Å²	206	124.2 Å²	124.2	81%	0.808	70%	0.699	S	S	*	*			trans	64.6	102.9	171.7	-68.2	-57	0	0	0	122
300	H	31.9	Very low	34.2	Very low	187 Å²	187	124 Å²	124	87%	0.866	71%	0.709	S	S	*	*			trans	-135.4	90.4	130.2	-118.5	-68.8	0	0	0	110.1
301	Q	33.2	Very low	33.3	Very low	189 Å²	189	124.6 Å²	124.6	88%	0.883	72%	0.724	S	S	*	*			trans	-157.3	100.5	152.5	-116.8	-179.5	21.4	0	0	109
302	S	30.7	Very low	33	Very low	111 Å²	111	121.6 Å²	121.6	78%	0.776	73%	0.725	S	S	*	*			trans	-109.5	119.6	178.7	36.7	0	0	0	0	110.1
303	S	31.3	Very low	32.6	Very low	111 Å²	111	125.1 Å²	125.1	78%	0.776	74%	0.744	S	S	*	*			trans	-142.1	149.2	161.4	56.6	0	0	0	0	109.3
304	S	32.9	Very low	32.1	Very low	109 Å²	109	124.3 Å²	124.3	76%	0.762	74%	0.743	S	S	*	*	S	Bend	trans	64.6	93.2	178.6	53.6	0	0	0	0	118.9
305	S	34.4	Very low	31.4	Very low	102 Å²	102	127 Å²	127	71%	0.713	75%	0.751	S	S	*	*				62.3	105.1	123.7	62.7	0	0	0	0	122.9
306	S	34.5	Very low	31.1	Very low	115 Å²	115	131 Å²	131	80%	0.804	76%	0.763	S	S	*	*				75.6	160	127	-43.2	0	0	0	0	117.9
307	P	32.5	Very low	30.9	Very low	119 Å²	119	133.9 Å²	133.9	77%	0.773	76%	0.764	S	S	*	*				-132.3	-176	-94.6	32.6	-10.7	0	0	0	115.4
308	S	32.1	Very low	31.1	Very low	110 Å²	110	134.3 Å²	134.3	77%	0.769	77%	0.765	S	S	*	*			trans	103.6	116.7	155.5	74.2	0	0	0	0	121.1
309	S	33	Very low	30.8	Very low	102 Å²	102	134.6 Å²	134.6	71%	0.713	77%	0.767	S	S	*	*			trans	62.5	105.3	139.6	56.8	0	0	0	0	123.4
310	S	29.2	Very low	30.7	Very low	104 Å²	104	129.5 Å²	129.5	73%	0.727	76%	0.762	S	S	*	*				78.1	127.2	117.7	69.4	0	0	0	0	123.2
311	C	27.2	Very low	30.4	Very low	122 Å²	122	126.5 Å²	126.5	82%	0.824	76%	0.757	S	S	*	*			trans	66.5	150.7	153.2	-59	0	0	0	0	117.9
312	S	29.6	Very low	30	Very low	86 Å²	86	122.2 Å²	122.2	60%	0.601	75%	0.748	S	S	*	*			cis	-168.8	167.7	-21.4	-91.4	0	0	0	0	107
313	D	32	Very low	30	Very low	148 Å²	148	124.8 Å²	124.8	79%	0.791	75%	0.751	S	S	*	*			trans	68.2	148.4	157.7	-56.9	-33.3	0	0	0	118.5
314	V	28.3	Very low	29.9	Very low	113 Å²	113	126.3 Å²	126.3	69%	0.685	75%	0.749	S	S	*	*			cis	167.8	134.6	-25.4	131.1	0	0	0	0	105.1
315	L	27.6	Very low	29.8	Very low	137 Å²	137	127 Å²	127	72%	0.717	75%	0.751	S	S	*	*			trans	62.9	114.4	163	-70	167.8	0	0	0	121.2
316	K	30.7	Very low	29.5	Very low	178 Å²	178	128.9 Å²	128.9	77%	0.774	75%	0.753	S	S	*	*				162	118.5	96.2	-104.3	155.7	179.9	177.8	0	115.6
317	Y	28	Very low	29.6	Very low	217 Å²	217	127.9 Å²	127.9	85%	0.851	74%	0.743	S	S	*	*			trans	52	152.6	134.9	-84.5	-100.8	0	0	0	123.8
318	P	34	Very low	29.6	Very low	103 Å²	103	130.9 Å²	130.9	67%	0.669	75%	0.745	S	S	*	*			trans	-114.5	179.2	-161.7	43.9	-33.2	0	0	0	114.2
319	L	26.2	Very low	29.5	Very low	158 Å²	158	130.7 Å²	130.7	83%	0.827	74%	0.739	S	S	*	*			trans	178.1	138.3	140.1	-103.3	153.6	0	0	0	113
320	S	25.9	Very low	29.4	Very low	99 Å²	99	131.5 Å²	131.5	69%	0.692	74%	0.74	S	S	*	*			trans	61.2	151.7	146.7	67.6	0	0	0	0	119.8
321	T	25.1	Very low	29.4	Very low	124 Å²	124	133 Å²	133	76%	0.761	74%	0.738	S	S	*	*			cis	-167.4	156.1	-12.9	19	0	0	0	0	108.3
322	S	24.8	Very low	29.5	Very low	99 Å²	99	131.7 Å²	131.7	69%	0.692	73%	0.73	S	S	*	*			trans	57.1	132.7	150.4	65	0	0	0	0	121.5
323	I	30.9	Very low	29.4	Very low	165 Å²	165	131.9 Å²	131.9	85%	0.846	73%	0.732	S	S	*	*				-176.3	148.3	106.6	-88.8	154.6	0	0	0	110.5
324	I	28.1	Very low	29	Very low	142 Å²	142	130.2 Å²	130.2	73%	0.728	73%	0.731	S	S	*	*			trans	-99.2	148.2	-171.7	-76.8	165.8	0	0	0	108.7
325	P	31.6	Very low	29	Very low	125 Å²	125	129.7 Å²	129.7	81%	0.812	73%	0.733	S	S	*	*				-155.3	161.6	85	38.8	-15.6	0	0	0	121.8
326	D	29	Very low	29.1	Very low	141 Å²	141	130 Å²	130	75%	0.754	74%	0.735	S	S	*	*			trans	-63.3	-168.6	165.5	-62.1	-58.6	0	0	0	114
327	P	35.6	Very low	28.8	Very low	93 Å²	93	128.8 Å²	128.8	60%	0.604	74%	0.735	S	S	*	*			cis	-138.7	-176	0.4	35.4	-12.4	0	0	0	116.9
328	F	33.3	Very low	28.6	Very low	183 Å²	183	122.8 Å²	122.8	80%	0.803	73%	0.725	S	S	*	*				161.4	100.8	124.3	-90.5	-74.8	0	0	0	110.8
329	T	29.4	Very low	28.2	Very low	105 Å²	105	124.4 Å²	124.4	64%	0.644	73%	0.728	S	S	*	*				61.8	121.6	101.5	-26.6	0	0	0	0	114.2	I331	T329-I331 HydrophobicContact CG2-CD1 4.14Å
330	V	31.8	Very low	28.2	Very low	120 Å²	120	124.5 Å²	124.5	73%	0.727	72%	0.722	S	S	*	*				-170.2	116.9	76	158.4	0	0	0	0	106.3
331	I	29.1	Very low	28.1	Very low	136 Å²	136	126.2 Å²	126.2	70%	0.697	72%	0.723	S	S	*	*				63.6	129.8	93.9	-64.4	163.7	0	0	0	112.9	T329	T329-I331 HydrophobicContact CG2-CD1 4.14Å
332	S	27.6	Very low	28.2	Very low	93 Å²	93	129.3 Å²	129.3	65%	0.65	72%	0.722	S	S	*	*			cis	-173.6	176.8	-8	55.4	0	0	0	0	111.6
333	S	27.9	Very low	28.4	Very low	91 Å²	91	130.5 Å²	130.5	64%	0.636	72%	0.717	S	S	*	*			trans	56.7	113.9	142.9	58.2	0	0	0	0	119.9
334	S	24.5	Very low	28.3	Very low	113 Å²	113	129.8 Å²	129.8	79%	0.79	71%	0.709	S	S	*	*				65	106.2	59.7	82.2	0	0	0	0	115.6
335	S	28.6	Very low	28.3	Very low	102 Å²	102	130.2 Å²	130.2	71%	0.713	71%	0.708	S	S	*	*			trans	-172.2	160.8	152.5	45.1	0	0	0	0	111.5
336	N	28.2	Very low	28.2	Very low	144 Å²	144	129.5 Å²	129.5	77%	0.77	70%	0.698	S	S	*	*			trans	68.6	102.6	171.7	-50.4	-22.4	0	0	0	114.5
337	I	25.3	Very low	28.2	Very low	151 Å²	151	129.7 Å²	129.7	77%	0.774	70%	0.699	S	S	*	*			cis	60.7	104.4	29.9	-60.1	-178.7	0	0	0	113.5
338	S	23.9	Very low	27.9	Very low	92 Å²	92	131.9 Å²	131.9	64%	0.643	71%	0.705	S	S	*	*			trans	69.7	150	146.7	-63	0	0	0	0	121
339	N	25.8	Very low	27.5	Very low	136 Å²	136	129.6 Å²	129.6	73%	0.727	70%	0.701	S	S	*	*			trans	67.5	149.8	154.8	-63.3	-34.8	0	0	0	113.7
340	K	26.4	Very low	27.5	Very low	161 Å²	161	129.7 Å²	129.7	70%	0.7	71%	0.705	S	S	*	*			cis	175.2	146.1	-2.9	-108.7	173.3	176.8	-176.4	0	101.1
341	L	24.1	Very low	27.4	Very low	134 Å²	134	133.1 Å²	133.1	70%	0.702	71%	0.71	S	S	*	*			trans	57.9	145	138	-61.1	168.7	0	0	0	120.2
342	Y	25.8	Very low	27.3	Very low	190 Å²	190	134.3 Å²	134.3	75%	0.745	72%	0.718	S	S	*	*			trans	74.7	140.5	145.4	-87.7	-132.7	0	0	0	115.5
343	E	29	Very low	27.4	Very low	124 Å²	124	133.7 Å²	133.7	58%	0.579	73%	0.726	S	S	*	*			cis	-165.5	176.5	2	-146.7	-177.7	-171.9	0	0	111.1
344	Q	29	Very low	27.3	Very low	149 Å²	149	136.8 Å²	136.8	70%	0.696	73%	0.734	S	S	*	*			trans	71.9	137.3	157.1	-62.8	160.3	37.7	0	0	117
345	Q	28.8	Very low	27.5	Very low	151 Å²	151	136.8 Å²	136.8	71%	0.706	73%	0.731	S	S	*	*			cis	-165	153	-10.5	-97.4	-168.1	25.5	0	0	105.7
346	N	29.7	Very low	27.3	Very low	111 Å²	111	141.6 Å²	141.6	59%	0.594	74%	0.739	S	S	*	*			cis	-154.5	155.2	-1.4	-82.6	-42.5	0	0	0	108.8
347	N	28.2	Very low	27.4	Very low	144 Å²	144	141.2 Å²	141.2	77%	0.77	74%	0.742	S	S	*	*			trans	61.8	142.2	152.5	-57.7	-12.5	0	0	0	118.9
348	L	28.7	Very low	27.3	Very low	140 Å²	140	140.1 Å²	140.1	73%	0.733	74%	0.742	S	S	*	*			cis	-153.3	136.6	4.5	-152.2	76.5	0	0	0	110.9
349	D	26.4	Very low	27.5	Very low	135 Å²	135	142.7 Å²	142.7	72%	0.722	75%	0.749	S	S	*	*			trans	6.4	128.2	155.6	-48.8	-42	0	0	0	122.1
350	C	28.1	Very low	27.4	Very low	107 Å²	107	141.7 Å²	141.7	72%	0.723	75%	0.748	S	S	*	*				167.8	133.1	96.3	-104.6	0	0	0	0	115.1
351	F	30.4	Very low	27.4	Very low	191 Å²	191	139.2 Å²	139.2	84%	0.838	75%	0.751	S	S	*	*			trans	51.1	101.6	160.9	-68.7	-82.4	0	0	0	118.6
352	N	26.9	Very low	27.7	Very low	161 Å²	161	140.4 Å²	140.4	86%	0.861	76%	0.756	S	S	*	*			cis	57.4	115.3	45.7	-82.4	-18.7	0	0	0	116.1
353	G	30.2	Very low	27.8	Very low	80 Å²	80	140.3 Å²	140.3	83%	0.825	76%	0.76	S	S	*	*			trans	173.3	33	177.2	0	0	0	0	0	119.2
354	I	24.8	Very low	27.5	Very low	157 Å²	157	145.2 Å²	145.2	81%	0.805	77%	0.773	S	S	*	*			trans	-73.9	151.2	172.7	-41	172	0	0	0	107.1
355	P	28.8	Very low	27.4	Very low	113 Å²	113	147.1 Å²	147.1	73%	0.734	78%	0.782	S	S	*	*			cis	-152.4	173	44	43.8	-21.3	0	0	0	121.6
356	K	25.5	Very low	27.2	Very low	202 Å²	202	147.9 Å²	147.9	88%	0.878	79%	0.791	S	S	*	*			trans	-59.5	140.9	165.9	-64	173.3	176.3	177	0	111.7
357	V	29.2	Very low	27	Very low	136 Å²	136	151 Å²	151	82%	0.824	80%	0.799	S	S	*	*			trans	-127.1	121.1	157.2	177.1	0	0	0	0	108.5
358	T	24.4	Very low	26.8	Very low	128 Å²	128	153.6 Å²	153.6	79%	0.785	80%	0.8	S	S	*	*			trans	-86.9	121.7	162.4	47	0	0	0	0	108.5
359	D	27.6	Very low	26.6	Very low	146 Å²	146	154.6 Å²	154.6	78%	0.781	81%	0.805	S	S	*	*				-169.6	170.7	117.1	-131.6	-48.3	0	0	0	112.7
360	T	23.8	Very low	26.5	Very low	115 Å²	115	155.5 Å²	155.5	71%	0.706	81%	0.809	S	S	*	*			trans	-80.6	153.7	-172.2	55	0	0	0	0	114.6
361	S	26.2	Very low	26.4	Very low	109 Å²	109	157.1 Å²	157.1	76%	0.762	81%	0.809	S	S	*	*			trans	125.8	157.9	153.2	-61.3	0	0	0	0	116
362	I	29.7	Very low	26.2	Very low	159 Å²	159	155 Å²	155	82%	0.815	81%	0.806	S	S	*	*			trans	78.5	81.6	177	-47.4	167.6	0	0	0	113.3
363	K	27.4	Very low	26.3	Very low	189 Å²	189	154.8 Å²	154.8	82%	0.822	80%	0.798	S	S	*	*				59.4	111.9	84.5	-74.7	-176.5	175.5	171	0	116.3
364	R	23.9	Very low	25.9	Very low	227 Å²	227	158 Å²	158	86%	0.857	80%	0.796	S	S	*	*			trans	55.9	104.1	145.7	-63	180	175.5	175.5	-3	118.2
365	Q	25.8	Very low	26	Very low	188 Å²	188	159.2 Å²	159.2	88%	0.879	79%	0.792	S	S	*	*				180	178.5	115.7	-100.5	163.3	-26.5	0	0	111
366	N	25.7	Very low	25.7	Very low	167 Å²	167	161.6 Å²	161.6	89%	0.893	79%	0.793	S	S	*	*			trans	81.2	90.5	174.6	-54.6	-10.9	0	0	0	116
367	K	25.9	Very low	25.8	Very low	176 Å²	176	158.9 Å²	158.9	77%	0.765	79%	0.787	S	S	*	*			trans	-122.1	112.7	165.6	176.9	-179.6	-179.8	-174.5	0	107.5
368	Y	23.9	Very low	25.4	Very low	200 Å²	200	156.7 Å²	156.7	78%	0.784	78%	0.778	S	S	*	*	S	Bend	trans	55.4	98	170.3	-51.3	-47.3	0	0	0	117.9
369	D	23.8	Very low	25.4	Very low	160 Å²	160	155.6 Å²	155.6	86%	0.856	78%	0.775	S	S	*	*			trans	-162.1	157.5	131.5	-100.3	-30.5	0	0	0	109.3
370	I	24.8	Very low	25.2	Very low	154 Å²	154	154 Å²	154	79%	0.79	77%	0.771	S	S	*	*			trans	64.1	111.5	172.6	-23.9	-179.1	0	0	0	117
371	I	25.8	Very low	25.3	Very low	141 Å²	141	155.3 Å²	155.3	72%	0.723	77%	0.772	S	S	*	*				172.5	105.5	112.8	-82.4	160	0	0	0	108.5	K373	I371-K373 HydrophobicContact CG2-CB 4.3Å; I371-K373 HydrophobicContact CG2-CD 4.24Å
372	D	25.7	Very low	25.2	Very low	147 Å²	147	157.7 Å²	157.7	79%	0.786	77%	0.771	S	S	*	*			trans	-68.9	127.9	158.4	173.1	23	0	0	0	109.3
373	K	29.1	Very low	25	Very low	156 Å²	156	156.6 Å²	156.6	68%	0.678	76%	0.761	S	S	*	*			trans	-171.8	116.5	164.9	-110.2	153	-171	176.9	0	114.9	I371 Y375	I371-K373 HydrophobicContact CG2-CB 4.3Å; I371-K373 HydrophobicContact CG2-CD 4.24Å; K373-Y375 HydrophobicContact CB-CD2 4.36Å; K373-Y375 HydrophobicContact CB-CE2 4.33Å; K373-Y375 HydrophobicContact CD-CE2 4.32Å; K373-Y375 HydrophobicContact CG-CE2 4.13Å
374	N	23.2	Very low	24.8	Very low	148 Å²	148	153.1 Å²	153.1	79%	0.791	75%	0.751	S	S	*	*			trans	-62.4	128.1	161.6	-58.8	-75.7	0	0	0	111.9
375	Y	25.4	Very low	24.9	Very low	183 Å²	183	149.5 Å²	149.5	72%	0.718	75%	0.749	S	S	*	*			trans	-149.6	110.5	157.5	-80.2	-82.1	0	0	0	106.7	K373	K373-Y375 HydrophobicContact CB-CD2 4.36Å; K373-Y375 HydrophobicContact CB-CE2 4.33Å; K373-Y375 HydrophobicContact CD-CE2 4.32Å; K373-Y375 HydrophobicContact CG-CE2 4.13Å
376	H	23.4	Very low	25	Very low	163 Å²	163	148.4 Å²	148.4	76%	0.755	75%	0.748	S	S	*	*				45.2	96.8	78.7	-104.7	-74.2	0	0	0	114.3
377	L	26.3	Very low	24.9	Very low	144 Å²	144	146.1 Å²	146.1	75%	0.754	74%	0.741	S	S	*	*			trans	-128.6	71.2	150.7	-82.7	99.9	0	0	0	109.2
378	S	21.8	Very low	24.9	Very low	91 Å²	91	143.6 Å²	143.6	64%	0.636	74%	0.74	S	S	*	*				-61.9	146.9	102.4	-54.1	0	0	0	0	113.9
379	S	24.3	Very low	25.1	Very low	105 Å²	105	140.2 Å²	140.2	73%	0.734	74%	0.74	S	S	*	*			trans	65.9	90.3	-175	69.6	0	0	0	0	116.2
380	T	24.5	Very low	25.3	Very low	112 Å²	112	140 Å²	140	69%	0.687	74%	0.739	S	S	*	*				-168.9	83.1	107.7	33.3	0	0	0	0	110.1
381	I	25.2	Very low	25.4	Very low	143 Å²	143	139.1 Å²	139.1	73%	0.733	74%	0.736	S	S	*	*			trans	-110.4	111.6	143.9	-63.3	178.4	0	0	0	104.3	F383	I381-F383 HydrophobicContact CB-CD2 4.48Å; I381-F383 HydrophobicContact CG2-CD2 3.6Å; I381-F383 HydrophobicContact CG2-CE2 3.81Å; I381-F383 PolarHBondContact O-N 2.95Å
382	E	24.4	Very low	25.6	Very low	159 Å²	159	139.2 Å²	139.2	74%	0.743	74%	0.738	S	S	*	*			trans	-72.8	81.7	174.5	-69.2	-171.5	136.9	0	0	109.7	N384	E382-N384 PolarHBondContact O-N 3.2Å
383	F	24.6	Very low	25.7	Very low	135 Å²	135	139 Å²	139	59%	0.592	74%	0.737	S	S	*	*			trans	-72.1	66.1	159.8	-94.4	-79.5	0	0	0	109.8	I381	I381-F383 HydrophobicContact CB-CD2 4.48Å; I381-F383 HydrophobicContact CG2-CD2 3.6Å; I381-F383 HydrophobicContact CG2-CE2 3.81Å; I381-F383 PolarHBondContact O-N 2.95Å
384	N	24.4	Very low	25.5	Very low	117 Å²	117	138.1 Å²	138.1	63%	0.626	75%	0.749	S	S	*	*			trans	-69.1	131.8	161.9	-76.9	-40.5	0	0	0	107.9	E382	E382-N384 PolarHBondContact O-N 3.2Å
385	N	25.7	Very low	25.7	Very low	151 Å²	151	137.4 Å²	137.4	81%	0.807	75%	0.745	S	S	*	*	S	Bend	trans	83.2	57.1	-179	-49.9	-29.6	0	0	0	117.9
386	L	26.3	Very low	25.7	Very low	164 Å²	164	134.6 Å²	134.6	86%	0.859	74%	0.741	S	S	*	*			trans	-147.4	73.1	142.9	-108.9	137.4	0	0	0	110.9
387	T	23.9	Very low	25.7	Very low	120 Å²	120	135.1 Å²	135.1	74%	0.736	75%	0.747	S	S	*	*			trans	-79.2	160.7	167.4	42.4	0	0	0	0	111.1
388	T	27.4	Very low	25.7	Very low	123 Å²	123	136.7 Å²	136.7	76%	0.755	75%	0.751	S	S	*	*			trans	93.5	113.5	171.3	71.1	0	0	0	0	118.6
389	T	26.4	Very low	25.8	Very low	128 Å²	128	135.8 Å²	135.8	79%	0.785	76%	0.757	S	S	*	*			trans	57.7	112.5	152.1	59.5	0	0	0	0	117.9
390	N	28.3	Very low	25.9	Very low	156 Å²	156	138.1 Å²	138.1	83%	0.834	76%	0.761	S	S	*	*				-165.7	160.6	58.9	-134.7	-20.9	0	0	0	113.2
391	N	27.2	Very low	25.9	Very low	135 Å²	135	139.7 Å²	139.7	72%	0.722	77%	0.765	S	S	*	*			trans	-76.1	144.4	-177.5	-62.9	-43.9	0	0	0	113.4
392	N	30.3	Very low	25.9	Very low	144 Å²	144	144.4 Å²	144.4	77%	0.77	78%	0.775	S	S	*	*				166.7	129.7	115.3	-80.9	-28.4	0	0	0	113.9
393	N	28.3	Very low	25.7	Very low	143 Å²	143	142.9 Å²	142.9	77%	0.765	78%	0.777	S	S	*	*			trans	59.2	88.6	155.3	-62.7	-9.8	0	0	0	120.6
394	C	24.7	Very low	25.7	Very low	136 Å²	136	142.8 Å²	142.8	92%	0.919	79%	0.787	S	S	*	*				-159.1	114.1	109.7	-119.4	0	0	0	0	110.1
395	N	27.2	Very low	25.7	Very low	134 Å²	134	143 Å²	143	72%	0.717	80%	0.797	S	S	*	*			trans	-99.6	133.5	-166.6	-87.8	-17.8	0	0	0	113.9
396	I	24.6	Very low	25.5	Very low	123 Å²	123	138.9 Å²	138.9	63%	0.631	79%	0.791	S	S	*	*				45.5	115.2	125	-49.6	166.1	0	0	0	117.6	Q398	I396-Q398 HydrophobicContact CG2-CB 4.48Å; I396-Q398 HydrophobicContact CG2-CG 4.29Å
397	I	24.7	Very low	25.4	Very low	174 Å²	174	137 Å²	137	89%	0.892	78%	0.782	S	S	*	*			trans	-125.2	107.2	131.1	-61.2	-178	0	0	0	108
398	Q	25.3	Very low	25.6	Very low	177 Å²	177	140.2 Å²	140.2	83%	0.827	79%	0.788	S	S	*	*			trans	-92.6	138.4	158.9	-74.3	175.5	-38.7	0	0	107.9	I396	I396-Q398 HydrophobicContact CG2-CB 4.48Å; I396-Q398 HydrophobicContact CG2-CG 4.29Å
399	G	25.4	Very low	25.5	Very low	73 Å²	73	143.2 Å²	143.2	75%	0.753	80%	0.799	S	S	*	*			trans	174.7	117	175	0	0	0	0	0	112.6
400	N	25.8	Very low	25.5	Very low	153 Å²	153	143.5 Å²	143.5	82%	0.818	79%	0.789	S	S	*	*			trans	-85.3	161.7	-177.4	-68	-32	0	0	0	112.8
401	N	23.9	Very low	25.3	Very low	145 Å²	145	143.5 Å²	143.5	78%	0.775	79%	0.789	S	S	*	*			trans	70.2	84.2	158.8	-57.4	-16.7	0	0	0	118.9
402	Y	24.5	Very low	25.2	Very low	242 Å²	242	145.7 Å²	145.7	95%	0.949	80%	0.795	S	S	*	*			trans	-146	134.2	135.6	-89.1	-72.8	0	0	0	110.8
403	V	21.9	Very low	24.8	Very low	128 Å²	128	145 Å²	145	78%	0.776	80%	0.801	S	S	*	*			trans	-101.6	156.6	174.7	-176.3	0	0	0	0	108.4
404	T	22.9	Very low	24.7	Very low	133 Å²	133	143.4 Å²	143.4	82%	0.816	79%	0.792	S	S	*	*			trans	73.8	100.1	176.9	69.3	0	0	0	0	117.6
405	S	25.2	Very low	24.7	Very low	120 Å²	120	142.4 Å²	142.4	84%	0.839	78%	0.777	S	S	*	*				-178.9	100.2	121.7	60	0	0	0	0	110.3
406	G	21.7	Very low	24.6	Very low	66 Å²	66	143.9 Å²	143.9	68%	0.68	77%	0.774	S	S	*	*			trans	-74.1	166.7	169.2	0	0	0	0	0	112.1
407	N	24.4	Very low	24.6	Very low	125 Å²	125	146 Å²	146	67%	0.668	78%	0.781	S	S	*	*			trans	77.9	84.1	-178.4	-50.9	-64.5	0	0	0	116.5
408	H	27.1	Very low	24.7	Very low	187 Å²	187	144 Å²	144	87%	0.866	77%	0.766	S	S	*	*			trans	-144.4	6.3	147.2	-121.1	-68.8	0	0	0	116.8
409	L	26.5	Very low	24.8	Very low	186 Å²	186	139.9 Å²	139.9	97%	0.974	75%	0.75	S	S	*	*	S	Bend	trans	-100.4	50.2	163.5	-74.8	168.9	0	0	0	111.2
410	K	26.1	Very low	25.1	Very low	134 Å²	134	139.8 Å²	139.8	58%	0.583	73%	0.73	S	S	*	*			trans	-98.4	156	159.2	-91.7	-179	173.8	174.4	0	108.9
411	N	24	Very low	25.6	Very low	155 Å²	155	135.3 Å²	135.3	83%	0.829	71%	0.708	S	S	*	*			trans	75.8	63.9	174	-52.4	-15.7	0	0	0	116.6
412	Q	25.9	Very low	26	Very low	181 Å²	181	132.6 Å²	132.6	85%	0.846	69%	0.694	S	S	*	*				-147.2	122.7	127	-111.9	165.9	43.1	0	0	110.5	I414	Q412-I414 PolarHBondContact O-N 2.95Å
413	S	21.8	Very low	26.6	Very low	129 Å²	129	125.9 Å²	125.9	90%	0.902	67%	0.673	S	S	*	*			trans	-73.9	86.1	-176	30	0	0	0	0	111.2	N415	S413-N415 PolarHBondContact O-N 3.38Å
414	I	25.3	Very low	27.2	Very low	111 Å²	111	121 Å²	121	57%	0.569	64%	0.642	S	S	*	*			trans	-81.2	117.2	176	-62.6	175.6	0	0	0	109.2	Q412 Y416	Q412-I414 PolarHBondContact O-N 2.95Å; I414-Y416 PolarHBondContact O-N 2.96Å; I414-Y416 VanDerWaalsContact O-N 3.16Å
415	N	24.6	Very low	28	Very low	114 Å²	114	120.3 Å²	120.3	61%	0.61	63%	0.628	S	S	*	*			trans	-62.7	112.3	167.1	-108.2	-22.7	0	0	0	108.7	S413 Q417 K527	S413-N415 PolarHBondContact O-N 3.38Å; N415-Q417 VanDerWaalsContact C-N 3.32Å; N415-Q417 PolarHBondContact O-N 2.85Å; N415-K527 PolarHBondContact OD1-NZ 3.02Å
416	Y	25	Very low	28.8	Very low	165 Å²	165	121.7 Å²	121.7	65%	0.647	62%	0.619	S	S	*	*			trans	-70.3	92.1	168.8	-78.1	-74.5	0	0	0	109.9	I414 F418	I414-Y416 PolarHBondContact O-N 2.96Å; I414-Y416 VanDerWaalsContact O-N 3.16Å; Y416-F418 HydrophobicContact CD1-CD2 4.06Å; Y416-F418 AromaticContact CD1-CE2 3.49Å; Y416-F418 HydrophobicContact CD1-CE2 3.49Å; Y416-F418 VanDerWaalsContact CD1-CE2 3.49Å; Y416-F418 HydrophobicContact CD1-CZ 4.09Å; Y416-F418 HydrophobicContact CE1-CE2 4.03Å; Y416-F418 HydrophobicContact CE1-CZ 4.21Å; Y416-F418 HydrophobicContact CG-CE2 4.39Å
417	Q	24.9	Very low	29.6	Very low	169 Å²	169	125 Å²	125	79%	0.79	62%	0.617	S	S	*	*			trans	-122.6	93.7	160.2	-160.9	160	-2.7	0	0	105.3	N415 N419	N415-Q417 VanDerWaalsContact C-N 3.32Å; N415-Q417 PolarHBondContact O-N 2.85Å; Q417-N419 VanDerWaalsContact C-N 3.34Å; Q417-N419 PolarHBondContact O-N 3.47Å
418	F	26.8	Very low	30.7	Very low	131 Å²	131	120.2 Å²	120.2	58%	0.575	59%	0.591	S	S	*	*			trans	-65.7	89.1	-173.9	-92.6	-90.6	0	0	0	110.7	Y416 I423	Y416-F418 HydrophobicContact CD1-CD2 4.06Å; Y416-F418 AromaticContact CD1-CE2 3.49Å; Y416-F418 HydrophobicContact CD1-CE2 3.49Å; Y416-F418 VanDerWaalsContact CD1-CE2 3.49Å; Y416-F418 HydrophobicContact CD1-CZ 4.09Å; Y416-F418 HydrophobicContact CE1-CE2 4.03Å; Y416-F418 HydrophobicContact CE1-CZ 4.21Å; Y416-F418 HydrophobicContact CG-CE2 4.39Å; F418-I423 HydrophobicContact CD1-CD1 4.21Å; F418-I423 HydrophobicContact CE1-CD1 3.81Å
419	N	26.5	Very low	31.5	Very low	90 Å²	90	114.4 Å²	114.4	48%	0.481	57%	0.571	S	S	.	*			trans	-86.3	110.2	154.8	-103.4	6.5	0	0	0	106.9	Q417 T421 N422	Q417-N419 VanDerWaalsContact C-N 3.34Å; Q417-N419 PolarHBondContact O-N 3.47Å; N419-T421 PolarHBondContact O-N 3.44Å; N419-N422 HydrophobicContact CB-CB 4.44Å; N419-N422 WeakPolarHBondContact O-CB 3.22Å; N419-N422 PolarHBondContact O-N 2.82Å
420	E	33.1	Very low	32.6	Very low	71 Å²	71	110 Å²	110	33%	0.332	56%	0.556	S	S	.	*	H	α-helix	trans	-50.4	-36	-180	-62.9	172.3	136.1	0	0	111.8	N422 I424 H481	E420-N422 VanDerWaalsContact C-N 3.26Å; E420-N422 PolarHBondContact O-N 2.92Å; E420-I424 WeakPolarHBondContact O-CD1 3.45Å; E420-H481 IonicContact OE1-CE1 2.68Å; E420-H481 IonicContact OE1-ND1 2.66Å; E420-H481 IonicContact OE2-CE1 2.65Å
421	T	34.4	Very low	33.5	Very low	60 Å²	60	106.4 Å²	106.4	37%	0.368	55%	0.547	S	S	.	.	H	α-helix	trans	-64	-18	177.5	58.8	0	0	0	0	115.6	N419 K425	N419-T421 PolarHBondContact O-N 3.44Å; T421-K425 WeakPolarHBondContact O-CB 3.37Å; T421-K425 VanDerWaalsContact O-CD 3.26Å; T421-K425 WeakPolarHBondContact O-CD 3.39Å; T421-K425 WeakPolarHBondContact O-CG 3.33Å; T421-K425 PolarHBondContact O-N 3.26Å
422	N	34.3	Very low	34.7	Very low	88 Å²	88	107.1 Å²	107.1	47%	0.471	54%	0.543	S	S	.	.	H	α-helix	trans	-86.5	-33.3	-173.1	-78.8	-15.6	0	0	0	114.2	N419 E420 K426	N419-N422 HydrophobicContact CB-CB 4.44Å; N419-N422 WeakPolarHBondContact O-CB 3.22Å; N419-N422 PolarHBondContact O-N 2.82Å; E420-N422 VanDerWaalsContact C-N 3.26Å; E420-N422 PolarHBondContact O-N 2.92Å; N422-K426 PolarHBondContact O-N 3.29Å
423	I	35.5	Very low	36.3	Very low	101 Å²	101	104 Å²	104	52%	0.518	54%	0.536	S	S	.	.	H	α-helix	trans	-70.2	-47.3	177.8	-62.7	174.9	0	0	0	109.2	F418 K425 K426 E427	F418-I423 HydrophobicContact CD1-CD1 4.21Å; F418-I423 HydrophobicContact CE1-CD1 3.81Å; I423-K425 VanDerWaalsContact C-N 3.34Å; I423-K425 PolarHBondContact O-N 2.79Å; I423-K426 WeakPolarHBondContact O-CA 3.17Å; I423-K426 VanDerWaalsContact O-CB 3.3Å; I423-K426 WeakPolarHBondContact O-CB 3.37Å; I423-K426 PolarHBondContact O-N 3.3Å; I423-E427 PolarHBondContact O-N 3.31Å; I423-E427 VanDerWaalsContact O-N 3.12Å
424	I	35	Very low	38.3	Very low	25 Å²	25	105.4 Å²	105.4	13%	0.128	52%	0.523	C	S	.	.	H	α-helix	trans	-59.3	-43.6	178.9	-54.8	165.1	0	0	0	111.5	E420 K426 E427 L428 F468 W477	E420-I424 WeakPolarHBondContact O-CD1 3.45Å; I424-K426 PolarHBondContact O-N 2.94Å; I424-E427 PolarHBondContact O-N 3.46Å; I424-L428 HydrophobicContact CG2-CD1 3.96Å; I424-L428 PolarHBondContact O-N 2.86Å; I424-F468 HydrophobicContact CB-CE2 4.36Å; I424-F468 HydrophobicContact CD1-CZ 4.16Å; I424-F468 HydrophobicContact CG2-CE2 3.58Å; I424-F468 HydrophobicContact CG2-CZ 4.19Å; I424-W477 HydrophobicContact CB-CH2 4.04Å; I424-W477 HydrophobicContact CD1-CE3 4.2Å; I424-W477 HydrophobicContact CD1-CH2 3.58Å; I424-W477 HydrophobicContact CD1-CZ3 3.29Å; I424-W477 HydrophobicContact CG1-CH2 3.55Å; I424-W477 HydrophobicContact CG1-CZ3 3.68Å; I424-W477 HydrophobicContact CG2-CH2 3.33Å; I424-W477 HydrophobicContact CG2-CZ2 3.76Å; I424-W477 HydrophobicContact CG2-CZ3 4.24Å
425	K	39.5	Very low	40.5	Very low	118 Å²	118	100.5 Å²	100.5	51%	0.513	50%	0.498	S	S	.	.	H	α-helix	trans	-61.3	-29.3	174	-79.8	171.9	-173.2	167.6	0	113	T421 I423 S429	T421-K425 WeakPolarHBondContact O-CB 3.37Å; T421-K425 VanDerWaalsContact O-CD 3.26Å; T421-K425 WeakPolarHBondContact O-CD 3.39Å; T421-K425 WeakPolarHBondContact O-CG 3.33Å; T421-K425 PolarHBondContact O-N 3.26Å; I423-K425 VanDerWaalsContact C-N 3.34Å; I423-K425 PolarHBondContact O-N 2.79Å; K425-S429 WeakPolarHBondContact O-CA 3.19Å; K425-S429 WeakPolarHBondContact O-CB 3.38Å; K425-S429 PolarHBondContact O-N 2.91Å
426	K	42.1	Very low	42.8	Very low	150 Å²	150	96.2 Å²	96.2	65%	0.652	48%	0.476	S	S	*	.	H	α-helix	trans	-76.8	-36.9	178.8	-160.3	-177.9	-179.4	-171.4	0	112.1	N422 I423 I424 S429 S430	N422-K426 PolarHBondContact O-N 3.29Å; I423-K426 WeakPolarHBondContact O-CA 3.17Å; I423-K426 VanDerWaalsContact O-CB 3.3Å; I423-K426 WeakPolarHBondContact O-CB 3.37Å; I423-K426 PolarHBondContact O-N 3.3Å; I424-K426 PolarHBondContact O-N 2.94Å; K426-S429 WeakPolarHBondContact O-CB 3.44Å; K426-S430 PolarHBondContact O-OG 3.16Å
427	E	39.4	Very low	45.1	Very low	135 Å²	135	93.6 Å²	93.6	63%	0.631	47%	0.473	S	S	*	.	H	α-helix	trans	-66.3	-57.4	171.3	-72.8	-64.2	131.6	0	0	111.2	I423 I424 S429 S430	I423-E427 PolarHBondContact O-N 3.31Å; I423-E427 VanDerWaalsContact O-N 3.12Å; I424-E427 PolarHBondContact O-N 3.46Å; E427-S429 PolarHBondContact O-N 3.01Å; E427-S430 WeakPolarHBondContact O-CB 3.37Å; E427-S430 PolarHBondContact O-N 3.38Å
428	L	47.3	Very low	47.3	Very low	25 Å²	25	87.8 Å²	87.8	13%	0.131	45%	0.447	C	S	.	.	H	α-helix	trans	-61.2	-28.2	177.9	-88.3	159.7	0	0	0	113.4	I424 S430 C431 L435 Y467 F468	I424-L428 HydrophobicContact CG2-CD1 3.96Å; I424-L428 PolarHBondContact O-N 2.86Å; L428-S430 PolarHBondContact O-N 3.32Å; L428-C431 PolarHBondContact O-N 2.84Å; L428-L435 HydrophobicContact CD2-CD1 3.71Å; L428-Y467 HydrophobicContact CD1-CD1 4.46Å; L428-Y467 HydrophobicContact CD2-CD1 4.15Å; L428-Y467 HydrophobicContact CD2-CE1 4.24Å; L428-F468 HydrophobicContact CD1-CD2 4.43Å
429	S	44.2	Very low	49.5	Very low	64 Å²	64	81.5 Å²	81.5	45%	0.448	42%	0.42	S	S	.	.	H	α-helix	trans	-53	-36.8	171.1	160.6	0	0	0	0	112.2	K425 K426 E427 K460	K425-S429 WeakPolarHBondContact O-CA 3.19Å; K425-S429 WeakPolarHBondContact O-CB 3.38Å; K425-S429 PolarHBondContact O-N 2.91Å; K426-S429 WeakPolarHBondContact O-CB 3.44Å; E427-S429 PolarHBondContact O-N 3.01Å; S429-K460 PolarHBondContact O-NZ 3.33Å
430	S	49	Very low	52	Low	93 Å²	93	80.1 Å²	80.1	65%	0.65	41%	0.409	S	S	*	.	H	α-helix	trans	-78.6	-29.8	-174	-53.7	0	0	0	0	113.3	K426 E427 L428 K432	K426-S430 PolarHBondContact O-OG 3.16Å; E427-S430 WeakPolarHBondContact O-CB 3.37Å; E427-S430 PolarHBondContact O-N 3.38Å; L428-S430 PolarHBondContact O-N 3.32Å; S430-K432 PolarHBondContact O-N 3.41Å
431	C	44.5	Very low	53.6	Low	60 Å²	60	79.4 Å²	79.4	41%	0.405	41%	0.412	S	S	.	.			trans	-80.3	45.9	-174.8	-71.4	0	0	0	0	114.8	L428 T433 Y434 L435	L428-C431 PolarHBondContact O-N 2.84Å; C431-T433 VanDerWaalsContact C-N 3.26Å; C431-T433 PolarHBondContact O-N 3.24Å; C431-T433 VanDerWaalsContact O-N 3.16Å; C431-Y434 PolarHBondContact O-N 2.91Å; C431-L435 PolarHBondContact O-N 3.32Å
432	K	50.2	Low	55.1	Low	169 Å²	169	77.5 Å²	77.5	74%	0.735	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.3	-38	-176.3	-120.6	-177.6	-178.1	-178.8	0	114.3	S430	S430-K432 PolarHBondContact O-N 3.41Å
433	T	58.4	Low	56.8	Low	115 Å²	115	75.3 Å²	75.3	71%	0.706	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.4	-26.4	-176	-8.7	0	0	0	0	113.5	C431	C431-T433 VanDerWaalsContact C-N 3.26Å; C431-T433 PolarHBondContact O-N 3.24Å; C431-T433 VanDerWaalsContact O-N 3.16Å
434	Y	64	Low	58.4	Low	160 Å²	160	77 Å²	77	63%	0.627	40%	0.397	S	S	*	.	H	α-helix	trans	-86.1	-33.7	-174.1	-92	-90	0	0	0	112.9	C431 P436 L437 L438	C431-Y434 PolarHBondContact O-N 2.91Å; Y434-P436 VanDerWaalsContact C-CD 3.48Å; Y434-L437 PolarHBondContact O-N 3.12Å; Y434-L437 VanDerWaalsContact O-N 3.12Å; Y434-L438 VanDerWaalsContact O-CB 3.3Å; Y434-L438 WeakPolarHBondContact O-CB 3.03Å; Y434-L438 PolarHBondContact O-N 3.37Å
435	L	71.8	Confident	59.6	Low	7 Å²	7	81.9 Å²	81.9	4%	0.037	42%	0.423	C	S	.	.	H	α-helix	trans	-55.1	-41.8	-172.6	-159.2	68.5	0	0	0	114.9	L428 C431 L438 I439 M463 E464 Y467	L428-L435 HydrophobicContact CD2-CD1 3.71Å; C431-L435 PolarHBondContact O-N 3.32Å; L435-L438 PolarHBondContact O-N 2.91Å; L435-I439 HydrophobicContact CG-CD1 4.22Å; L435-I439 VanDerWaalsContact O-CG1 3.3Å; L435-I439 WeakPolarHBondContact O-CG1 3.33Å; L435-I439 PolarHBondContact O-N 3Å; L435-M463 HydrophobicContact CD2-CB 3.64Å; L435-M463 HydrophobicContact CG-CB 4.16Å; L435-E464 HydrophobicContact CD2-CG 3.72Å; L435-Y467 HydrophobicContact CD1-CD1 4.32Å; L435-Y467 HydrophobicContact CD1-CD2 4.44Å; L435-Y467 HydrophobicContact CD1-CG 4.04Å
436	P	72.4	Confident	60.6	Low	25 Å²	25	78.5 Å²	78.5	16%	0.162	41%	0.41	C	S	.	.	H	α-helix	trans	-68.9	-40.8	176.7	-13.5	27.3	0	0	0	112.6	Y434 L438 I439 K440 M463	Y434-P436 VanDerWaalsContact C-CD 3.48Å; P436-L438 VanDerWaalsContact C-N 3.3Å; P436-L438 PolarHBondContact O-N 2.93Å; P436-I439 PolarHBondContact O-N 3.32Å; P436-K440 WeakPolarHBondContact O-CB 3.25Å; P436-K440 WeakPolarHBondContact O-CG 3Å; P436-K440 PolarHBondContact O-N 2.85Å; P436-M463 HydrophobicContact CB-CE 4.41Å; P436-M463 HydrophobicContact CB-SD 4.03Å; P436-M463 HydrophobicContact CG-CE 4Å; P436-M463 HydrophobicContact CG-SD 3.76Å
437	L	73.6	Confident	61.5	Low	109 Å²	109	78.4 Å²	78.4	57%	0.571	42%	0.417	S	S	*	.	H	α-helix	trans	-63.9	-38.6	176.8	-65.8	174.8	0	0	0	111.2	Y434 K440 S441	Y434-L437 PolarHBondContact O-N 3.12Å; Y434-L437 VanDerWaalsContact O-N 3.12Å; L437-K440 PolarHBondContact O-N 3.38Å; L437-S441 WeakPolarHBondContact O-CB 3.14Å; L437-S441 PolarHBondContact O-N 3.26Å
438	L	71.6	Confident	62.8	Low	47 Å²	47	73.6 Å²	73.6	25%	0.246	40%	0.396	C	S	.	.	H	α-helix	trans	-67.6	-46.5	179.5	-154.3	61.8	0	0	0	110.7	Y434 L435 P436 K440 S441 T442 Y467	Y434-L438 VanDerWaalsContact O-CB 3.3Å; Y434-L438 WeakPolarHBondContact O-CB 3.03Å; Y434-L438 PolarHBondContact O-N 3.37Å; L435-L438 PolarHBondContact O-N 2.91Å; P436-L438 VanDerWaalsContact C-N 3.3Å; P436-L438 PolarHBondContact O-N 2.93Å; L438-K440 VanDerWaalsContact C-N 3.33Å; L438-K440 PolarHBondContact O-N 2.73Å; L438-S441 WeakPolarHBondContact O-CB 3.39Å; L438-S441 PolarHBondContact O-N 2.67Å; L438-T442 PolarHBondContact O-N 2.85Å; L438-T442 PolarHBondContact O-OG1 3.19Å; L438-Y467 HydrophobicContact CB-CE2 4.46Å; L438-Y467 HydrophobicContact CD2-CD2 4.27Å; L438-Y467 HydrophobicContact CD2-CE2 3.37Å; L438-Y467 WeakPolarHBondContact CD2-OH 3.49Å; L438-Y467 HydrophobicContact CG-CD2 4.49Å; L438-Y467 HydrophobicContact CG-CE2 3.69Å
439	I	73.1	Confident	63.8	Low	0 Å²	0	82 Å²	82	0%	0	43%	0.434	C	S	.	.	H	α-helix	trans	-64.5	-35.5	175.1	-65.2	166.9	0	0	0	111.7	L435 P436 K443 L448 I455 M463 I466 Y467	L435-I439 HydrophobicContact CG-CD1 4.22Å; L435-I439 VanDerWaalsContact O-CG1 3.3Å; L435-I439 WeakPolarHBondContact O-CG1 3.33Å; L435-I439 PolarHBondContact O-N 3Å; P436-I439 PolarHBondContact O-N 3.32Å; I439-K443 WeakPolarHBondContact O-CA 3.27Å; I439-K443 WeakPolarHBondContact O-CB 2.91Å; I439-K443 PolarHBondContact O-N 3.46Å; I439-L448 HydrophobicContact CG2-CD1 4.34Å; I439-I455 HydrophobicContact CB-CG2 4.2Å; I439-I455 HydrophobicContact CG2-CD1 4.13Å; I439-I455 HydrophobicContact CG2-CG1 4.43Å; I439-I455 HydrophobicContact CG2-CG2 3.96Å; I439-M463 HydrophobicContact CD1-CB 3.54Å; I439-M463 HydrophobicContact CD1-CG 3.82Å; I439-M463 WeakPolarHBondContact CD1-O 3.19Å; I439-M463 HydrophobicContact CD1-SD 4.27Å; I439-I466 HydrophobicContact CG2-CG2 4.44Å; I439-Y467 HydrophobicContact CG1-CD2 4.3Å
440	K	77.7	Confident	65	Low	60 Å²	60	80.5 Å²	80.5	26%	0.261	42%	0.421	S	S	.	.	H	α-helix	trans	-66	-42.9	172.2	-77.6	172.8	171.7	179.1	0	112.1	P436 L437 L438 K443 D452 I455 D456	P436-K440 WeakPolarHBondContact O-CB 3.25Å; P436-K440 WeakPolarHBondContact O-CG 3Å; P436-K440 PolarHBondContact O-N 2.85Å; L437-K440 PolarHBondContact O-N 3.38Å; L438-K440 VanDerWaalsContact C-N 3.33Å; L438-K440 PolarHBondContact O-N 2.73Å; K440-K443 WeakPolarHBondContact O-CB 3.44Å; K440-K443 PolarHBondContact O-N 3.08Å; K440-D452 VanDerWaalsContact CE-O 3.24Å; K440-D452 WeakPolarHBondContact CE-O 3.45Å; K440-I455 HydrophobicContact CG-CB 4.42Å; K440-I455 HydrophobicContact CG-CD1 3.93Å; K440-I455 HydrophobicContact CG-CG2 4.18Å; K440-D456 WeakPolarHBondContact CE-OD1 3.44Å; K440-D456 IonicContact NZ-OD1 3.76Å; K440-D456 PolarHBondContact NZ-OD1 3.29Å; K440-D456 IonicContact NZ-OD2 3.35Å; K440-D456 PolarHBondContact NZ-OD2 3.01Å
441	S	68.6	Low	66.3	Low	57 Å²	57	80.2 Å²	80.2	40%	0.399	41%	0.412	S	S	.	.	H	α-helix	trans	-62.4	-42.8	177	-174.3	0	0	0	0	112.2	L437 L438	L437-S441 WeakPolarHBondContact O-CB 3.14Å; L437-S441 PolarHBondContact O-N 3.26Å; L438-S441 WeakPolarHBondContact O-CB 3.39Å; L438-S441 PolarHBondContact O-N 2.67Å
442	T	64.5	Low	67.8	Low	20 Å²	20	81.2 Å²	81.2	12%	0.123	41%	0.413	C	S	.	.	H	α-helix	trans	-91.9	-0.6	-177.1	59	0	0	0	0	113.5	L438 N444 D445 L446	L438-T442 PolarHBondContact O-N 2.85Å; L438-T442 PolarHBondContact O-OG1 3.19Å; T442-N444 PolarHBondContact O-N 2.93Å; T442-N444 VanDerWaalsContact O-N 3.11Å; T442-D445 PolarHBondContact O-N 3Å; T442-L446 WeakPolarHBondContact O-CB 3.22Å; T442-L446 WeakPolarHBondContact O-CG 3.42Å; T442-L446 PolarHBondContact O-N 2.99Å; T442-L446 WeakPolarHBondContact OG1-CD1 3.45Å
443	K	70	Confident	69	Low	42 Å²	42	76.3 Å²	76.3	18%	0.183	40%	0.404	C	S	.	.	T	Hydrogen-bonded Turn	trans	-49.9	-41.4	-178.1	171	175.6	158	173.5	0	113.4	I439 K440 N447 L448 I450 D452 I455	I439-K443 WeakPolarHBondContact O-CA 3.27Å; I439-K443 WeakPolarHBondContact O-CB 2.91Å; I439-K443 PolarHBondContact O-N 3.46Å; K440-K443 WeakPolarHBondContact O-CB 3.44Å; K440-K443 PolarHBondContact O-N 3.08Å; K443-N447 PolarHBondContact O-N 3.07Å; K443-L448 HydrophobicContact CG-CB 4.3Å; K443-L448 WeakPolarHBondContact CG-O 3.23Å; K443-L448 PolarHBondContact O-N 2.76Å; K443-L448 VanDerWaalsContact O-N 3.1Å; K443-I450 WeakPolarHBondContact CE-O 3.3Å; K443-I450 PolarHBondContact NZ-O 3.16Å; K443-D452 WeakPolarHBondContact CD-OD1 3.36Å; K443-D452 IonicContact NZ-OD1 3.56Å; K443-D452 PolarHBondContact NZ-OD1 3.19Å; K443-I455 HydrophobicContact CD-CD1 4.17Å
444	N	68.5	Low	69.8	Low	136 Å²	136	76.9 Å²	76.9	73%	0.727	40%	0.397	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.7	-43	178.8	-67.7	-18.8	0	0	0	111.8	T442 L446 N447	T442-N444 PolarHBondContact O-N 2.93Å; T442-N444 VanDerWaalsContact O-N 3.11Å; N444-L446 PolarHBondContact O-N 2.85Å; N444-N447 PolarHBondContact O-N 2.81Å
445	D	61.3	Low	70.2	Confident	127 Å²	127	69.3 Å²	69.3	68%	0.679	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.2	-27.9	178.1	-52.7	-39.8	0	0	0	112.1	T442	T442-D445 PolarHBondContact O-N 3Å
446	L	60.8	Low	70.4	Confident	47 Å²	47	73.2 Å²	73.2	25%	0.246	39%	0.388	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.9	4.2	-175.6	-60.4	175.9	0	0	0	114.1	T442 N444 L448 S470	T442-L446 WeakPolarHBondContact O-CB 3.22Å; T442-L446 WeakPolarHBondContact O-CG 3.42Å; T442-L446 PolarHBondContact O-N 2.99Å; T442-L446 WeakPolarHBondContact OG1-CD1 3.45Å; N444-L446 PolarHBondContact O-N 2.85Å; L446-L448 HydrophobicContact CB-CD1 3.74Å; L446-L448 HydrophobicContact CB-CG 3.77Å; L446-L448 HydrophobicContact CD1-CD1 3.86Å; L446-L448 HydrophobicContact CG-CD1 4.48Å; L446-L448 PolarHBondContact O-N 2.81Å; L446-S470 VanDerWaalsContact CD1-CB 3.45Å; L446-S470 WeakPolarHBondContact CD1-OG 3.4Å; L446-S470 VanDerWaalsContact CD2-CB 3.44Å
447	N	61	Low	70.6	Confident	149 Å²	149	78.9 Å²	78.9	80%	0.797	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.4	29.5	-175	-88.8	-47	0	0	0	113.8	K443 N444 Q449	K443-N447 PolarHBondContact O-N 3.07Å; N444-N447 PolarHBondContact O-N 2.81Å; N447-Q449 PolarHBondContact O-N 3.3Å; N447-Q449 VanDerWaalsContact O-N 3.14Å
448	L	66.7	Low	70.7	Confident	34 Å²	34	74.4 Å²	74.4	18%	0.178	39%	0.393	C	S	.	.			trans	-78.7	102.4	-175.3	-74.6	169.3	0	0	0	110.8	I439 K443 L446 I450 I466	I439-L448 HydrophobicContact CG2-CD1 4.34Å; K443-L448 HydrophobicContact CG-CB 4.3Å; K443-L448 WeakPolarHBondContact CG-O 3.23Å; K443-L448 PolarHBondContact O-N 2.76Å; K443-L448 VanDerWaalsContact O-N 3.1Å; L446-L448 HydrophobicContact CB-CD1 3.74Å; L446-L448 HydrophobicContact CB-CG 3.77Å; L446-L448 HydrophobicContact CD1-CD1 3.86Å; L446-L448 HydrophobicContact CG-CD1 4.48Å; L446-L448 PolarHBondContact O-N 2.81Å; L448-I450 HydrophobicContact CB-CG1 4.39Å; L448-I450 HydrophobicContact CD2-CD1 4.06Å; L448-I450 PolarHBondContact O-N 3.24Å; L448-I466 HydrophobicContact CD1-CG2 3.56Å; L448-I466 HydrophobicContact CD2-CG2 4.09Å
449	Q	68.7	Low	71.1	Confident	201 Å²	201	76.3 Å²	76.3	94%	0.939	41%	0.409	S	S	*	.			trans	-73.6	59	169.8	-63.4	-173.1	0.9	0	0	111.8	N447	N447-Q449 PolarHBondContact O-N 3.3Å; N447-Q449 VanDerWaalsContact O-N 3.14Å
450	I	68.8	Low	71	Confident	32 Å²	32	79.8 Å²	79.8	16%	0.164	42%	0.424	C	S	.	.			trans	-120.1	124.8	176.9	-52.7	179.7	0	0	0	108.4	K443 L448 K454 I455 I466	K443-I450 WeakPolarHBondContact CE-O 3.3Å; K443-I450 PolarHBondContact NZ-O 3.16Å; L448-I450 HydrophobicContact CB-CG1 4.39Å; L448-I450 HydrophobicContact CD2-CD1 4.06Å; L448-I450 PolarHBondContact O-N 3.24Å; I450-K454 HydrophobicContact CG2-CB 3.81Å; I450-I455 HydrophobicContact CB-CG1 4.28Å; I450-I455 HydrophobicContact CG2-CG1 3.72Å; I450-I466 HydrophobicContact CD1-CD1 3.82Å
451	D	76.2	Confident	70.8	Confident	87 Å²	87	83.4 Å²	83.4	47%	0.465	45%	0.445	S	S	.	.			trans	-61.4	142.6	175.4	-53.3	-56.5	0	0	0	111.1	A453 K454 I455	D451-A453 PolarHBondContact O-N 2.92Å; D451-A453 VanDerWaalsContact O-N 3.16Å; D451-K454 HydrophobicContact CB-CB 4.41Å; D451-K454 HydrophobicContact CB-CD 4.16Å; D451-K454 HydrophobicContact CB-CG 4.24Å; D451-K454 WeakPolarHBondContact O-CA 3.28Å; D451-K454 WeakPolarHBondContact O-CB 3.3Å; D451-K454 PolarHBondContact O-N 2.79Å; D451-K454 WeakPolarHBondContact OD2-CD 3.26Å; D451-K454 VanDerWaalsContact OD2-CE 3.22Å; D451-K454 WeakPolarHBondContact OD2-CE 3.48Å; D451-K454 IonicContact OD2-NZ 3.59Å; D451-K454 PolarHBondContact OD2-NZ 2.87Å; D451-I455 PolarHBondContact O-N 3.07Å
452	D	75.7	Confident	71.2	Confident	81 Å²	81	86.3 Å²	86.3	43%	0.433	45%	0.45	S	S	.	.	H	α-helix	trans	-61	-33.5	-173.5	-63.5	-7.9	0	0	0	112.5	K440 K443 I455 D456	K440-D452 VanDerWaalsContact CE-O 3.24Å; K440-D452 WeakPolarHBondContact CE-O 3.45Å; K443-D452 WeakPolarHBondContact CD-OD1 3.36Å; K443-D452 IonicContact NZ-OD1 3.56Å; K443-D452 PolarHBondContact NZ-OD1 3.19Å; D452-I455 WeakPolarHBondContact O-CB 3.3Å; D452-I455 PolarHBondContact O-N 2.62Å; D452-D456 PolarHBondContact O-N 3.11Å
453	A	75.1	Confident	71.6	Confident	66 Å²	66	86.2 Å²	86.2	55%	0.545	45%	0.448	S	S	.	.	H	α-helix	trans	-64.3	-36.6	172.3	0	0	0	0	0	112.8	D451 I455 D456 D457	D451-A453 PolarHBondContact O-N 2.92Å; D451-A453 VanDerWaalsContact O-N 3.16Å; A453-I455 VanDerWaalsContact C-N 3.25Å; A453-I455 PolarHBondContact O-N 3.12Å; A453-D456 PolarHBondContact O-N 3.48Å; A453-D457 PolarHBondContact O-N 3.09Å
454	K	76.6	Confident	71.7	Confident	127 Å²	127	86.5 Å²	86.5	55%	0.552	45%	0.45	S	S	*	.	H	α-helix	trans	-71.4	-19.5	175.2	-71.6	174	-177.7	153.1	0	112.6	I450 D451 M458	I450-K454 HydrophobicContact CG2-CB 3.81Å; D451-K454 HydrophobicContact CB-CB 4.41Å; D451-K454 HydrophobicContact CB-CD 4.16Å; D451-K454 HydrophobicContact CB-CG 4.24Å; D451-K454 WeakPolarHBondContact O-CA 3.28Å; D451-K454 WeakPolarHBondContact O-CB 3.3Å; D451-K454 PolarHBondContact O-N 2.79Å; D451-K454 WeakPolarHBondContact OD2-CD 3.26Å; D451-K454 VanDerWaalsContact OD2-CE 3.22Å; D451-K454 WeakPolarHBondContact OD2-CE 3.48Å; D451-K454 IonicContact OD2-NZ 3.59Å; D451-K454 PolarHBondContact OD2-NZ 2.87Å; K454-M458 WeakPolarHBondContact O-CB 3.42Å; K454-M458 PolarHBondContact O-N 2.82Å
455	I	71.9	Confident	71.9	Confident	1 Å²	1	86.3 Å²	86.3	1%	0.005	44%	0.443	C	S	.	.	H	α-helix	trans	-74.2	-42	173.9	-61.4	170.2	0	0	0	110	I439 K440 K443 I450 D451 D452 A453 D457 M458 M463	I439-I455 HydrophobicContact CB-CG2 4.2Å; I439-I455 HydrophobicContact CG2-CD1 4.13Å; I439-I455 HydrophobicContact CG2-CG1 4.43Å; I439-I455 HydrophobicContact CG2-CG2 3.96Å; K440-I455 HydrophobicContact CG-CB 4.42Å; K440-I455 HydrophobicContact CG-CD1 3.93Å; K440-I455 HydrophobicContact CG-CG2 4.18Å; K443-I455 HydrophobicContact CD-CD1 4.17Å; I450-I455 HydrophobicContact CB-CG1 4.28Å; I450-I455 HydrophobicContact CG2-CG1 3.72Å; D451-I455 PolarHBondContact O-N 3.07Å; D452-I455 WeakPolarHBondContact O-CB 3.3Å; D452-I455 PolarHBondContact O-N 2.62Å; A453-I455 VanDerWaalsContact C-N 3.25Å; A453-I455 PolarHBondContact O-N 3.12Å; I455-D457 PolarHBondContact O-N 3.13Å; I455-M458 HydrophobicContact CG2-CE 4.45Å; I455-M458 VanDerWaalsContact O-CB 3.23Å; I455-M458 WeakPolarHBondContact O-CB 3.43Å; I455-M458 PolarHBondContact O-N 3.14Å; I455-M463 WeakPolarHBondContact O-CE 3.33Å
456	D	76	Confident	72.4	Confident	90 Å²	90	81.3 Å²	81.3	48%	0.481	42%	0.416	S	S	.	.	H	α-helix	trans	-64.4	-39.5	177.8	-65.4	-40.2	0	0	0	112.4	K440 D452 A453 M458	K440-D456 WeakPolarHBondContact CE-OD1 3.44Å; K440-D456 IonicContact NZ-OD1 3.76Å; K440-D456 PolarHBondContact NZ-OD1 3.29Å; K440-D456 IonicContact NZ-OD2 3.35Å; K440-D456 PolarHBondContact NZ-OD2 3.01Å; D452-D456 PolarHBondContact O-N 3.11Å; A453-D456 PolarHBondContact O-N 3.48Å; D456-M458 PolarHBondContact O-N 3.36Å
457	D	77.2	Confident	72.7	Confident	144 Å²	144	80.4 Å²	80.4	77%	0.77	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.2	-1.6	177	-75.2	-28.1	0	0	0	114.2	A453 I455	A453-D457 PolarHBondContact O-N 3.09Å; I455-D457 PolarHBondContact O-N 3.13Å
458	M	75.4	Confident	72.9	Confident	14 Å²	14	76.2 Å²	76.2	7%	0.069	38%	0.384	C	S	.	.	S	Bend	trans	-76.7	135.2	-170.9	-166.8	144.1	61.1	0	0	112.3	K454 I455 D456 K460 K462 M463 I466	K454-M458 WeakPolarHBondContact O-CB 3.42Å; K454-M458 PolarHBondContact O-N 2.82Å; I455-M458 HydrophobicContact CG2-CE 4.45Å; I455-M458 VanDerWaalsContact O-CB 3.23Å; I455-M458 WeakPolarHBondContact O-CB 3.43Å; I455-M458 PolarHBondContact O-N 3.14Å; D456-M458 PolarHBondContact O-N 3.36Å; M458-K460 PolarHBondContact O-N 3.33Å; M458-K462 HydrophobicContact CG-CB 3.82Å; M458-K462 HydrophobicContact CG-CD 3.86Å; M458-K462 HydrophobicContact CG-CG 3.87Å; M458-K462 HydrophobicContact SD-CB 4.36Å; M458-K462 HydrophobicContact SD-CD 3.72Å; M458-K462 HydrophobicContact SD-CG 3.76Å; M458-M463 HydrophobicContact CB-CE 4.21Å; M458-M463 HydrophobicContact CB-CG 3.89Å; M458-M463 HydrophobicContact CE-CG 3.84Å; M458-M463 HydrophobicContact CG-CG 4.02Å; M458-M463 WeakPolarHBondContact O-CE 3.22Å; M458-I466 HydrophobicContact CE-CD1 3.47Å; M458-I466 VanDerWaalsContact CE-CD1 3.47Å; M458-I466 HydrophobicContact SD-CD1 3.47Å; M458-I466 WeakPolarHBondContact SD-CD1 3.41Å
459	P	78.6	Confident	72.8	Confident	87 Å²	87	78.2 Å²	78.2	57%	0.565	40%	0.395	S	S	*	.			trans	-58.4	138.7	175.1	-25.5	34.4	0	0	0	111.7	I461 K462 M463	P459-I461 PolarHBondContact O-N 2.85Å; P459-I461 VanDerWaalsContact O-N 3.13Å; P459-K462 HydrophobicContact CB-CB 4.38Å; P459-K462 CarbonylContact O-C 3.35Å; P459-K462 WeakPolarHBondContact O-CA 3.4Å; P459-K462 WeakPolarHBondContact O-CB 3.44Å; P459-K462 PolarHBondContact O-N 3.47Å; P459-M463 PolarHBondContact O-N 2.77Å
460	K	71.7	Confident	72.5	Confident	73 Å²	73	70 Å²	70	32%	0.317	36%	0.36	S	S	.	.	H	α-helix	trans	-48.9	-43.6	179.8	176.2	168.6	172.4	163.4	0	112.9	S429 M458 K462 M463 E464	S429-K460 PolarHBondContact O-NZ 3.33Å; M458-K460 PolarHBondContact O-N 3.33Å; K460-K462 VanDerWaalsContact C-N 3.25Å; K460-K462 PolarHBondContact O-N 2.9Å; K460-M463 PolarHBondContact O-N 2.85Å; K460-E464 WeakPolarHBondContact CE-OE1 3.38Å; K460-E464 HydrophobicContact CG-CG 4.15Å; K460-E464 IonicContact NZ-OE1 3.13Å; K460-E464 WeakPolarHBondContact O-CB 3.27Å; K460-E464 WeakPolarHBondContact O-CG 3.42Å; K460-E464 PolarHBondContact O-N 2.76Å
461	I	72.6	Confident	72.3	Confident	137 Å²	137	70.3 Å²	70.3	70%	0.703	36%	0.361	S	S	*	.	H	α-helix	trans	-60.1	-34.7	177	-61	169.6	0	0	0	112	P459 K465	P459-I461 PolarHBondContact O-N 2.85Å; P459-I461 VanDerWaalsContact O-N 3.13Å; I461-K465 VanDerWaalsContact O-CB 3.22Å; I461-K465 WeakPolarHBondContact O-CB 3.31Å; I461-K465 PolarHBondContact O-N 3.42Å
462	K	78.2	Confident	71.3	Confident	118 Å²	118	70.9 Å²	70.9	51%	0.513	36%	0.36	S	S	.	.	H	α-helix	trans	-79.3	-35.9	177.8	-170.9	178.6	173.2	-170.5	0	111.7	M458 P459 K460 I466	M458-K462 HydrophobicContact CG-CB 3.82Å; M458-K462 HydrophobicContact CG-CD 3.86Å; M458-K462 HydrophobicContact CG-CG 3.87Å; M458-K462 HydrophobicContact SD-CB 4.36Å; M458-K462 HydrophobicContact SD-CD 3.72Å; M458-K462 HydrophobicContact SD-CG 3.76Å; P459-K462 HydrophobicContact CB-CB 4.38Å; P459-K462 CarbonylContact O-C 3.35Å; P459-K462 WeakPolarHBondContact O-CA 3.4Å; P459-K462 WeakPolarHBondContact O-CB 3.44Å; P459-K462 PolarHBondContact O-N 3.47Å; K460-K462 VanDerWaalsContact C-N 3.25Å; K460-K462 PolarHBondContact O-N 2.9Å; K462-I466 HydrophobicContact CG-CD1 4.08Å; K462-I466 WeakPolarHBondContact O-CB 3.23Å; K462-I466 WeakPolarHBondContact O-CG1 3.27Å; K462-I466 PolarHBondContact O-N 3.05Å
463	M	72.9	Confident	70.2	Confident	17 Å²	17	72.9 Å²	72.9	8%	0.084	37%	0.371	C	S	.	.	H	α-helix	trans	-62.1	-50	168.4	-73.7	-164.9	-133	0	0	111.5	L435 P436 I439 I455 M458 P459 K460 K465 I466 Y467	L435-M463 HydrophobicContact CD2-CB 3.64Å; L435-M463 HydrophobicContact CG-CB 4.16Å; P436-M463 HydrophobicContact CB-CE 4.41Å; P436-M463 HydrophobicContact CB-SD 4.03Å; P436-M463 HydrophobicContact CG-CE 4Å; P436-M463 HydrophobicContact CG-SD 3.76Å; I439-M463 HydrophobicContact CD1-CB 3.54Å; I439-M463 HydrophobicContact CD1-CG 3.82Å; I439-M463 WeakPolarHBondContact CD1-O 3.19Å; I439-M463 HydrophobicContact CD1-SD 4.27Å; I455-M463 WeakPolarHBondContact O-CE 3.33Å; M458-M463 HydrophobicContact CB-CE 4.21Å; M458-M463 HydrophobicContact CB-CG 3.89Å; M458-M463 HydrophobicContact CE-CG 3.84Å; M458-M463 HydrophobicContact CG-CG 4.02Å; M458-M463 WeakPolarHBondContact O-CE 3.22Å; P459-M463 PolarHBondContact O-N 2.77Å; K460-M463 PolarHBondContact O-N 2.85Å; M463-K465 VanDerWaalsContact C-N 3.33Å; M463-K465 PolarHBondContact O-N 2.77Å; M463-I466 PolarHBondContact O-N 2.85Å; M463-Y467 WeakPolarHBondContact O-CB 2.99Å; M463-Y467 PolarHBondContact O-N 2.71Å
464	E	71.4	Confident	69.5	Low	48 Å²	48	71.3 Å²	71.3	22%	0.224	36%	0.356	C	S	.	.	H	α-helix	trans	-56.5	-48.4	175.7	-75.3	174.3	158.1	0	0	110.1	L435 K460 Y467 F468	L435-E464 HydrophobicContact CD2-CG 3.72Å; K460-E464 WeakPolarHBondContact CE-OE1 3.38Å; K460-E464 HydrophobicContact CG-CG 4.15Å; K460-E464 IonicContact NZ-OE1 3.13Å; K460-E464 WeakPolarHBondContact O-CB 3.27Å; K460-E464 WeakPolarHBondContact O-CG 3.42Å; K460-E464 PolarHBondContact O-N 2.76Å; E464-Y467 PolarHBondContact O-N 2.8Å; E464-F468 VanDerWaalsContact O-CB 3.27Å; E464-F468 WeakPolarHBondContact O-CB 3.2Å; E464-F468 PolarHBondContact O-N 3.44Å
465	K	73.9	Confident	68.3	Low	132 Å²	132	69.3 Å²	69.3	57%	0.574	36%	0.357	S	S	*	.	H	α-helix	trans	-60.1	-48.1	176.6	-179.9	169.7	179	179.6	0	112.2	I461 M463 Y467 F468 D469	I461-K465 VanDerWaalsContact O-CB 3.22Å; I461-K465 WeakPolarHBondContact O-CB 3.31Å; I461-K465 PolarHBondContact O-N 3.42Å; M463-K465 VanDerWaalsContact C-N 3.33Å; M463-K465 PolarHBondContact O-N 2.77Å; K465-Y467 PolarHBondContact O-N 3.09Å; K465-F468 PolarHBondContact O-N 3.29Å; K465-D469 WeakPolarHBondContact CE-OD2 3.35Å; K465-D469 WeakPolarHBondContact CG-OD2 3.07Å; K465-D469 VanDerWaalsContact O-CB 3.25Å; K465-D469 WeakPolarHBondContact O-CB 3.44Å; K465-D469 VanDerWaalsContact O-CG 3.28Å; K465-D469 PolarHBondContact O-N 3.29Å
466	I	70.3	Confident	67.3	Low	23 Å²	23	74.5 Å²	74.5	12%	0.118	38%	0.38	C	S	.	.	H	α-helix	trans	-60	-47.6	178.1	-77.1	163.5	0	0	0	110.5	I439 L448 I450 M458 K462 M463 F468 D469 S470	I439-I466 HydrophobicContact CG2-CG2 4.44Å; L448-I466 HydrophobicContact CD1-CG2 3.56Å; L448-I466 HydrophobicContact CD2-CG2 4.09Å; I450-I466 HydrophobicContact CD1-CD1 3.82Å; M458-I466 HydrophobicContact CE-CD1 3.47Å; M458-I466 VanDerWaalsContact CE-CD1 3.47Å; M458-I466 HydrophobicContact SD-CD1 3.47Å; M458-I466 WeakPolarHBondContact SD-CD1 3.41Å; K462-I466 HydrophobicContact CG-CD1 4.08Å; K462-I466 WeakPolarHBondContact O-CB 3.23Å; K462-I466 WeakPolarHBondContact O-CG1 3.27Å; K462-I466 PolarHBondContact O-N 3.05Å; M463-I466 PolarHBondContact O-N 2.85Å; I466-F468 VanDerWaalsContact C-N 3.35Å; I466-F468 PolarHBondContact O-N 2.88Å; I466-D469 PolarHBondContact O-N 3.17Å; I466-S470 WeakPolarHBondContact O-CB 2.99Å; I466-S470 PolarHBondContact O-N 3.49Å; I466-S470 PolarHBondContact O-OG 3.44Å
467	Y	66.9	Low	65.9	Low	27 Å²	27	71.6 Å²	71.6	11%	0.106	36%	0.362	C	S	.	.	H	α-helix	trans	-62.6	-39.9	178.3	-172.5	-96.4	0	0	0	112.3	L428 L435 L438 I439 M463 E464 K465 S470 M471	L428-Y467 HydrophobicContact CD1-CD1 4.46Å; L428-Y467 HydrophobicContact CD2-CD1 4.15Å; L428-Y467 HydrophobicContact CD2-CE1 4.24Å; L435-Y467 HydrophobicContact CD1-CD1 4.32Å; L435-Y467 HydrophobicContact CD1-CD2 4.44Å; L435-Y467 HydrophobicContact CD1-CG 4.04Å; L438-Y467 HydrophobicContact CB-CE2 4.46Å; L438-Y467 HydrophobicContact CD2-CD2 4.27Å; L438-Y467 HydrophobicContact CD2-CE2 3.37Å; L438-Y467 WeakPolarHBondContact CD2-OH 3.49Å; L438-Y467 HydrophobicContact CG-CD2 4.49Å; L438-Y467 HydrophobicContact CG-CE2 3.69Å; I439-Y467 HydrophobicContact CG1-CD2 4.3Å; M463-Y467 WeakPolarHBondContact O-CB 2.99Å; M463-Y467 PolarHBondContact O-N 2.71Å; E464-Y467 PolarHBondContact O-N 2.8Å; K465-Y467 PolarHBondContact O-N 3.09Å; Y467-S470 PolarHBondContact O-N 2.93Å; Y467-M471 HydrophobicContact CD1-CG 4.26Å; Y467-M471 HydrophobicContact CD2-CG 4.34Å; Y467-M471 HydrophobicContact CE1-CB 4.45Å; Y467-M471 HydrophobicContact CE1-CG 3.86Å; Y467-M471 HydrophobicContact CE1-SD 3.9Å; Y467-M471 HydrophobicContact CE2-CE 3.76Å; Y467-M471 HydrophobicContact CE2-CG 3.94Å; Y467-M471 HydrophobicContact CE2-SD 4.06Å; Y467-M471 HydrophobicContact CG-CG 4.49Å; Y467-M471 VanDerWaalsContact O-CB 3.23Å; Y467-M471 WeakPolarHBondContact O-CB 3.04Å; Y467-M471 WeakPolarHBondContact O-CG 3.42Å; Y467-M471 PolarHBondContact O-N 3.27Å; Y467-M471 WeakPolarHBondContact OH-CE 3.24Å; Y467-M471 PolarHBondContact OH-SD 2.96Å
468	F	66.3	Low	64.7	Low	61 Å²	61	68.5 Å²	68.5	27%	0.268	35%	0.349	S	S	.	.	H	α-helix	trans	-70.3	-46.6	178	-144.1	-71	0	0	0	111.9	I424 L428 E464 K465 I466 S470 M471 K472	I424-F468 HydrophobicContact CB-CE2 4.36Å; I424-F468 HydrophobicContact CD1-CZ 4.16Å; I424-F468 HydrophobicContact CG2-CE2 3.58Å; I424-F468 HydrophobicContact CG2-CZ 4.19Å; L428-F468 HydrophobicContact CD1-CD2 4.43Å; E464-F468 VanDerWaalsContact O-CB 3.27Å; E464-F468 WeakPolarHBondContact O-CB 3.2Å; E464-F468 PolarHBondContact O-N 3.44Å; K465-F468 PolarHBondContact O-N 3.29Å; I466-F468 VanDerWaalsContact C-N 3.35Å; I466-F468 PolarHBondContact O-N 2.88Å; F468-S470 PolarHBondContact O-N 3.3Å; F468-M471 PolarHBondContact O-N 3.15Å; F468-K472 VanDerWaalsContact O-CB 3.3Å; F468-K472 WeakPolarHBondContact O-CB 3.44Å; F468-K472 WeakPolarHBondContact O-CG 3.49Å; F468-K472 PolarHBondContact O-N 3.04Å
469	D	63.8	Low	63.6	Low	76 Å²	76	72.6 Å²	72.6	41%	0.406	37%	0.371	S	S	.	.	H	α-helix	trans	-62.4	-24.5	175.2	-73.6	-24.1	0	0	0	111.9	K465 I466 K472	K465-D469 WeakPolarHBondContact CE-OD2 3.35Å; K465-D469 WeakPolarHBondContact CG-OD2 3.07Å; K465-D469 VanDerWaalsContact O-CB 3.25Å; K465-D469 WeakPolarHBondContact O-CB 3.44Å; K465-D469 VanDerWaalsContact O-CG 3.28Å; K465-D469 PolarHBondContact O-N 3.29Å; I466-D469 PolarHBondContact O-N 3.17Å; D469-K472 VanDerWaalsContact O-CE 3.28Å; D469-K472 WeakPolarHBondContact O-CE 3.06Å
470	S	63.8	Low	62	Low	28 Å²	28	70.7 Å²	70.7	20%	0.196	36%	0.356	C	S	.	.	H	α-helix	trans	-88.3	-34.8	178.4	-68.6	0	0	0	0	113.9	L446 I466 Y467 F468	L446-S470 VanDerWaalsContact CD1-CB 3.45Å; L446-S470 WeakPolarHBondContact CD1-OG 3.4Å; L446-S470 VanDerWaalsContact CD2-CB 3.44Å; I466-S470 WeakPolarHBondContact O-CB 2.99Å; I466-S470 PolarHBondContact O-N 3.49Å; I466-S470 PolarHBondContact O-OG 3.44Å; Y467-S470 PolarHBondContact O-N 2.93Å; F468-S470 PolarHBondContact O-N 3.3Å
471	M	63	Low	60.7	Low	39 Å²	39	70.1 Å²	70.1	19%	0.192	35%	0.354	C	S	.	.	H	α-helix	trans	-95.6	-21.2	-176.4	-77.6	-124.3	161.8	0	0	113.9	Y467 F468 D473 S474	Y467-M471 HydrophobicContact CD1-CG 4.26Å; Y467-M471 HydrophobicContact CD2-CG 4.34Å; Y467-M471 HydrophobicContact CE1-CB 4.45Å; Y467-M471 HydrophobicContact CE1-CG 3.86Å; Y467-M471 HydrophobicContact CE1-SD 3.9Å; Y467-M471 HydrophobicContact CE2-CE 3.76Å; Y467-M471 HydrophobicContact CE2-CG 3.94Å; Y467-M471 HydrophobicContact CE2-SD 4.06Å; Y467-M471 HydrophobicContact CG-CG 4.49Å; Y467-M471 VanDerWaalsContact O-CB 3.23Å; Y467-M471 WeakPolarHBondContact O-CB 3.04Å; Y467-M471 WeakPolarHBondContact O-CG 3.42Å; Y467-M471 PolarHBondContact O-N 3.27Å; Y467-M471 WeakPolarHBondContact OH-CE 3.24Å; Y467-M471 PolarHBondContact OH-SD 2.96Å; F468-M471 PolarHBondContact O-N 3.15Å; M471-D473 PolarHBondContact O-N 2.9Å; M471-S474 VanDerWaalsContact O-CB 3.3Å; M471-S474 WeakPolarHBondContact O-CB 3.33Å; M471-S474 PolarHBondContact O-N 2.9Å; M471-S474 PolarHBondContact O-OG 3.45Å
472	K	57	Low	59.6	Low	100 Å²	100	68.6 Å²	68.6	44%	0.435	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	-50.4	-30	179.2	60.4	170.4	-163.6	-175.6	0	114.2	F468 D469	F468-K472 VanDerWaalsContact O-CB 3.3Å; F468-K472 WeakPolarHBondContact O-CB 3.44Å; F468-K472 WeakPolarHBondContact O-CG 3.49Å; F468-K472 PolarHBondContact O-N 3.04Å; D469-K472 VanDerWaalsContact O-CE 3.28Å; D469-K472 WeakPolarHBondContact O-CE 3.06Å
473	D	52	Low	58.1	Low	123 Å²	123	68.5 Å²	68.5	66%	0.658	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.6	3.3	-178	-53.5	-38.6	0	0	0	112.3	M471	M471-D473 PolarHBondContact O-N 2.9Å
474	S	59	Low	56.5	Low	33 Å²	33	71.1 Å²	71.1	23%	0.231	36%	0.359	C	S	.	.	S	Bend	trans	-82.3	149	177	72.1	0	0	0	0	111.9	M471 F476 W477 T478	M471-S474 VanDerWaalsContact O-CB 3.3Å; M471-S474 WeakPolarHBondContact O-CB 3.33Å; M471-S474 PolarHBondContact O-N 2.9Å; M471-S474 PolarHBondContact O-OG 3.45Å; S474-F476 PolarHBondContact O-N 2.87Å; S474-F476 VanDerWaalsContact O-N 3.13Å; S474-W477 PolarHBondContact O-N 3.42Å; S474-T478 PolarHBondContact O-N 2.99Å
475	S	52.8	Low	55.1	Low	84 Å²	84	70.9 Å²	70.9	59%	0.587	36%	0.357	S	S	*	.	H	α-helix	trans	-56.6	-32.7	-179.3	62.8	0	0	0	0	113	W477 T478 D479	S475-W477 VanDerWaalsContact C-N 3.29Å; S475-W477 PolarHBondContact O-N 3.08Å; S475-T478 VanDerWaalsContact CA-OG1 3.31Å; S475-T478 WeakPolarHBondContact CA-OG1 3.35Å; S475-T478 PolarHBondContact O-N 3.4Å; S475-T478 VanDerWaalsContact O-N 3.14Å; S475-T478 PolarHBondContact O-OG1 3.4Å; S475-D479 WeakPolarHBondContact O-CB 3.15Å; S475-D479 PolarHBondContact O-N 3.15Å
476	F	50.3	Low	53.6	Low	111 Å²	111	70.2 Å²	70.2	49%	0.487	36%	0.357	S	S	.	.	H	α-helix	trans	-55.8	-40.4	175.7	176	-101.4	0	0	0	113.2	S474 I480	S474-F476 PolarHBondContact O-N 2.87Å; S474-F476 VanDerWaalsContact O-N 3.13Å; F476-I480 HydrophobicContact CD1-CD1 4.15Å; F476-I480 HydrophobicContact CD2-CD1 4.37Å; F476-I480 HydrophobicContact CE1-CD1 3.55Å; F476-I480 HydrophobicContact CE2-CD1 3.8Å; F476-I480 HydrophobicContact CZ-CD1 3.36Å; F476-I480 WeakPolarHBondContact O-CG1 3.23Å; F476-I480 PolarHBondContact O-N 3.18Å; F476-I480 VanDerWaalsContact O-N 3.09Å
477	W	46.9	Very low	52	Low	28 Å²	28	74.8 Å²	74.8	11%	0.106	38%	0.377	C	S	.	.	H	α-helix	trans	-77.9	-32.6	177	-80.3	96.2	0	0	0	112.7	I424 S474 S475 I480 H481	I424-W477 HydrophobicContact CB-CH2 4.04Å; I424-W477 HydrophobicContact CD1-CE3 4.2Å; I424-W477 HydrophobicContact CD1-CH2 3.58Å; I424-W477 HydrophobicContact CD1-CZ3 3.29Å; I424-W477 HydrophobicContact CG1-CH2 3.55Å; I424-W477 HydrophobicContact CG1-CZ3 3.68Å; I424-W477 HydrophobicContact CG2-CH2 3.33Å; I424-W477 HydrophobicContact CG2-CZ2 3.76Å; I424-W477 HydrophobicContact CG2-CZ3 4.24Å; S474-W477 PolarHBondContact O-N 3.42Å; S475-W477 VanDerWaalsContact C-N 3.29Å; S475-W477 PolarHBondContact O-N 3.08Å; W477-I480 HydrophobicContact CE3-CG2 4.38Å; W477-I480 HydrophobicContact CZ3-CG2 4.15Å; W477-H481 WeakPolarHBondContact O-CB 3.37Å; W477-H481 PolarHBondContact O-CD2 3.01Å; W477-H481 PolarHBondContact O-N 3.14Å
478	T	51.5	Low	50.4	Low	79 Å²	79	79.5 Å²	79.5	49%	0.485	40%	0.4	S	S	.	.	H	α-helix	trans	-66.7	-39.6	171.7	57	0	0	0	0	111.5	S474 S475 H481 E482	S474-T478 PolarHBondContact O-N 2.99Å; S475-T478 VanDerWaalsContact CA-OG1 3.31Å; S475-T478 WeakPolarHBondContact CA-OG1 3.35Å; S475-T478 PolarHBondContact O-N 3.4Å; S475-T478 VanDerWaalsContact O-N 3.14Å; S475-T478 PolarHBondContact O-OG1 3.4Å; T478-H481 PolarHBondContact O-N 3.26Å; T478-E482 VanDerWaalsContact O-CB 3.29Å; T478-E482 WeakPolarHBondContact O-CB 3.43Å; T478-E482 PolarHBondContact O-N 2.99Å
479	D	53	Low	48.9	Very low	101 Å²	101	82.9 Å²	82.9	54%	0.54	42%	0.421	S	S	.	.	H	α-helix	trans	-65.4	-45.6	178.7	-63.6	-20.9	0	0	0	110.7	S475 E482 E483	S475-D479 WeakPolarHBondContact O-CB 3.15Å; S475-D479 PolarHBondContact O-N 3.15Å; D479-E482 PolarHBondContact O-N 2.9Å; D479-E483 WeakPolarHBondContact O-CB 3.31Å; D479-E483 PolarHBondContact O-N 3.43Å
480	I	44.9	Very low	47.5	Very low	47 Å²	47	83.4 Å²	83.4	24%	0.241	42%	0.424	C	S	.	.	H	α-helix	trans	-63.7	-41.9	173.6	-73.6	176.4	0	0	0	111.7	F476 W477 E482 E483 L484	F476-I480 HydrophobicContact CD1-CD1 4.15Å; F476-I480 HydrophobicContact CD2-CD1 4.37Å; F476-I480 HydrophobicContact CE1-CD1 3.55Å; F476-I480 HydrophobicContact CE2-CD1 3.8Å; F476-I480 HydrophobicContact CZ-CD1 3.36Å; F476-I480 WeakPolarHBondContact O-CG1 3.23Å; F476-I480 PolarHBondContact O-N 3.18Å; F476-I480 VanDerWaalsContact O-N 3.09Å; W477-I480 HydrophobicContact CE3-CG2 4.38Å; W477-I480 HydrophobicContact CZ3-CG2 4.15Å; I480-E482 VanDerWaalsContact C-N 3.33Å; I480-E483 PolarHBondContact O-N 3.14Å; I480-L484 HydrophobicContact CG2-CD1 3.72Å; I480-L484 HydrophobicContact CG2-CG 4.25Å; I480-L484 VanDerWaalsContact O-CB 3.27Å; I480-L484 WeakPolarHBondContact O-CB 3.3Å; I480-L484 VanDerWaalsContact O-CG 3.23Å; I480-L484 WeakPolarHBondContact O-CG 3.49Å; I480-L484 PolarHBondContact O-N 2.82Å
481	H	43.7	Very low	46.3	Very low	60 Å²	60	87 Å²	87	28%	0.278	44%	0.437	S	S	.	.	H	α-helix	trans	-66	-35.9	175.9	-92.9	-73.8	0	0	0	112.1	E420 W477 T478 K485	E420-H481 IonicContact OE1-CE1 2.68Å; E420-H481 IonicContact OE1-ND1 2.66Å; E420-H481 IonicContact OE2-CE1 2.65Å; W477-H481 WeakPolarHBondContact O-CB 3.37Å; W477-H481 PolarHBondContact O-CD2 3.01Å; W477-H481 PolarHBondContact O-N 3.14Å; T478-H481 PolarHBondContact O-N 3.26Å; H481-K485 VanDerWaalsContact O-CB 3.26Å; H481-K485 WeakPolarHBondContact O-CB 3.29Å; H481-K485 VanDerWaalsContact O-CG 3.23Å; H481-K485 WeakPolarHBondContact O-CG 3.45Å; H481-K485 PolarHBondContact O-N 2.77Å
482	E	49.9	Very low	45.1	Very low	105 Å²	105	92.6 Å²	92.6	49%	0.491	46%	0.457	S	S	.	.	H	α-helix	trans	-70.8	-40.7	177.3	-159.9	66.9	-167.2	0	0	111	T478 D479 I480 K485 Q486	T478-E482 VanDerWaalsContact O-CB 3.29Å; T478-E482 WeakPolarHBondContact O-CB 3.43Å; T478-E482 PolarHBondContact O-N 2.99Å; D479-E482 PolarHBondContact O-N 2.9Å; I480-E482 VanDerWaalsContact C-N 3.33Å; E482-K485 PolarHBondContact O-N 2.94Å; E482-Q486 VanDerWaalsContact O-CG 3.29Å; E482-Q486 WeakPolarHBondContact O-CG 3.29Å; E482-Q486 PolarHBondContact O-N 3.18Å
483	E	46.3	Very low	44.4	Very low	116 Å²	116	88.5 Å²	88.5	54%	0.542	44%	0.44	S	S	.	.	H	α-helix	trans	-67.3	-40.9	174.7	-168.9	171.6	-163.1	0	0	111.9	D479 I480 Q486 Q487	D479-E483 WeakPolarHBondContact O-CB 3.31Å; D479-E483 PolarHBondContact O-N 3.43Å; I480-E483 PolarHBondContact O-N 3.14Å; E483-Q486 WeakPolarHBondContact O-CB 3.49Å; E483-Q486 PolarHBondContact O-N 2.9Å; E483-Q487 WeakPolarHBondContact O-CG 3.38Å; E483-Q487 PolarHBondContact O-N 3.49Å
484	L	39.2	Very low	43.9	Very low	73 Å²	73	86 Å²	86	38%	0.382	43%	0.432	S	S	.	.	H	α-helix	trans	-68	-35.1	172.7	-71.3	173.9	0	0	0	112.5	I480 Q486 Q487 Q488	I480-L484 HydrophobicContact CG2-CD1 3.72Å; I480-L484 HydrophobicContact CG2-CG 4.25Å; I480-L484 VanDerWaalsContact O-CB 3.27Å; I480-L484 WeakPolarHBondContact O-CB 3.3Å; I480-L484 VanDerWaalsContact O-CG 3.23Å; I480-L484 WeakPolarHBondContact O-CG 3.49Å; I480-L484 PolarHBondContact O-N 2.82Å; L484-Q486 VanDerWaalsContact C-N 3.35Å; L484-Q487 PolarHBondContact O-N 3.29Å; L484-Q488 PolarHBondContact O-N 2.89Å
485	K	43.4	Very low	42.9	Very low	42 Å²	42	87.4 Å²	87.4	18%	0.183	44%	0.442	C	S	.	.	H	α-helix	trans	-64.6	-37.7	169.5	-81.9	177	-174.9	176.5	0	111.4	I75 H481 E482 Q487 Q488 N489	I75-K485 PolarHBondContact O-NZ 3.23Å; H481-K485 VanDerWaalsContact O-CB 3.26Å; H481-K485 WeakPolarHBondContact O-CB 3.29Å; H481-K485 VanDerWaalsContact O-CG 3.23Å; H481-K485 WeakPolarHBondContact O-CG 3.45Å; H481-K485 PolarHBondContact O-N 2.77Å; E482-K485 PolarHBondContact O-N 2.94Å; K485-Q487 VanDerWaalsContact C-N 3.34Å; K485-Q488 PolarHBondContact O-N 3.22Å; K485-N489 WeakPolarHBondContact O-CB 3.43Å; K485-N489 PolarHBondContact O-N 2.86Å; K485-N489 PolarHBondContact O-ND2 3.36Å; K485-N489 VanDerWaalsContact O-ND2 3.17Å
486	Q	42.8	Very low	42.6	Very low	119 Å²	119	84.7 Å²	84.7	56%	0.556	42%	0.422	S	S	*	.	H	α-helix	trans	-65.6	-37.2	172.7	-73.1	173.5	44.2	0	0	111.4	E482 E483 L484 N490	E482-Q486 VanDerWaalsContact O-CG 3.29Å; E482-Q486 WeakPolarHBondContact O-CG 3.29Å; E482-Q486 PolarHBondContact O-N 3.18Å; E483-Q486 WeakPolarHBondContact O-CB 3.49Å; E483-Q486 PolarHBondContact O-N 2.9Å; L484-Q486 VanDerWaalsContact C-N 3.35Å; Q486-N490 PolarHBondContact O-N 2.81Å; Q486-N490 PolarHBondContact O-ND2 2.84Å
487	Q	36.2	Very low	42.6	Very low	118 Å²	118	80.2 Å²	80.2	55%	0.551	40%	0.404	S	S	*	.	H	α-helix	trans	-68.6	-38.7	172.7	-68.9	-178.5	19.2	0	0	113	E483 L484 K485 N490	E483-Q487 WeakPolarHBondContact O-CG 3.38Å; E483-Q487 PolarHBondContact O-N 3.49Å; L484-Q487 PolarHBondContact O-N 3.29Å; K485-Q487 VanDerWaalsContact C-N 3.34Å; Q487-N490 WeakPolarHBondContact O-CB 3.45Å; Q487-N490 PolarHBondContact O-N 2.86Å
488	Q	33.7	Very low	42.8	Very low	126 Å²	126	85.4 Å²	85.4	59%	0.589	43%	0.434	S	S	*	.	H	α-helix	trans	-69.4	-34.1	173.6	-77.9	-172.4	-2.2	0	0	113.3	L484 K485 N490	L484-Q488 PolarHBondContact O-N 2.89Å; K485-Q488 PolarHBondContact O-N 3.22Å; Q488-N490 VanDerWaalsContact C-N 3.28Å
489	N	35.1	Very low	43.1	Very low	133 Å²	133	86.3 Å²	86.3	71%	0.711	44%	0.443	S	S	*	.	H	α-helix	trans	-77.5	-13.2	174.5	-77.5	-44.3	0	0	0	113.2	K485 H491	K485-N489 WeakPolarHBondContact O-CB 3.43Å; K485-N489 PolarHBondContact O-N 2.86Å; K485-N489 PolarHBondContact O-ND2 3.36Å; K485-N489 VanDerWaalsContact O-ND2 3.17Å; N489-H491 PolarHBondContact O-N 3.29Å
490	N	32.5	Very low	43.7	Very low	86 Å²	86	82.2 Å²	82.2	46%	0.46	42%	0.422	S	S	.	.			trans	-73.6	77.7	163.1	-81.3	-38.1	0	0	0	110.1	Q486 Q487 Q488 Y492	Q486-N490 PolarHBondContact O-N 2.81Å; Q486-N490 PolarHBondContact O-ND2 2.84Å; Q487-N490 WeakPolarHBondContact O-CB 3.45Å; Q487-N490 PolarHBondContact O-N 2.86Å; Q488-N490 VanDerWaalsContact C-N 3.28Å; N490-Y492 PolarHBondContact O-N 3.07Å
491	H	39.8	Very low	44.9	Very low	104 Å²	104	83.8 Å²	83.8	48%	0.481	43%	0.431	S	S	.	.			trans	-56.3	87.1	156.9	-148.6	-68.5	0	0	0	106.9	N489 L493 S494 S495	N489-H491 PolarHBondContact O-N 3.29Å; H491-L493 PolarHBondContact O-N 3.33Å; H491-S494 WeakPolarHBondContact O-CA 3.26Å; H491-S494 PolarHBondContact O-N 2.85Å; H491-S495 PolarHBondContact O-N 3.4Å; H491-S495 VanDerWaalsContact O-N 3.1Å; H491-S495 PolarHBondContact O-OG 3.27Å
492	Y	38.3	Very low	46.2	Very low	156 Å²	156	85.2 Å²	85.2	61%	0.612	45%	0.448	S	S	*	.	H	α-helix	trans	-58.2	-26	-167.9	-132	-88.7	0	0	0	112.5	N490 T496	N490-Y492 PolarHBondContact O-N 3.07Å; Y492-T496 HydrophobicContact CD1-CG2 4.44Å; Y492-T496 WeakPolarHBondContact O-CB 3.29Å; Y492-T496 WeakPolarHBondContact O-CG2 2.95Å; Y492-T496 PolarHBondContact O-OG1 3.36Å
493	L	42.4	Very low	47.3	Very low	15 Å²	15	82.1 Å²	82.1	8%	0.079	44%	0.441	C	S	.	.	H	α-helix	trans	-72.8	-31.9	172.3	-61.1	156.7	0	0	0	113.6	H491 M508 I529 L533	H491-L493 PolarHBondContact O-N 3.33Å; L493-M508 HydrophobicContact CB-CG 4.12Å; L493-M508 HydrophobicContact CB-SD 4.07Å; L493-M508 HydrophobicContact CD2-CG 4.26Å; L493-M508 HydrophobicContact CD2-SD 3.33Å; L493-M508 WeakPolarHBondContact CD2-SD 3.23Å; L493-M508 HydrophobicContact CG-SD 4.29Å; L493-M508 WeakPolarHBondContact O-CG 3.29Å; L493-I529 HydrophobicContact CD1-CG2 4.47Å; L493-I529 HydrophobicContact CD2-CG2 4.21Å; L493-L533 HydrophobicContact CD2-CD1 3.51Å; L493-L533 HydrophobicContact CG-CD1 4.24Å
494	S	40.6	Very low	48.3	Very low	69 Å²	69	76.6 Å²	76.6	48%	0.483	42%	0.415	S	S	.	.	H	α-helix	trans	-92.6	-38.3	-172	-153.1	0	0	0	0	112.4	H491 S497	H491-S494 WeakPolarHBondContact O-CA 3.26Å; H491-S494 PolarHBondContact O-N 2.85Å; S494-S497 WeakPolarHBondContact O-CB 3.45Å; S494-S497 PolarHBondContact O-N 3.26Å; S494-S497 PolarHBondContact O-OG 3.09Å
495	S	37.9	Very low	49.7	Very low	63 Å²	63	77.9 Å²	77.9	44%	0.441	42%	0.415	S	S	.	.	H	α-helix	trans	-73.1	-33.8	176.9	52.4	0	0	0	0	113.2	H491 S497	H491-S495 PolarHBondContact O-N 3.4Å; H491-S495 VanDerWaalsContact O-N 3.1Å; H491-S495 PolarHBondContact O-OG 3.27Å; S495-S497 VanDerWaalsContact C-N 3.35Å
496	T	46.4	Very low	51.1	Low	28 Å²	28	81.3 Å²	81.3	17%	0.172	43%	0.431	C	S	.	.	G	3₁₀ helix	trans	-72.5	-24.9	173.6	53.5	0	0	0	0	113.3	Y492 L498 S499	Y492-T496 HydrophobicContact CD1-CG2 4.44Å; Y492-T496 WeakPolarHBondContact O-CB 3.29Å; Y492-T496 WeakPolarHBondContact O-CG2 2.95Å; Y492-T496 PolarHBondContact O-OG1 3.36Å; T496-L498 PolarHBondContact O-N 3.44Å; T496-S499 PolarHBondContact O-N 3.13Å; T496-S499 PolarHBondContact O-OG 3.15Å
497	S	50.1	Low	52.6	Low	16 Å²	16	76 Å²	76	11%	0.112	41%	0.406	C	S	.	.	G	3₁₀ helix	trans	-57.6	-22	-176.6	77.2	0	0	0	0	114.5	S494 S495 S499 R505	S494-S497 WeakPolarHBondContact O-CB 3.45Å; S494-S497 PolarHBondContact O-N 3.26Å; S494-S497 PolarHBondContact O-OG 3.09Å; S495-S497 VanDerWaalsContact C-N 3.35Å; S497-S499 PolarHBondContact O-N 3Å; S497-R505 WeakPolarHBondContact O-CD 3.49Å; S497-R505 WeakPolarHBondContact O-CG 3.11Å; S497-R505 PolarHBondContact O-NE 3.44Å
498	L	51.9	Low	54.2	Low	137 Å²	137	70.5 Å²	70.5	72%	0.717	38%	0.381	S	S	*	.	G	3₁₀ helix	trans	-79.4	-13.4	-175.2	-79.9	153.1	0	0	0	114.5	T496	T496-L498 PolarHBondContact O-N 3.44Å
499	S	57.8	Low	55.9	Low	99 Å²	99	69.5 Å²	69.5	69%	0.692	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109.8	-14.2	180	52.1	0	0	0	0	115.3	T496 S497	T496-S499 PolarHBondContact O-N 3.13Å; T496-S499 PolarHBondContact O-OG 3.15Å; S497-S499 PolarHBondContact O-N 3Å
500	C	64.2	Low	57.7	Low	14 Å²	14	64.8 Å²	64.8	10%	0.095	35%	0.353	C	S	.	.	S	Bend	trans	-85.6	164.6	-178.6	-49.6	0	0	0	0	113.2	R505 T540 C541	C500-R505 HydrophobicContact CB-CG 4.46Å; C500-T540 PolarHBondContact SG-O 2.97Å; C500-C541 WeakPolarHBondContact CA-SG 3.45Å; C500-C541 HydrophobicContact CB-CB 3.67Å; C500-C541 WeakPolarHBondContact CB-SG 3.38Å; C500-C541 WeakPolarHBondContact SG-CA 3.29Å; C500-C541 WeakPolarHBondContact SG-CB 3.28Å; C500-C541 CovalentContact SG-SG 2.04Å; C500-C541 PolarHBondContact SG-SG 3.02Å
501	D	71	Confident	59.5	Low	80 Å²	80	60.7 Å²	60.7	43%	0.428	33%	0.332	S	S	.	.			trans	-66.2	165.1	174.3	71.2	2.4	0	0	0	112.8	A503 S504 R505 T543	D501-A503 VanDerWaalsContact C-N 3.27Å; D501-A503 PolarHBondContact O-N 2.89Å; D501-S504 PolarHBondContact O-N 3.45Å; D501-S504 WeakPolarHBondContact OD1-CB 3.45Å; D501-S504 PolarHBondContact OD1-N 2.77Å; D501-S504 PolarHBondContact OD1-OG 2.95Å; D501-R505 WeakPolarHBondContact O-CG 3.44Å; D501-R505 PolarHBondContact O-N 2.87Å; D501-T543 WeakPolarHBondContact OD1-CG2 3.42Å; D501-T543 VanDerWaalsContact OD2-CG2 3.26Å; D501-T543 WeakPolarHBondContact OD2-CG2 3.48Å
502	S	70.1	Confident	60.9	Low	91 Å²	91	57.5 Å²	57.5	64%	0.636	32%	0.321	S	S	*	.	H	α-helix	trans	-60.3	-36.3	-174.9	54	0	0	0	0	112.9	R505 E506	S502-R505 PolarHBondContact O-N 3.33Å; S502-E506 WeakPolarHBondContact O-CG 3.37Å; S502-E506 PolarHBondContact O-N 3.33Å
503	A	73.6	Confident	62.4	Low	40 Å²	40	52.7 Å²	52.7	33%	0.331	30%	0.302	S	S	.	.	H	α-helix	trans	-69	-41.6	178.1	0	0	0	0	0	112.2	D501 R505 E506 T507 T543	D501-A503 VanDerWaalsContact C-N 3.27Å; D501-A503 PolarHBondContact O-N 2.89Å; A503-R505 VanDerWaalsContact C-N 3.29Å; A503-R505 PolarHBondContact O-N 2.93Å; A503-E506 PolarHBondContact O-N 2.98Å; A503-T507 PolarHBondContact O-N 3.28Å; A503-T507 PolarHBondContact O-OG1 3.13Å; A503-T543 HydrophobicContact CB-CG2 3.67Å
504	S	68	Low	63.5	Low	0 Å²	0	52 Å²	52	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-62.9	-40.3	174.1	-57.8	0	0	0	0	110.5	D501 T507 M508 C541 T543	D501-S504 PolarHBondContact O-N 3.45Å; D501-S504 WeakPolarHBondContact OD1-CB 3.45Å; D501-S504 PolarHBondContact OD1-N 2.77Å; D501-S504 PolarHBondContact OD1-OG 2.95Å; S504-T507 WeakPolarHBondContact CA-OG1 3.4Å; S504-T507 PolarHBondContact O-N 3.39Å; S504-T507 PolarHBondContact O-OG1 2.98Å; S504-M508 WeakPolarHBondContact O-CB 3.28Å; S504-M508 PolarHBondContact O-N 3.12Å; S504-C541 PolarHBondContact OG-O 3.25Å; S504-T543 WeakPolarHBondContact OG-CG2 3.39Å
505	R	67.5	Low	64.7	Low	100 Å²	100	50.6 Å²	50.6	38%	0.377	29%	0.286	S	S	.	.	H	α-helix	trans	-62.4	-44.6	176.2	-67.4	176.3	74.6	161.5	11.6	112.7	S497 C500 D501 S502 A503 T507 M508 D509	S497-R505 WeakPolarHBondContact O-CD 3.49Å; S497-R505 WeakPolarHBondContact O-CG 3.11Å; S497-R505 PolarHBondContact O-NE 3.44Å; C500-R505 HydrophobicContact CB-CG 4.46Å; D501-R505 WeakPolarHBondContact O-CG 3.44Å; D501-R505 PolarHBondContact O-N 2.87Å; S502-R505 PolarHBondContact O-N 3.33Å; A503-R505 VanDerWaalsContact C-N 3.29Å; A503-R505 PolarHBondContact O-N 2.93Å; R505-T507 PolarHBondContact O-N 2.95Å; R505-M508 WeakPolarHBondContact O-CB 3.14Å; R505-M508 PolarHBondContact O-N 3.04Å; R505-M508 VanDerWaalsContact O-N 3.16Å; R505-D509 PolarHBondContact O-N 2.86Å
506	E	73.3	Confident	65.9	Low	114 Å²	114	51.1 Å²	51.1	53%	0.533	29%	0.289	S	S	.	.	H	α-helix	trans	-57.9	-46.6	173.3	-76.5	177.5	-164.7	0	0	111.7	S502 A503 M508 D509 H510	S502-E506 WeakPolarHBondContact O-CG 3.37Å; S502-E506 PolarHBondContact O-N 3.33Å; A503-E506 PolarHBondContact O-N 2.98Å; E506-M508 VanDerWaalsContact C-N 3.32Å; E506-M508 PolarHBondContact O-N 2.8Å; E506-D509 PolarHBondContact O-N 2.89Å; E506-H510 PolarHBondContact O-CD2 2.95Å; E506-H510 PolarHBondContact O-N 2.75Å
507	T	74.2	Confident	66.7	Low	6 Å²	6	54.8 Å²	54.8	4%	0.037	30%	0.304	C	S	.	.	H	α-helix	trans	-64.3	-35.4	175.7	59.5	0	0	0	0	112.5	A503 S504 R505 H510 L511 M546	A503-T507 PolarHBondContact O-N 3.28Å; A503-T507 PolarHBondContact O-OG1 3.13Å; S504-T507 WeakPolarHBondContact CA-OG1 3.4Å; S504-T507 PolarHBondContact O-N 3.39Å; S504-T507 PolarHBondContact O-OG1 2.98Å; R505-T507 PolarHBondContact O-N 2.95Å; T507-H510 PolarHBondContact O-N 3.1Å; T507-L511 VanDerWaalsContact O-CG 3.29Å; T507-L511 WeakPolarHBondContact O-CG 3.41Å; T507-L511 PolarHBondContact O-N 3.25Å; T507-M546 WeakPolarHBondContact OG1-CB 3.31Å
508	M	69.1	Low	66.9	Low	3 Å²	3	54.6 Å²	54.6	2%	0.015	30%	0.302	C	S	.	.	H	α-helix	trans	-66.7	-41.8	177.3	-158.8	70.9	78.1	0	0	111.8	L493 S504 R505 E506 L511 S512 T540 M546	L493-M508 HydrophobicContact CB-CG 4.12Å; L493-M508 HydrophobicContact CB-SD 4.07Å; L493-M508 HydrophobicContact CD2-CG 4.26Å; L493-M508 HydrophobicContact CD2-SD 3.33Å; L493-M508 WeakPolarHBondContact CD2-SD 3.23Å; L493-M508 HydrophobicContact CG-SD 4.29Å; L493-M508 WeakPolarHBondContact O-CG 3.29Å; S504-M508 WeakPolarHBondContact O-CB 3.28Å; S504-M508 PolarHBondContact O-N 3.12Å; R505-M508 WeakPolarHBondContact O-CB 3.14Å; R505-M508 PolarHBondContact O-N 3.04Å; R505-M508 VanDerWaalsContact O-N 3.16Å; E506-M508 VanDerWaalsContact C-N 3.32Å; E506-M508 PolarHBondContact O-N 2.8Å; M508-L511 PolarHBondContact O-N 3.23Å; M508-S512 WeakPolarHBondContact O-CB 3.47Å; M508-S512 PolarHBondContact O-N 3.12Å; M508-T540 HydrophobicContact CE-CG2 4.25Å; M508-T540 WeakPolarHBondContact CE-O 3.39Å; M508-M546 HydrophobicContact CE-CE 3.57Å; M508-M546 HydrophobicContact SD-CE 3.53Å; M508-M546 VanDerWaalsContact SD-CE 3.53Å
509	D	69.4	Low	66.7	Low	106 Å²	106	55.4 Å²	55.4	57%	0.567	30%	0.302	S	S	*	.	H	α-helix	trans	-67.1	-37.3	174.3	-75.8	-24.8	0	0	0	111.3	R505 E506 S512 Y513	R505-D509 PolarHBondContact O-N 2.86Å; E506-D509 PolarHBondContact O-N 2.89Å; D509-S512 PolarHBondContact O-N 3.43Å; D509-Y513 VanDerWaalsContact O-CB 3.31Å; D509-Y513 WeakPolarHBondContact O-CB 3.01Å; D509-Y513 PolarHBondContact O-N 2.79Å
510	H	72.9	Confident	66.3	Low	34 Å²	34	58.8 Å²	58.8	16%	0.157	31%	0.312	C	S	.	.	H	α-helix	trans	-61.7	-46.3	170.3	-71.3	-32.4	0	0	0	111.9	E506 T507 Y513 Y514 E550 P562	E506-H510 PolarHBondContact O-CD2 2.95Å; E506-H510 PolarHBondContact O-N 2.75Å; T507-H510 PolarHBondContact O-N 3.1Å; H510-Y513 WeakPolarHBondContact O-CB 3.29Å; H510-Y513 PolarHBondContact O-N 2.85Å; H510-Y513 VanDerWaalsContact O-N 3.16Å; H510-Y514 VanDerWaalsContact C-CD2 3.48Å; H510-Y514 HydrophobicContact CB-CE2 3.95Å; H510-Y514 WeakPolarHBondContact O-CD2 3.5Å; H510-Y514 PolarHBondContact O-N 3.44Å; H510-E550 IonicContact CD2-OE1 3.26Å; H510-E550 IonicContact CD2-OE2 3.35Å; H510-E550 IonicContact CG-OE1 2.65Å; H510-P562 HydrophobicContact CB-CG 4.17Å; H510-P562 WeakPolarHBondContact ND1-CG 3.15Å
511	L	71.3	Confident	65.7	Low	0 Å²	0	62.9 Å²	62.9	0%	0	33%	0.326	C	S	.	.	H	α-helix	trans	-60.9	-43.7	175.1	-68.3	174.3	0	0	0	113	T507 M508 Y513 Y514 N515 I529 M546 L549 I553	T507-L511 VanDerWaalsContact O-CG 3.29Å; T507-L511 WeakPolarHBondContact O-CG 3.41Å; T507-L511 PolarHBondContact O-N 3.25Å; M508-L511 PolarHBondContact O-N 3.23Å; L511-Y513 VanDerWaalsContact C-N 3.31Å; L511-Y513 PolarHBondContact O-N 2.69Å; L511-Y514 HydrophobicContact CD2-CD2 4.28Å; L511-Y514 PolarHBondContact O-N 3.04Å; L511-N515 PolarHBondContact O-N 3.07Å; L511-I529 HydrophobicContact CB-CD1 4.27Å; L511-I529 HydrophobicContact CD2-CD1 4.24Å; L511-I529 HydrophobicContact CD2-CG1 4.24Å; L511-M546 HydrophobicContact CD1-CE 3.41Å; L511-M546 VanDerWaalsContact CD1-CE 3.41Å; L511-L549 HydrophobicContact CD1-CD2 3.83Å; L511-L549 HydrophobicContact CD1-CG 4.36Å; L511-L549 HydrophobicContact CD2-CD2 4.47Å; L511-L549 HydrophobicContact CD2-CG 4.27Å; L511-I553 HydrophobicContact CD2-CD1 3.42Å; L511-I553 VanDerWaalsContact CD2-CD1 3.42Å
512	S	68.6	Low	64.6	Low	37 Å²	37	62.3 Å²	62.3	26%	0.259	32%	0.323	S	S	.	.	H	α-helix	trans	-59.2	-42.1	172.4	-170	0	0	0	0	111.7	M508 D509 N515 S516	M508-S512 WeakPolarHBondContact O-CB 3.47Å; M508-S512 PolarHBondContact O-N 3.12Å; D509-S512 PolarHBondContact O-N 3.43Å; S512-N515 PolarHBondContact O-N 3.36Å; S512-S516 VanDerWaalsContact O-CB 3.27Å; S512-S516 WeakPolarHBondContact O-CB 3.41Å; S512-S516 PolarHBondContact O-N 3.08Å
513	Y	70.7	Confident	64.1	Low	55 Å²	55	61.6 Å²	61.6	22%	0.216	32%	0.318	C	S	.	.	H	α-helix	trans	-64	-47.9	175.4	-176.8	-90	0	0	0	112.7	D509 H510 L511 N515 S516 H517 P562 T565	D509-Y513 VanDerWaalsContact O-CB 3.31Å; D509-Y513 WeakPolarHBondContact O-CB 3.01Å; D509-Y513 PolarHBondContact O-N 2.79Å; H510-Y513 WeakPolarHBondContact O-CB 3.29Å; H510-Y513 PolarHBondContact O-N 2.85Å; H510-Y513 VanDerWaalsContact O-N 3.16Å; L511-Y513 VanDerWaalsContact C-N 3.31Å; L511-Y513 PolarHBondContact O-N 2.69Å; Y513-N515 VanDerWaalsContact C-N 3.27Å; Y513-N515 PolarHBondContact O-N 2.96Å; Y513-S516 PolarHBondContact O-N 3.21Å; Y513-H517 AromaticContact CD2-CE1 3.77Å; Y513-H517 AromaticContact CD2-ND1 3.66Å; Y513-H517 HydrophobicContact CE1-CB 4.17Å; Y513-H517 AromaticContact CE2-CD2 3.65Å; Y513-H517 AromaticContact CE2-CE1 3.25Å; Y513-H517 WeakPolarHBondContact CE2-CE1 3.41Å; Y513-H517 AromaticContact CE2-CG 3.65Å; Y513-H517 AromaticContact CE2-ND1 3.4Å; Y513-H517 WeakPolarHBondContact CE2-ND1 3.36Å; Y513-H517 AromaticContact CE2-NE2 3.39Å; Y513-H517 WeakPolarHBondContact CE2-NE2 3.3Å; Y513-H517 AromaticContact CZ-CD2 3.45Å; Y513-H517 VanDerWaalsContact CZ-CD2 3.45Å; Y513-H517 AromaticContact CZ-CE1 3.89Å; Y513-H517 AromaticContact CZ-CG 3.53Å; Y513-H517 AromaticContact CZ-ND1 3.81Å; Y513-H517 AromaticContact CZ-NE2 3.68Å; Y513-H517 WeakPolarHBondContact O-CB 3.47Å; Y513-H517 PolarHBondContact O-N 3.35Å; Y513-H517 PolarHBondContact OH-CD2 3.44Å; Y513-H517 PolarHBondContact OH-NE2 3.32Å; Y513-P562 HydrophobicContact CD1-CB 3.72Å; Y513-P562 HydrophobicContact CD1-CG 4.38Å; Y513-P562 HydrophobicContact CE1-CB 4.03Å; Y513-P562 HydrophobicContact CG-CB 4.31Å; Y513-T565 WeakPolarHBondContact OH-CB 3.36Å; Y513-T565 WeakPolarHBondContact OH-CG2 3.41Å; Y513-T565 PolarHBondContact OH-OG1 3.43Å
514	Y	65.7	Low	63.8	Low	0 Å²	0	65.2 Å²	65.2	0%	0	32%	0.323	C	S	.	.	H	α-helix	trans	-58.6	-39.9	177	-65.2	-67	0	0	0	111.3	H510 L511 N518 E550 I553 L554 V559 H561 P562	H510-Y514 VanDerWaalsContact C-CD2 3.48Å; H510-Y514 HydrophobicContact CB-CE2 3.95Å; H510-Y514 WeakPolarHBondContact O-CD2 3.5Å; H510-Y514 PolarHBondContact O-N 3.44Å; L511-Y514 HydrophobicContact CD2-CD2 4.28Å; L511-Y514 PolarHBondContact O-N 3.04Å; Y514-N518 WeakPolarHBondContact O-CB 3.37Å; Y514-N518 PolarHBondContact O-N 3.41Å; Y514-N518 PolarHBondContact O-ND2 2.9Å; Y514-E550 HydrophobicContact CE2-CG 3.94Å; Y514-E550 WeakPolarHBondContact CE2-OE1 3.45Å; Y514-E550 PolarHBondContact OH-OE1 2.95Å; Y514-I553 HydrophobicContact CD1-CG2 4.34Å; Y514-I553 HydrophobicContact CD2-CG2 4.08Å; Y514-I553 HydrophobicContact CG-CG2 4.04Å; Y514-L554 HydrophobicContact CE1-CD2 3.99Å; Y514-L554 HydrophobicContact CE1-CG 4.48Å; Y514-L554 VanDerWaalsContact OH-CD2 3.3Å; Y514-L554 WeakPolarHBondContact OH-CD2 3.22Å; Y514-L554 WeakPolarHBondContact OH-CG 3.47Å; Y514-V559 HydrophobicContact CD1-CG1 3.41Å; Y514-V559 VanDerWaalsContact CD1-CG1 3.41Å; Y514-V559 HydrophobicContact CE1-CG1 3.69Å; Y514-V559 HydrophobicContact CG-CG1 4.38Å; Y514-H561 PolarHBondContact OH-ND1 3.32Å; Y514-P562 HydrophobicContact CE1-CG 3.97Å; Y514-P562 HydrophobicContact CE2-CG 4.19Å; Y514-P562 WeakPolarHBondContact OH-CD 3.46Å; Y514-P562 WeakPolarHBondContact OH-CG 3.1Å
515	N	65.5	Low	63.8	Low	40 Å²	40	65.5 Å²	65.5	21%	0.214	33%	0.325	C	S	.	.	H	α-helix	trans	-69.5	-40	178	-159	27.4	0	0	0	112.1	L511 S512 Y513 I529	L511-N515 PolarHBondContact O-N 3.07Å; S512-N515 PolarHBondContact O-N 3.36Å; Y513-N515 VanDerWaalsContact C-N 3.27Å; Y513-N515 PolarHBondContact O-N 2.96Å; N515-I529 HydrophobicContact CB-CD1 4.26Å
516	S	62.8	Low	63.7	Low	74 Å²	74	64.7 Å²	64.7	52%	0.517	33%	0.325	S	S	.	.	H	α-helix	trans	-72.9	-40.8	-178.4	-178.1	0	0	0	0	114.1	S512 Y513	S512-S516 VanDerWaalsContact O-CB 3.27Å; S512-S516 WeakPolarHBondContact O-CB 3.41Å; S512-S516 PolarHBondContact O-N 3.08Å; Y513-S516 PolarHBondContact O-N 3.21Å
517	H	62.1	Low	63.4	Low	104 Å²	104	63 Å²	63	48%	0.481	32%	0.316	S	S	.	.	H	α-helix	trans	-89.7	-21.5	-171.6	-83.3	59.2	0	0	0	114.9	Y513 Q519	Y513-H517 AromaticContact CD2-CE1 3.77Å; Y513-H517 AromaticContact CD2-ND1 3.66Å; Y513-H517 HydrophobicContact CE1-CB 4.17Å; Y513-H517 AromaticContact CE2-CD2 3.65Å; Y513-H517 AromaticContact CE2-CE1 3.25Å; Y513-H517 WeakPolarHBondContact CE2-CE1 3.41Å; Y513-H517 AromaticContact CE2-CG 3.65Å; Y513-H517 AromaticContact CE2-ND1 3.4Å; Y513-H517 WeakPolarHBondContact CE2-ND1 3.36Å; Y513-H517 AromaticContact CE2-NE2 3.39Å; Y513-H517 WeakPolarHBondContact CE2-NE2 3.3Å; Y513-H517 AromaticContact CZ-CD2 3.45Å; Y513-H517 VanDerWaalsContact CZ-CD2 3.45Å; Y513-H517 AromaticContact CZ-CE1 3.89Å; Y513-H517 AromaticContact CZ-CG 3.53Å; Y513-H517 AromaticContact CZ-ND1 3.81Å; Y513-H517 AromaticContact CZ-NE2 3.68Å; Y513-H517 WeakPolarHBondContact O-CB 3.47Å; Y513-H517 PolarHBondContact O-N 3.35Å; Y513-H517 PolarHBondContact OH-CD2 3.44Å; Y513-H517 PolarHBondContact OH-NE2 3.32Å; H517-Q519 VanDerWaalsContact C-N 3.28Å; H517-Q519 PolarHBondContact O-N 3.49Å; H517-Q519 VanDerWaalsContact O-N 3.13Å
518	N	54.6	Low	63.4	Low	13 Å²	13	65.8 Å²	65.8	7%	0.07	33%	0.329	C	S	.	.			trans	-89.7	50.6	-177.7	-69.4	-73	0	0	0	112.8	Y514 N520 R521 N522 I525	Y514-N518 WeakPolarHBondContact O-CB 3.37Å; Y514-N518 PolarHBondContact O-N 3.41Å; Y514-N518 PolarHBondContact O-ND2 2.9Å; N518-N520 PolarHBondContact O-N 2.74Å; N518-R521 HydrophobicContact CB-CB 4.32Å; N518-R521 PolarHBondContact O-N 3.26Å; N518-N522 PolarHBondContact O-OD1 2.84Å; N518-N522 VanDerWaalsContact O-OD1 3.04Å; N518-I525 HydrophobicContact CB-CD1 3.63Å
519	Q	49.3	Very low	63.5	Low	153 Å²	153	65.6 Å²	65.6	72%	0.715	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.9	-19.8	-172.6	-68.2	-172.3	-8.1	0	0	116.2	H517 N522	H517-Q519 VanDerWaalsContact C-N 3.28Å; H517-Q519 PolarHBondContact O-N 3.49Å; H517-Q519 VanDerWaalsContact O-N 3.13Å; Q519-N522 WeakPolarHBondContact CA-OD1 3.39Å; Q519-N522 PolarHBondContact O-OD1 3.29Å
520	N	48.9	Very low	63.4	Low	170 Å²	170	64.4 Å²	64.4	91%	0.909	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.2	1.9	176.1	-69.6	-22.5	0	0	0	114	N518	N518-N520 PolarHBondContact O-N 2.74Å
521	R	50.7	Low	63.3	Low	101 Å²	101	65.2 Å²	65.2	38%	0.381	33%	0.331	S	S	.	.			trans	-133.7	3.4	-171.4	-67.1	-178.6	169.4	-148.7	-6.3	115	N518 S523 Y524 I525 P557 G558	N518-R521 HydrophobicContact CB-CB 4.32Å; N518-R521 PolarHBondContact O-N 3.26Å; R521-S523 PolarHBondContact O-N 2.74Å; R521-Y524 PolarHBondContact O-N 3.15Å; R521-I525 HydrophobicContact CB-CD1 4.17Å; R521-P557 PolarHBondContact NH1-O 2.96Å; R521-P557 PolarHBondContact NH2-O 3.32Å; R521-G558 PolarHBondContact NH1-O 2.79Å
522	N	49.4	Very low	63.2	Low	67 Å²	67	66.9 Å²	66.9	36%	0.358	34%	0.339	S	S	.	.	H	α-helix	trans	-41.9	-45.1	-171.5	-62.8	13.7	0	0	0	113.3	N518 Q519 Y524 E526	N518-N522 PolarHBondContact O-OD1 2.84Å; N518-N522 VanDerWaalsContact O-OD1 3.04Å; Q519-N522 WeakPolarHBondContact CA-OD1 3.39Å; Q519-N522 PolarHBondContact O-OD1 3.29Å; N522-Y524 VanDerWaalsContact C-N 3.25Å; N522-Y524 PolarHBondContact O-N 3.29Å; N522-E526 WeakPolarHBondContact O-CB 3.34Å; N522-E526 PolarHBondContact O-N 2.75Å; N522-E526 VanDerWaalsContact O-N 3.12Å
523	S	59.6	Low	63.1	Low	76 Å²	76	65.9 Å²	65.9	53%	0.531	33%	0.33	S	S	.	.	H	α-helix	trans	-48.4	-35.1	177.5	178.4	0	0	0	0	116	R521 K527	R521-S523 PolarHBondContact O-N 2.74Å; S523-K527 WeakPolarHBondContact O-CB 3.34Å; S523-K527 WeakPolarHBondContact O-CD 3.29Å; S523-K527 WeakPolarHBondContact O-CE 3.34Å; S523-K527 WeakPolarHBondContact O-CG 3.22Å; S523-K527 PolarHBondContact OG-NZ 3.17Å
524	Y	66.8	Low	62.7	Low	116 Å²	116	69.6 Å²	69.6	46%	0.455	35%	0.353	S	S	.	.	H	α-helix	trans	-98.7	-49.3	-175.1	-167.1	-83.5	0	0	0	113.2	R521 N522 E526 K527 E528 M556	R521-Y524 PolarHBondContact O-N 3.15Å; N522-Y524 VanDerWaalsContact C-N 3.25Å; N522-Y524 PolarHBondContact O-N 3.29Å; Y524-E526 VanDerWaalsContact C-N 3.32Å; Y524-E526 PolarHBondContact O-N 2.97Å; Y524-K527 PolarHBondContact O-N 3.36Å; Y524-K527 VanDerWaalsContact O-N 3.17Å; Y524-E528 HydrophobicContact CE1-CB 4.46Å; Y524-E528 PolarHBondContact O-N 2.88Å; Y524-M556 HydrophobicContact CD1-CE 4.38Å; Y524-M556 HydrophobicContact CD1-SD 3.77Å; Y524-M556 HydrophobicContact CE1-CE 3.39Å; Y524-M556 HydrophobicContact CE1-CG 4.38Å; Y524-M556 HydrophobicContact CE1-SD 3.35Å; Y524-M556 WeakPolarHBondContact CE1-SD 3.16Å; Y524-M556 WeakPolarHBondContact OH-CE 3.5Å
525	I	67.5	Low	62.6	Low	6 Å²	6	75.1 Å²	75.1	3%	0.031	38%	0.379	C	S	.	.	H	α-helix	trans	-64	-42.4	-178.2	-61.6	170.9	0	0	0	110	N518 R521 K527 E528 I529 I553 V559	N518-I525 HydrophobicContact CB-CD1 3.63Å; R521-I525 HydrophobicContact CB-CD1 4.17Å; I525-K527 VanDerWaalsContact C-N 3.34Å; I525-K527 PolarHBondContact O-N 3.27Å; I525-E528 PolarHBondContact O-N 3.4Å; I525-I529 HydrophobicContact CG2-CD1 3.8Å; I525-I529 HydrophobicContact CG2-CG1 4.45Å; I525-I529 WeakPolarHBondContact O-CB 3.37Å; I525-I529 VanDerWaalsContact O-CG1 3.29Å; I525-I529 WeakPolarHBondContact O-CG1 3.43Å; I525-I529 PolarHBondContact O-N 3.05Å; I525-I553 HydrophobicContact CG2-CG2 4.43Å; I525-V559 HydrophobicContact CD1-CG2 3.98Å
526	E	65.9	Low	62.5	Low	83 Å²	83	76.6 Å²	76.6	39%	0.388	39%	0.387	S	S	.	.	H	α-helix	trans	-65	-37.8	175.8	-164.2	-179.9	174.8	0	0	111.6	N522 Y524 N530	N522-E526 WeakPolarHBondContact O-CB 3.34Å; N522-E526 PolarHBondContact O-N 2.75Å; N522-E526 VanDerWaalsContact O-N 3.12Å; Y524-E526 VanDerWaalsContact C-N 3.32Å; Y524-E526 PolarHBondContact O-N 2.97Å; E526-N530 WeakPolarHBondContact O-CB 3.46Å; E526-N530 PolarHBondContact O-N 3.44Å; E526-N530 PolarHBondContact O-ND2 3.27Å
527	K	67.5	Low	62.2	Low	79 Å²	79	76 Å²	76	34%	0.343	38%	0.381	S	S	.	.	H	α-helix	trans	-65.9	-39.7	173.5	-83.3	178.8	-166.2	141.5	0	112.7	N415 S523 Y524 I525 S531	N415-K527 PolarHBondContact OD1-NZ 3.02Å; S523-K527 WeakPolarHBondContact O-CB 3.34Å; S523-K527 WeakPolarHBondContact O-CD 3.29Å; S523-K527 WeakPolarHBondContact O-CE 3.34Å; S523-K527 WeakPolarHBondContact O-CG 3.22Å; S523-K527 PolarHBondContact OG-NZ 3.17Å; Y524-K527 PolarHBondContact O-N 3.36Å; Y524-K527 VanDerWaalsContact O-N 3.17Å; I525-K527 VanDerWaalsContact C-N 3.34Å; I525-K527 PolarHBondContact O-N 3.27Å; K527-S531 WeakPolarHBondContact O-CA 3.36Å; K527-S531 WeakPolarHBondContact O-CB 3.45Å; K527-S531 PolarHBondContact O-N 2.8Å
528	E	73.2	Confident	62.2	Low	64 Å²	64	78.9 Å²	78.9	30%	0.299	40%	0.395	S	S	.	.	H	α-helix	trans	-70.6	-44.6	-179.3	-160.5	63.7	-164.1	0	0	110.9	Y524 I525 S531 H532 L549	Y524-E528 HydrophobicContact CE1-CB 4.46Å; Y524-E528 PolarHBondContact O-N 2.88Å; I525-E528 PolarHBondContact O-N 3.4Å; E528-S531 PolarHBondContact O-N 3.47Å; E528-H532 WeakPolarHBondContact O-CB 3.04Å; E528-H532 PolarHBondContact O-N 3.31Å; E528-L549 HydrophobicContact CG-CD1 4.5Å
529	I	71	Confident	62.8	Low	0 Å²	0	79.2 Å²	79.2	0%	0	40%	0.397	C	S	.	.	H	α-helix	trans	-59.8	-52.8	173.5	-67.6	172.1	0	0	0	110.4	L493 L511 N515 I525 S531 H532 L533 I553	L493-I529 HydrophobicContact CD1-CG2 4.47Å; L493-I529 HydrophobicContact CD2-CG2 4.21Å; L511-I529 HydrophobicContact CB-CD1 4.27Å; L511-I529 HydrophobicContact CD2-CD1 4.24Å; L511-I529 HydrophobicContact CD2-CG1 4.24Å; N515-I529 HydrophobicContact CB-CD1 4.26Å; I525-I529 HydrophobicContact CG2-CD1 3.8Å; I525-I529 HydrophobicContact CG2-CG1 4.45Å; I525-I529 WeakPolarHBondContact O-CB 3.37Å; I525-I529 VanDerWaalsContact O-CG1 3.29Å; I525-I529 WeakPolarHBondContact O-CG1 3.43Å; I525-I529 PolarHBondContact O-N 3.05Å; I529-S531 VanDerWaalsContact C-N 3.34Å; I529-S531 PolarHBondContact O-N 2.78Å; I529-H532 PolarHBondContact O-N 3.46Å; I529-L533 HydrophobicContact CG2-CD1 3.67Å; I529-L533 HydrophobicContact CG2-CG 4.43Å; I529-L533 WeakPolarHBondContact O-CB 3.5Å; I529-L533 VanDerWaalsContact O-CG 3.28Å; I529-L533 WeakPolarHBondContact O-CG 3.14Å; I529-L533 PolarHBondContact O-N 3.13Å; I529-I553 HydrophobicContact CD1-CD1 4.14Å; I529-I553 HydrophobicContact CG1-CD1 3.56Å
530	N	68	Low	63.3	Low	80 Å²	80	72.7 Å²	72.7	43%	0.428	37%	0.367	S	S	.	.	H	α-helix	trans	-67.2	-34.6	-179.2	-69.2	-15.8	0	0	0	111.9	E526 L534	E526-N530 WeakPolarHBondContact O-CB 3.46Å; E526-N530 PolarHBondContact O-N 3.44Å; E526-N530 PolarHBondContact O-ND2 3.27Å; N530-L534 WeakPolarHBondContact O-CB 3.35Å; N530-L534 PolarHBondContact O-N 3.4Å
531	S	70.7	Confident	64.2	Low	51 Å²	51	67.1 Å²	67.1	36%	0.357	34%	0.341	S	S	.	.	H	α-helix	trans	-62.9	-48.6	174.4	-177.8	0	0	0	0	110.7	K527 E528 I529 H535	K527-S531 WeakPolarHBondContact O-CA 3.36Å; K527-S531 WeakPolarHBondContact O-CB 3.45Å; K527-S531 PolarHBondContact O-N 2.8Å; E528-S531 PolarHBondContact O-N 3.47Å; I529-S531 VanDerWaalsContact C-N 3.34Å; I529-S531 PolarHBondContact O-N 2.78Å; S531-H535 WeakPolarHBondContact O-CB 3.41Å; S531-H535 PolarHBondContact O-N 3.01Å; S531-H535 PolarHBondContact O-ND1 2.66Å
532	H	68.3	Low	65.5	Low	35 Å²	35	65.2 Å²	65.2	16%	0.162	34%	0.339	C	S	.	.	H	α-helix	trans	-65	-44.1	-179.9	-160.3	-71.6	0	0	0	112	E528 I529 N536 D539 L549	E528-H532 WeakPolarHBondContact O-CB 3.04Å; E528-H532 PolarHBondContact O-N 3.31Å; I529-H532 PolarHBondContact O-N 3.46Å; H532-N536 PolarHBondContact O-N 2.76Å; H532-D539 IonicContact CE1-OD2 2.73Å; H532-D539 PolarHBondContact CE1-OD2 2.84Å; H532-L549 HydrophobicContact CB-CD1 3.77Å; H532-L549 HydrophobicContact CB-CD2 3.82Å; H532-L549 HydrophobicContact CB-CG 4.38Å
533	L	68	Low	66.6	Low	16 Å²	16	64.1 Å²	64.1	8%	0.084	33%	0.334	C	S	.	.	H	α-helix	trans	-73.5	-30.3	-178.9	-65.7	176.5	0	0	0	113.6	L493 I529 N536 P537 T540 M546	L493-L533 HydrophobicContact CD2-CD1 3.51Å; L493-L533 HydrophobicContact CG-CD1 4.24Å; I529-L533 HydrophobicContact CG2-CD1 3.67Å; I529-L533 HydrophobicContact CG2-CG 4.43Å; I529-L533 WeakPolarHBondContact O-CB 3.5Å; I529-L533 VanDerWaalsContact O-CG 3.28Å; I529-L533 WeakPolarHBondContact O-CG 3.14Å; I529-L533 PolarHBondContact O-N 3.13Å; L533-N536 CarbonylContact O-C 3.59Å; L533-P537 WeakPolarHBondContact O-CA 3.33Å; L533-T540 HydrophobicContact CD2-CG2 3.65Å; L533-M546 HydrophobicContact CD2-SD 4.46Å
534	L	62.2	Low	67.6	Low	133 Å²	133	67.2 Å²	67.2	70%	0.696	34%	0.338	S	S	*	.	H	α-helix	trans	-75.4	-35	175.2	-173	69.9	0	0	0	112.1	N530	N530-L534 WeakPolarHBondContact O-CB 3.35Å; N530-L534 PolarHBondContact O-N 3.4Å
535	H	63.7	Low	68	Low	117 Å²	117	63.7 Å²	63.7	54%	0.542	33%	0.326	S	S	.	.	H	α-helix	trans	-77.9	-39.4	175.5	-72.5	89.7	0	0	0	112.1	S531	S531-H535 WeakPolarHBondContact O-CB 3.41Å; S531-H535 PolarHBondContact O-N 3.01Å; S531-H535 PolarHBondContact O-ND1 2.66Å
536	N	62.4	Low	68.3	Low	70 Å²	70	63.4 Å²	63.4	37%	0.374	33%	0.325	S	S	.	.			trans	-127.1	70.4	-176.3	-59.1	-7.1	0	0	0	111.9	H532 L533 Q538 D539	H532-N536 PolarHBondContact O-N 2.76Å; L533-N536 CarbonylContact O-C 3.59Å; N536-Q538 PolarHBondContact O-N 2.87Å; N536-Q538 VanDerWaalsContact O-N 3.15Å; N536-D539 HydrophobicContact CB-CB 4.01Å; N536-D539 WeakPolarHBondContact CB-OD2 3.11Å; N536-D539 PolarHBondContact ND2-OD2 3.31Å; N536-D539 WeakPolarHBondContact O-CB 3.49Å; N536-D539 PolarHBondContact O-N 2.72Å
537	P	56	Low	68.9	Low	62 Å²	62	62.7 Å²	62.7	40%	0.403	32%	0.323	S	S	.	.	G	3₁₀ helix	trans	-61.3	-26.3	178.9	23.7	-34	0	0	0	113.2	L533 D539 T540	L533-P537 WeakPolarHBondContact O-CA 3.33Å; P537-D539 VanDerWaalsContact C-N 3.26Å; P537-D539 PolarHBondContact O-N 3.08Å; P537-T540 WeakPolarHBondContact O-CG2 3.36Å; P537-T540 PolarHBondContact O-N 3.25Å; P537-T540 PolarHBondContact O-OG1 3.06Å
538	Q	62.6	Low	69.6	Low	165 Å²	165	63.5 Å²	63.5	77%	0.771	33%	0.327	S	S	*	.	G	3₁₀ helix	trans	-69.2	-20.2	175.7	-58.6	-62.3	-22.5	0	0	113.4	N536 T540	N536-Q538 PolarHBondContact O-N 2.87Å; N536-Q538 VanDerWaalsContact O-N 3.15Å; Q538-T540 PolarHBondContact O-N 3.12Å
539	D	67	Low	69.8	Low	20 Å²	20	60.5 Å²	60.5	11%	0.107	31%	0.313	C	S	.	.	G	3₁₀ helix	trans	-73.8	-12.7	179.9	-74.5	-13.9	0	0	0	112.6	H532 N536 P537 C541 N542 E545 M546	H532-D539 IonicContact CE1-OD2 2.73Å; H532-D539 PolarHBondContact CE1-OD2 2.84Å; N536-D539 HydrophobicContact CB-CB 4.01Å; N536-D539 WeakPolarHBondContact CB-OD2 3.11Å; N536-D539 PolarHBondContact ND2-OD2 3.31Å; N536-D539 WeakPolarHBondContact O-CB 3.49Å; N536-D539 PolarHBondContact O-N 2.72Å; P537-D539 VanDerWaalsContact C-N 3.26Å; P537-D539 PolarHBondContact O-N 3.08Å; D539-C541 PolarHBondContact O-N 3.42Å; D539-C541 VanDerWaalsContact O-N 3.13Å; D539-N542 HydrophobicContact CB-CB 4.49Å; D539-N542 WeakPolarHBondContact O-CB 3.16Å; D539-N542 PolarHBondContact O-N 2.67Å; D539-E545 HydrophobicContact CB-CB 3.93Å; D539-M546 WeakPolarHBondContact O-CG 3.44Å
540	T	60.8	Low	70.2	Confident	16 Å²	16	60.8 Å²	60.8	10%	0.098	31%	0.314	C	S	.	.	G	3₁₀ helix	trans	-53.5	-33.9	-179.4	47	0	0	0	0	114.7	C500 M508 L533 P537 Q538	C500-T540 PolarHBondContact SG-O 2.97Å; M508-T540 HydrophobicContact CE-CG2 4.25Å; M508-T540 WeakPolarHBondContact CE-O 3.39Å; L533-T540 HydrophobicContact CD2-CG2 3.65Å; P537-T540 WeakPolarHBondContact O-CG2 3.36Å; P537-T540 PolarHBondContact O-N 3.25Å; P537-T540 PolarHBondContact O-OG1 3.06Å; Q538-T540 PolarHBondContact O-N 3.12Å
541	C	68.2	Low	70.8	Confident	53 Å²	53	61.7 Å²	61.7	36%	0.358	32%	0.319	S	S	.	.	G	3₁₀ helix	trans	-106.9	13.4	173.2	-60.4	0	0	0	0	113.5	C500 S504 D539	C500-C541 WeakPolarHBondContact CA-SG 3.45Å; C500-C541 HydrophobicContact CB-CB 3.67Å; C500-C541 WeakPolarHBondContact CB-SG 3.38Å; C500-C541 WeakPolarHBondContact SG-CA 3.29Å; C500-C541 WeakPolarHBondContact SG-CB 3.28Å; C500-C541 CovalentContact SG-SG 2.04Å; C500-C541 PolarHBondContact SG-SG 3.02Å; S504-C541 PolarHBondContact OG-O 3.25Å; D539-C541 PolarHBondContact O-N 3.42Å; D539-C541 VanDerWaalsContact O-N 3.13Å
542	N	76.2	Confident	71.2	Confident	61 Å²	61	63.2 Å²	63.2	33%	0.326	32%	0.323	S	S	.	.			trans	-99.8	92.6	177.4	-174.1	-13.5	0	0	0	110	D539 K544 E545 M546	D539-N542 HydrophobicContact CB-CB 4.49Å; D539-N542 WeakPolarHBondContact O-CB 3.16Å; D539-N542 PolarHBondContact O-N 2.67Å; N542-K544 PolarHBondContact O-N 2.65Å; N542-K544 PolarHBondContact OD1-N 3.06Å; N542-E545 HydrophobicContact CB-CB 4.46Å; N542-E545 WeakPolarHBondContact ND2-CG 3.42Å; N542-E545 PolarHBondContact O-N 2.95Å; N542-M546 WeakPolarHBondContact O-CG 3.4Å; N542-M546 PolarHBondContact O-N 3.46Å
543	T	73.3	Confident	71.6	Confident	44 Å²	44	61.7 Å²	61.7	27%	0.27	32%	0.316	S	S	.	.	H	α-helix	trans	-44.9	-37	178.5	52.5	0	0	0	0	113.9	D501 A503 S504 N547	D501-T543 WeakPolarHBondContact OD1-CG2 3.42Å; D501-T543 VanDerWaalsContact OD2-CG2 3.26Å; D501-T543 WeakPolarHBondContact OD2-CG2 3.48Å; A503-T543 HydrophobicContact CB-CG2 3.67Å; S504-T543 WeakPolarHBondContact OG-CG2 3.39Å; T543-N547 VanDerWaalsContact O-CB 3.23Å; T543-N547 WeakPolarHBondContact O-CB 3.26Å; T543-N547 PolarHBondContact O-N 2.68Å; T543-N547 PolarHBondContact O-ND2 2.92Å
544	K	79.6	Confident	71.8	Confident	141 Å²	141	63.4 Å²	63.4	61%	0.613	33%	0.325	S	S	*	.	H	α-helix	trans	-72.3	-40.4	-176.5	-168.6	178.1	-177.5	-179.7	0	112.7	N542 K548	N542-K544 PolarHBondContact O-N 2.65Å; N542-K544 PolarHBondContact OD1-N 3.06Å; K544-K548 WeakPolarHBondContact O-CG 3.35Å; K544-K548 PolarHBondContact O-N 3.27Å
545	E	76.6	Confident	72.5	Confident	42 Å²	42	61.2 Å²	61.2	20%	0.196	32%	0.321	C	S	.	.	H	α-helix	trans	-79.3	-35.6	178.1	-55.6	-52.7	125.1	0	0	111.2	D539 N542 N547 K548 L549	D539-E545 HydrophobicContact CB-CB 3.93Å; N542-E545 HydrophobicContact CB-CB 4.46Å; N542-E545 WeakPolarHBondContact ND2-CG 3.42Å; N542-E545 PolarHBondContact O-N 2.95Å; E545-N547 PolarHBondContact O-N 2.69Å; E545-K548 WeakPolarHBondContact O-CB 3.42Å; E545-K548 PolarHBondContact O-N 3.48Å; E545-K548 VanDerWaalsContact O-N 3.12Å; E545-K548 IonicContact OE1-NZ 2.78Å; E545-K548 PolarHBondContact OE1-NZ 2.85Å; E545-K548 WeakPolarHBondContact OE2-CD 3.28Å; E545-K548 WeakPolarHBondContact OE2-CE 3.27Å; E545-K548 IonicContact OE2-NZ 2.85Å; E545-K548 PolarHBondContact OE2-NZ 3.18Å; E545-L549 PolarHBondContact O-N 3.42Å
546	M	72.8	Confident	72.8	Confident	0 Å²	0	58.5 Å²	58.5	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-62.7	-41.6	171.2	-65.5	-63	-72.6	0	0	112.4	T507 M508 L511 L533 D539 N542 K548 L549 E550	T507-M546 WeakPolarHBondContact OG1-CB 3.31Å; M508-M546 HydrophobicContact CE-CE 3.57Å; M508-M546 HydrophobicContact SD-CE 3.53Å; M508-M546 VanDerWaalsContact SD-CE 3.53Å; L511-M546 HydrophobicContact CD1-CE 3.41Å; L511-M546 VanDerWaalsContact CD1-CE 3.41Å; L533-M546 HydrophobicContact CD2-SD 4.46Å; D539-M546 WeakPolarHBondContact O-CG 3.44Å; N542-M546 WeakPolarHBondContact O-CG 3.4Å; N542-M546 PolarHBondContact O-N 3.46Å; M546-K548 VanDerWaalsContact C-N 3.32Å; M546-K548 PolarHBondContact O-N 3.04Å; M546-L549 PolarHBondContact O-N 3.35Å; M546-E550 PolarHBondContact O-N 3.45Å
547	N	78	Confident	72.9	Confident	67 Å²	67	60.5 Å²	60.5	36%	0.358	33%	0.326	S	S	.	.	H	α-helix	trans	-65.1	-33.1	172.4	-85	-70.6	0	0	0	112.3	T543 E545 N551	T543-N547 VanDerWaalsContact O-CB 3.23Å; T543-N547 WeakPolarHBondContact O-CB 3.26Å; T543-N547 PolarHBondContact O-N 2.68Å; T543-N547 PolarHBondContact O-ND2 2.92Å; E545-N547 PolarHBondContact O-N 2.69Å; N547-N551 WeakPolarHBondContact O-CB 3.41Å; N547-N551 PolarHBondContact O-N 3.12Å; N547-N551 PolarHBondContact O-ND2 2.88Å
548	K	82	Confident	73.2	Confident	97 Å²	97	60.1 Å²	60.1	42%	0.422	33%	0.334	S	S	.	.	H	α-helix	trans	-65.7	-44.5	171.8	-77	161.8	165.1	176.2	0	111.2	K544 E545 M546 N551 N552	K544-K548 WeakPolarHBondContact O-CG 3.35Å; K544-K548 PolarHBondContact O-N 3.27Å; E545-K548 WeakPolarHBondContact O-CB 3.42Å; E545-K548 PolarHBondContact O-N 3.48Å; E545-K548 VanDerWaalsContact O-N 3.12Å; E545-K548 IonicContact OE1-NZ 2.78Å; E545-K548 PolarHBondContact OE1-NZ 2.85Å; E545-K548 WeakPolarHBondContact OE2-CD 3.28Å; E545-K548 WeakPolarHBondContact OE2-CE 3.27Å; E545-K548 IonicContact OE2-NZ 2.85Å; E545-K548 PolarHBondContact OE2-NZ 3.18Å; M546-K548 VanDerWaalsContact C-N 3.32Å; M546-K548 PolarHBondContact O-N 3.04Å; K548-N551 PolarHBondContact O-N 3.21Å; K548-N552 WeakPolarHBondContact O-CB 3.39Å; K548-N552 PolarHBondContact O-N 3.42Å; K548-N552 PolarHBondContact O-OD1 3.49Å
549	L	78.3	Confident	73.1	Confident	0 Å²	0	53.2 Å²	53.2	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-61.1	-44.9	176.5	179.1	59.3	0	0	0	111.6	L511 E528 H532 E545 M546 N552 I553	L511-L549 HydrophobicContact CD1-CD2 3.83Å; L511-L549 HydrophobicContact CD1-CG 4.36Å; L511-L549 HydrophobicContact CD2-CD2 4.47Å; L511-L549 HydrophobicContact CD2-CG 4.27Å; E528-L549 HydrophobicContact CG-CD1 4.5Å; H532-L549 HydrophobicContact CB-CD1 3.77Å; H532-L549 HydrophobicContact CB-CD2 3.82Å; H532-L549 HydrophobicContact CB-CG 4.38Å; E545-L549 PolarHBondContact O-N 3.42Å; M546-L549 PolarHBondContact O-N 3.35Å; L549-N552 PolarHBondContact O-N 2.92Å; L549-I553 HydrophobicContact CD1-CD1 3.85Å; L549-I553 HydrophobicContact CD1-CG1 4.42Å; L549-I553 HydrophobicContact CG-CD1 3.98Å; L549-I553 WeakPolarHBondContact O-CG1 3.41Å; L549-I553 PolarHBondContact O-N 2.91Å
550	E	79.2	Confident	72.7	Confident	7 Å²	7	56.6 Å²	56.6	3%	0.033	32%	0.32	C	S	.	.	H	α-helix	trans	-60.9	-44.6	173.4	175.4	164	-156.6	0	0	111.7	H510 Y514 M546 N552 I553 L554	H510-E550 IonicContact CD2-OE1 3.26Å; H510-E550 IonicContact CD2-OE2 3.35Å; H510-E550 IonicContact CG-OE1 2.65Å; Y514-E550 HydrophobicContact CE2-CG 3.94Å; Y514-E550 WeakPolarHBondContact CE2-OE1 3.45Å; Y514-E550 PolarHBondContact OH-OE1 2.95Å; M546-E550 PolarHBondContact O-N 3.45Å; E550-N552 VanDerWaalsContact C-N 3.35Å; E550-N552 PolarHBondContact O-N 3.25Å; E550-I553 CarbonylContact O-C 3.46Å; E550-I553 PolarHBondContact O-N 2.67Å; E550-L554 HydrophobicContact CG-CD1 3.76Å; E550-L554 HydrophobicContact CG-CG 4.28Å; E550-L554 WeakPolarHBondContact O-CB 3.29Å; E550-L554 WeakPolarHBondContact O-CG 3.45Å; E550-L554 PolarHBondContact O-N 3.36Å
551	N	80.6	Confident	72.6	Confident	98 Å²	98	58.4 Å²	58.4	52%	0.524	33%	0.327	S	S	.	.	H	α-helix	trans	-64	-37.1	176.8	-79.1	-60.1	0	0	0	112.8	N547 K548 L554 S555	N547-N551 WeakPolarHBondContact O-CB 3.41Å; N547-N551 PolarHBondContact O-N 3.12Å; N547-N551 PolarHBondContact O-ND2 2.88Å; K548-N551 PolarHBondContact O-N 3.21Å; N551-L554 PolarHBondContact O-N 3.21Å; N551-S555 WeakPolarHBondContact O-CB 3.48Å; N551-S555 PolarHBondContact O-N 3.06Å
552	N	79.7	Confident	71.7	Confident	83 Å²	83	56.1 Å²	56.1	44%	0.444	31%	0.311	S	S	.	.	H	α-helix	trans	-63.1	-44.6	173.7	-70.3	-13.1	0	0	0	110.8	K548 L549 E550 L554 S555	K548-N552 WeakPolarHBondContact O-CB 3.39Å; K548-N552 PolarHBondContact O-N 3.42Å; K548-N552 PolarHBondContact O-OD1 3.49Å; L549-N552 PolarHBondContact O-N 2.92Å; E550-N552 VanDerWaalsContact C-N 3.35Å; E550-N552 PolarHBondContact O-N 3.25Å; N552-L554 VanDerWaalsContact C-N 3.35Å; N552-S555 PolarHBondContact O-N 3.2Å; N552-S555 PolarHBondContact O-OG 2.95Å
553	I	75.7	Confident	70.3	Confident	4 Å²	4	59.3 Å²	59.3	2%	0.021	32%	0.319	C	S	.	.	H	α-helix	trans	-68.4	-32.8	176.8	-70.9	163.5	0	0	0	111.6	L511 Y514 I525 I529 L549 E550 M556 V559	L511-I553 HydrophobicContact CD2-CD1 3.42Å; L511-I553 VanDerWaalsContact CD2-CD1 3.42Å; Y514-I553 HydrophobicContact CD1-CG2 4.34Å; Y514-I553 HydrophobicContact CD2-CG2 4.08Å; Y514-I553 HydrophobicContact CG-CG2 4.04Å; I525-I553 HydrophobicContact CG2-CG2 4.43Å; I529-I553 HydrophobicContact CD1-CD1 4.14Å; I529-I553 HydrophobicContact CG1-CD1 3.56Å; L549-I553 HydrophobicContact CD1-CD1 3.85Å; L549-I553 HydrophobicContact CD1-CG1 4.42Å; L549-I553 HydrophobicContact CG-CD1 3.98Å; L549-I553 WeakPolarHBondContact O-CG1 3.41Å; L549-I553 PolarHBondContact O-N 2.91Å; E550-I553 CarbonylContact O-C 3.46Å; E550-I553 PolarHBondContact O-N 2.67Å; I553-M556 WeakPolarHBondContact O-CB 3.36Å; I553-M556 PolarHBondContact O-N 3.35Å; I553-V559 HydrophobicContact CG2-CG1 4.17Å; I553-V559 WeakPolarHBondContact O-CG2 3.48Å
554	L	73.6	Confident	68.9	Low	51 Å²	51	60.8 Å²	60.8	27%	0.267	33%	0.328	S	S	.	.	H	α-helix	trans	-71.8	-28.7	172.7	-80	169	0	0	0	113.5	Y514 E550 N551 N552 M556 H561	Y514-L554 HydrophobicContact CE1-CD2 3.99Å; Y514-L554 HydrophobicContact CE1-CG 4.48Å; Y514-L554 VanDerWaalsContact OH-CD2 3.3Å; Y514-L554 WeakPolarHBondContact OH-CD2 3.22Å; Y514-L554 WeakPolarHBondContact OH-CG 3.47Å; E550-L554 HydrophobicContact CG-CD1 3.76Å; E550-L554 HydrophobicContact CG-CG 4.28Å; E550-L554 WeakPolarHBondContact O-CB 3.29Å; E550-L554 WeakPolarHBondContact O-CG 3.45Å; E550-L554 PolarHBondContact O-N 3.36Å; N551-L554 PolarHBondContact O-N 3.21Å; N552-L554 VanDerWaalsContact C-N 3.35Å; L554-M556 PolarHBondContact O-N 3.24Å; L554-H561 HydrophobicContact CD2-CB 4.16Å; L554-H561 WeakPolarHBondContact CD2-ND1 3.25Å
555	S	75.5	Confident	67.1	Low	87 Å²	87	55.9 Å²	55.9	61%	0.608	31%	0.31	S	S	*	.	H	α-helix	trans	-71	-14.8	175.6	79.4	0	0	0	0	113.5	N551 N552 P557	N551-S555 WeakPolarHBondContact O-CB 3.48Å; N551-S555 PolarHBondContact O-N 3.06Å; N552-S555 PolarHBondContact O-N 3.2Å; N552-S555 PolarHBondContact O-OG 2.95Å; S555-P557 WeakPolarHBondContact O-CD 3.46Å
556	M	70.6	Confident	65.1	Low	61 Å²	61	57 Å²	57	30%	0.3	32%	0.319	S	S	.	.	S	Bend	trans	-69.6	121.3	178	-77.8	-90.9	137	0	0	111.7	Y524 I553 L554 G558 V559	Y524-M556 HydrophobicContact CD1-CE 4.38Å; Y524-M556 HydrophobicContact CD1-SD 3.77Å; Y524-M556 HydrophobicContact CE1-CE 3.39Å; Y524-M556 HydrophobicContact CE1-CG 4.38Å; Y524-M556 HydrophobicContact CE1-SD 3.35Å; Y524-M556 WeakPolarHBondContact CE1-SD 3.16Å; Y524-M556 WeakPolarHBondContact OH-CE 3.5Å; I553-M556 WeakPolarHBondContact O-CB 3.36Å; I553-M556 PolarHBondContact O-N 3.35Å; L554-M556 PolarHBondContact O-N 3.24Å; M556-G558 PolarHBondContact O-N 2.96Å; M556-G558 VanDerWaalsContact O-N 3.08Å; M556-V559 HydrophobicContact CB-CG2 3.6Å; M556-V559 PolarHBondContact O-N 3.45Å
557	P	63.9	Low	63.2	Low	111 Å²	111	61.6 Å²	61.6	72%	0.721	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.9	116.5	-176.8	-25.2	33.5	0	0	0	112.3	R521 S555	R521-P557 PolarHBondContact NH1-O 2.96Å; R521-P557 PolarHBondContact NH2-O 3.32Å; S555-P557 WeakPolarHBondContact O-CD 3.46Å
558	G	62.6	Low	61.2	Low	55 Å²	55	61.8 Å²	61.8	57%	0.567	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	87.3	18.9	176.4	0	0	0	0	0	116.2	R521 M556	R521-G558 PolarHBondContact NH1-O 2.79Å; M556-G558 PolarHBondContact O-N 2.96Å; M556-G558 VanDerWaalsContact O-N 3.08Å
559	V	61	Low	58.9	Low	19 Å²	19	61 Å²	61	12%	0.115	35%	0.353	C	S	.	.	P	Polyproline II helix	trans	-75	127.8	161.5	172.3	0	0	0	0	109	Y514 I525 I553 M556	Y514-V559 HydrophobicContact CD1-CG1 3.41Å; Y514-V559 VanDerWaalsContact CD1-CG1 3.41Å; Y514-V559 HydrophobicContact CE1-CG1 3.69Å; Y514-V559 HydrophobicContact CG-CG1 4.38Å; I525-V559 HydrophobicContact CD1-CG2 3.98Å; I553-V559 HydrophobicContact CG2-CG1 4.17Å; I553-V559 WeakPolarHBondContact O-CG2 3.48Å; M556-V559 HydrophobicContact CB-CG2 3.6Å; M556-V559 PolarHBondContact O-N 3.45Å
560	I	59.2	Low	56.9	Low	92 Å²	92	64.3 Å²	64.3	47%	0.472	37%	0.373	S	S	.	.	P	Polyproline II helix	trans	-79.3	124.9	179.1	-57.6	173.8	0	0	0	109.1	T565	I560-T565 HydrophobicContact CG2-CG2 4.23Å
561	H	57.3	Low	54.8	Low	54 Å²	54	66.9 Å²	66.9	25%	0.25	39%	0.389	C	S	.	.	P	Polyproline II helix	trans	-78.1	129.7	-174.4	-163.1	3	0	0	0	110.3	Y514 L554 R563 T564 T565	Y514-H561 PolarHBondContact OH-ND1 3.32Å; L554-H561 HydrophobicContact CD2-CB 4.16Å; L554-H561 WeakPolarHBondContact CD2-ND1 3.25Å; H561-R563 PolarHBondContact ND1-N 2.81Å; H561-R563 PolarHBondContact O-N 2.89Å; H561-T564 HydrophobicContact CB-CG2 4Å; H561-T564 PolarHBondContact N-OG1 2.84Å; H561-T564 WeakPolarHBondContact O-CA 3.25Å; H561-T564 PolarHBondContact O-N 3.34Å; H561-T564 PolarHBondContact O-OG1 3.25Å; H561-T565 PolarHBondContact O-N 2.79Å; H561-T565 VanDerWaalsContact O-N 3.13Å
562	P	50.4	Low	52.8	Low	4 Å²	4	66 Å²	66	3%	0.026	39%	0.388	C	S	.	.	H	α-helix	trans	-57.6	-25.8	168.7	23	-34.3	0	0	0	111.5	H510 Y513 Y514 T565 T566	H510-P562 HydrophobicContact CB-CG 4.17Å; H510-P562 WeakPolarHBondContact ND1-CG 3.15Å; Y513-P562 HydrophobicContact CD1-CB 3.72Å; Y513-P562 HydrophobicContact CD1-CG 4.38Å; Y513-P562 HydrophobicContact CE1-CB 4.03Å; Y513-P562 HydrophobicContact CG-CB 4.31Å; Y514-P562 HydrophobicContact CE1-CG 3.97Å; Y514-P562 HydrophobicContact CE2-CG 4.19Å; Y514-P562 WeakPolarHBondContact OH-CD 3.46Å; Y514-P562 WeakPolarHBondContact OH-CG 3.1Å; P562-T565 WeakPolarHBondContact CA-OG1 3.47Å; P562-T565 PolarHBondContact O-N 3.03Å; P562-T565 PolarHBondContact O-OG1 3.37Å; P562-T566 WeakPolarHBondContact O-CB 3.2Å; P562-T566 PolarHBondContact O-N 3.43Å; P562-T566 PolarHBondContact O-OG1 3.44Å
563	R	47.4	Very low	50.8	Low	129 Å²	129	65.9 Å²	65.9	49%	0.487	39%	0.39	S	S	.	.	H	α-helix	trans	-74.3	-23.8	169	-70.4	-169.3	176.5	116.8	7.3	113.8	H561 T566 I567	H561-R563 PolarHBondContact ND1-N 2.81Å; H561-R563 PolarHBondContact O-N 2.89Å; R563-T566 WeakPolarHBondContact CA-OG1 3.47Å; R563-I567 WeakPolarHBondContact O-CA 3.12Å; R563-I567 WeakPolarHBondContact O-CB 3.39Å; R563-I567 WeakPolarHBondContact O-CD1 3.47Å; R563-I567 WeakPolarHBondContact O-CG1 3.2Å; R563-I567 PolarHBondContact O-N 3.13Å
564	T	43.8	Very low	48.8	Very low	75 Å²	75	68.9 Å²	68.9	46%	0.46	41%	0.408	S	S	.	.	H	α-helix	trans	-76.3	-26.5	167.5	54.2	0	0	0	0	113.2	H561 S568	H561-T564 HydrophobicContact CB-CG2 4Å; H561-T564 PolarHBondContact N-OG1 2.84Å; H561-T564 WeakPolarHBondContact O-CA 3.25Å; H561-T564 PolarHBondContact O-N 3.34Å; H561-T564 PolarHBondContact O-OG1 3.25Å; T564-S568 WeakPolarHBondContact O-CB 3.17Å; T564-S568 PolarHBondContact O-N 2.91Å
565	T	40.5	Very low	47.1	Very low	38 Å²	38	71 Å²	71	23%	0.233	42%	0.419	C	S	.	.	H	α-helix	trans	-90.5	-27.8	174.4	49.5	0	0	0	0	113.6	Y513 I560 H561 P562 S568 T569	Y513-T565 WeakPolarHBondContact OH-CB 3.36Å; Y513-T565 WeakPolarHBondContact OH-CG2 3.41Å; Y513-T565 PolarHBondContact OH-OG1 3.43Å; I560-T565 HydrophobicContact CG2-CG2 4.23Å; H561-T565 PolarHBondContact O-N 2.79Å; H561-T565 VanDerWaalsContact O-N 3.13Å; P562-T565 WeakPolarHBondContact CA-OG1 3.47Å; P562-T565 PolarHBondContact O-N 3.03Å; P562-T565 PolarHBondContact O-OG1 3.37Å; T565-S568 CarbonylContact O-C 3.6Å; T565-S568 PolarHBondContact O-N 3.27Å; T565-T569 WeakPolarHBondContact O-CB 3.44Å; T565-T569 WeakPolarHBondContact O-CG2 3.42Å; T565-T569 PolarHBondContact O-N 2.93Å; T565-T569 PolarHBondContact O-OG1 3.19Å; T565-T569 VanDerWaalsContact O-OG1 3.07Å
566	T	35.3	Very low	45.2	Very low	65 Å²	65	71.8 Å²	71.8	40%	0.399	42%	0.42	S	S	.	.	H	α-helix	trans	-78.8	-25.3	164.4	48.8	0	0	0	0	112.7	P562 R563 T569 T570	P562-T566 WeakPolarHBondContact O-CB 3.2Å; P562-T566 PolarHBondContact O-N 3.43Å; P562-T566 PolarHBondContact O-OG1 3.44Å; R563-T566 WeakPolarHBondContact CA-OG1 3.47Å; T566-T569 WeakPolarHBondContact CA-OG1 3.42Å; T566-T570 WeakPolarHBondContact O-CA 3.34Å; T566-T570 WeakPolarHBondContact O-CB 3.41Å; T566-T570 VanDerWaalsContact O-CG2 3.24Å; T566-T570 WeakPolarHBondContact O-CG2 3.47Å; T566-T570 PolarHBondContact O-N 3.47Å; T566-T570 PolarHBondContact O-OG1 3.1Å
567	I	33.7	Very low	43.5	Very low	97 Å²	97	73.8 Å²	73.8	50%	0.497	44%	0.436	S	S	.	.	H	α-helix	trans	-67.1	-46.8	157.2	-71.3	169.1	0	0	0	107.9	R563 T569 T570 V571	R563-I567 WeakPolarHBondContact O-CA 3.12Å; R563-I567 WeakPolarHBondContact O-CB 3.39Å; R563-I567 WeakPolarHBondContact O-CD1 3.47Å; R563-I567 WeakPolarHBondContact O-CG1 3.2Å; R563-I567 PolarHBondContact O-N 3.13Å; I567-T569 PolarHBondContact O-N 2.96Å; I567-T569 VanDerWaalsContact O-N 3.11Å; I567-T570 PolarHBondContact O-N 2.96Å; I567-V571 HydrophobicContact CB-CG2 4.43Å; I567-V571 HydrophobicContact CG2-CB 4.24Å; I567-V571 HydrophobicContact CG2-CG2 3.48Å; I567-V571 VanDerWaalsContact CG2-CG2 3.48Å; I567-V571 VanDerWaalsContact O-CA 3.22Å; I567-V571 WeakPolarHBondContact O-CA 3.3Å; I567-V571 WeakPolarHBondContact O-CB 2.93Å; I567-V571 WeakPolarHBondContact O-CG2 3.43Å; I567-V571 PolarHBondContact O-N 3.5Å
568	S	34.4	Very low	42.1	Very low	70 Å²	70	72.6 Å²	72.6	49%	0.49	43%	0.427	S	S	.	.	H	α-helix	trans	-63.7	-18.8	176.5	-162	0	0	0	0	115.1	T564 T565 T572	T564-S568 WeakPolarHBondContact O-CB 3.17Å; T564-S568 PolarHBondContact O-N 2.91Å; T565-S568 CarbonylContact O-C 3.6Å; T565-S568 PolarHBondContact O-N 3.27Å; S568-T572 WeakPolarHBondContact O-CB 3.39Å; S568-T572 PolarHBondContact O-N 3.32Å; S568-T572 PolarHBondContact O-OG1 3.45Å
569	T	35.3	Very low	40.7	Very low	81 Å²	81	73.1 Å²	73.1	50%	0.497	42%	0.419	S	S	.	.	H	α-helix	trans	-104.4	-27.9	173.7	58.8	0	0	0	0	113.8	T565 T566 I567 T572 T573	T565-T569 WeakPolarHBondContact O-CB 3.44Å; T565-T569 WeakPolarHBondContact O-CG2 3.42Å; T565-T569 PolarHBondContact O-N 2.93Å; T565-T569 PolarHBondContact O-OG1 3.19Å; T565-T569 VanDerWaalsContact O-OG1 3.07Å; T566-T569 WeakPolarHBondContact CA-OG1 3.42Å; I567-T569 PolarHBondContact O-N 2.96Å; I567-T569 VanDerWaalsContact O-N 3.11Å; T569-T572 CarbonylContact O-C 3.59Å; T569-T573 WeakPolarHBondContact O-CB 3.12Å; T569-T573 VanDerWaalsContact O-CG2 3.32Å; T569-T573 WeakPolarHBondContact O-CG2 3.39Å; T569-T573 PolarHBondContact O-N 3.4Å; T569-T573 PolarHBondContact O-OG1 3.26Å
570	T	35.3	Very low	39.3	Very low	69 Å²	69	77.4 Å²	77.4	42%	0.423	45%	0.445	S	S	.	.	H	α-helix	trans	-76.4	-52.1	166.5	61.6	0	0	0	0	109.9	T566 I567 T572 T573 V574	T566-T570 WeakPolarHBondContact O-CA 3.34Å; T566-T570 WeakPolarHBondContact O-CB 3.41Å; T566-T570 VanDerWaalsContact O-CG2 3.24Å; T566-T570 WeakPolarHBondContact O-CG2 3.47Å; T566-T570 PolarHBondContact O-N 3.47Å; T566-T570 PolarHBondContact O-OG1 3.1Å; I567-T570 PolarHBondContact O-N 2.96Å; T570-T572 PolarHBondContact O-N 2.99Å; T570-T572 VanDerWaalsContact O-N 3.11Å; T570-T573 WeakPolarHBondContact CA-OG1 3.16Å; T570-T573 CarbonylContact O-C 3.55Å; T570-T573 VanDerWaalsContact O-C 3.31Å; T570-T573 WeakPolarHBondContact O-CA 3.23Å; T570-T573 PolarHBondContact O-N 3.19Å; T570-T573 PolarHBondContact O-OG1 2.94Å; T570-V574 WeakPolarHBondContact O-CA 3.35Å; T570-V574 WeakPolarHBondContact O-CB 3.25Å; T570-V574 WeakPolarHBondContact O-CG2 3.37Å; T570-V574 PolarHBondContact O-N 3.24Å
571	V	35.1	Very low	38	Very low	62 Å²	62	79.1 Å²	79.1	38%	0.376	45%	0.454	S	S	.	.	H	α-helix	trans	-56.3	-25.5	166.1	-178.1	0	0	0	0	111.8	I567 I575	I567-V571 HydrophobicContact CB-CG2 4.43Å; I567-V571 HydrophobicContact CG2-CB 4.24Å; I567-V571 HydrophobicContact CG2-CG2 3.48Å; I567-V571 VanDerWaalsContact CG2-CG2 3.48Å; I567-V571 VanDerWaalsContact O-CA 3.22Å; I567-V571 WeakPolarHBondContact O-CA 3.3Å; I567-V571 WeakPolarHBondContact O-CB 2.93Å; I567-V571 WeakPolarHBondContact O-CG2 3.43Å; I567-V571 PolarHBondContact O-N 3.5Å; V571-I575 HydrophobicContact CG1-CD1 3.37Å; V571-I575 HydrophobicContact CG1-CG1 3.71Å; V571-I575 WeakPolarHBondContact O-CA 3.31Å; V571-I575 WeakPolarHBondContact O-CB 3.27Å; V571-I575 WeakPolarHBondContact O-CG1 3.35Å; V571-I575 PolarHBondContact O-N 2.93Å
572	T	37.6	Very low	36.7	Very low	80 Å²	80	82.4 Å²	82.4	49%	0.491	48%	0.478	S	S	.	.	H	α-helix	trans	-79.9	-32.1	166.1	-62.2	0	0	0	0	113.8	S568 T569 T570 T576	S568-T572 WeakPolarHBondContact O-CB 3.39Å; S568-T572 PolarHBondContact O-N 3.32Å; S568-T572 PolarHBondContact O-OG1 3.45Å; T569-T572 CarbonylContact O-C 3.59Å; T570-T572 PolarHBondContact O-N 2.99Å; T570-T572 VanDerWaalsContact O-N 3.11Å; T572-T576 VanDerWaalsContact O-CB 3.31Å; T572-T576 WeakPolarHBondContact O-CB 3.41Å; T572-T576 WeakPolarHBondContact O-CG2 3.3Å; T572-T576 PolarHBondContact O-N 2.89Å; T572-T576 VanDerWaalsContact O-N 3.09Å; T572-T576 PolarHBondContact O-OG1 2.92Å
573	T	37.8	Very low	35.6	Very low	79 Å²	79	88.2 Å²	88.2	49%	0.485	51%	0.514	S	S	.	.	H	α-helix	trans	-85.4	-6.8	172.7	57.5	0	0	0	0	114.9	T569 T570 T576 T577	T569-T573 WeakPolarHBondContact O-CB 3.12Å; T569-T573 VanDerWaalsContact O-CG2 3.32Å; T569-T573 WeakPolarHBondContact O-CG2 3.39Å; T569-T573 PolarHBondContact O-N 3.4Å; T569-T573 PolarHBondContact O-OG1 3.26Å; T570-T573 WeakPolarHBondContact CA-OG1 3.16Å; T570-T573 CarbonylContact O-C 3.55Å; T570-T573 VanDerWaalsContact O-C 3.31Å; T570-T573 WeakPolarHBondContact O-CA 3.23Å; T570-T573 PolarHBondContact O-N 3.19Å; T570-T573 PolarHBondContact O-OG1 2.94Å; T573-T576 VanDerWaalsContact CA-OG1 3.28Å; T573-T576 WeakPolarHBondContact CA-OG1 3.41Å; T573-T577 VanDerWaalsContact O-CB 3.28Å; T573-T577 WeakPolarHBondContact O-CB 3.4Å; T573-T577 WeakPolarHBondContact O-CG2 3.48Å; T573-T577 PolarHBondContact O-N 3.25Å; T573-T577 PolarHBondContact O-OG1 3.08Å
574	V	34.6	Very low	34.7	Very low	68 Å²	68	87.7 Å²	87.7	41%	0.412	53%	0.525	S	S	.	.	H	α-helix	trans	-113.2	-31.3	-178.8	173.1	0	0	0	0	108.5	T570 T576 T578	T570-V574 WeakPolarHBondContact O-CA 3.35Å; T570-V574 WeakPolarHBondContact O-CB 3.25Å; T570-V574 WeakPolarHBondContact O-CG2 3.37Å; T570-V574 PolarHBondContact O-N 3.24Å; V574-T576 VanDerWaalsContact C-N 3.3Å; V574-T578 VanDerWaalsContact CG1-OG1 3.31Å; V574-T578 WeakPolarHBondContact CG1-OG1 3.42Å; V574-T578 CarbonylContact O-C 3.59Å; V574-T578 WeakPolarHBondContact O-CA 3.47Å; V574-T578 WeakPolarHBondContact O-CB 3.27Å; V574-T578 PolarHBondContact O-N 3.28Å; V574-T578 PolarHBondContact O-OG1 3.34Å; V574-T578 VanDerWaalsContact O-OG1 3.04Å
575	I	36.9	Very low	33.9	Very low	95 Å²	95	90.9 Å²	90.9	49%	0.487	54%	0.539	S	S	.	.	H	α-helix	trans	-67.2	-34.8	157.1	-68.7	175.9	0	0	0	109.7	V571 T579	V571-I575 HydrophobicContact CG1-CD1 3.37Å; V571-I575 HydrophobicContact CG1-CG1 3.71Å; V571-I575 WeakPolarHBondContact O-CA 3.31Å; V571-I575 WeakPolarHBondContact O-CB 3.27Å; V571-I575 WeakPolarHBondContact O-CG1 3.35Å; V571-I575 PolarHBondContact O-N 2.93Å; I575-T579 HydrophobicContact CB-CG2 4.41Å; I575-T579 HydrophobicContact CG2-CG2 3.96Å; I575-T579 PolarHBondContact O-OG1 3.03Å
576	T	36	Very low	33.3	Very low	103 Å²	103	96.8 Å²	96.8	63%	0.632	57%	0.566	S	S	*	*	H	α-helix	trans	-82.8	-7.9	174.6	56.1	0	0	0	0	115.6	T572 T573 V574	T572-T576 VanDerWaalsContact O-CB 3.31Å; T572-T576 WeakPolarHBondContact O-CB 3.41Å; T572-T576 WeakPolarHBondContact O-CG2 3.3Å; T572-T576 PolarHBondContact O-N 2.89Å; T572-T576 VanDerWaalsContact O-N 3.09Å; T572-T576 PolarHBondContact O-OG1 2.92Å; T573-T576 VanDerWaalsContact CA-OG1 3.28Å; T573-T576 WeakPolarHBondContact CA-OG1 3.41Å; V574-T576 VanDerWaalsContact C-N 3.3Å
577	T	35.4	Very low	33	Very low	104 Å²	104	103 Å²	103	64%	0.638	59%	0.588	S	S	*	*	H	α-helix	trans	-124	-3.7	174.8	64	0	0	0	0	115.3	T573	T573-T577 VanDerWaalsContact O-CB 3.28Å; T573-T577 WeakPolarHBondContact O-CB 3.4Å; T573-T577 WeakPolarHBondContact O-CG2 3.48Å; T573-T577 PolarHBondContact O-N 3.25Å; T573-T577 PolarHBondContact O-OG1 3.08Å
578	T	34	Very low	32.6	Very low	86 Å²	86	103.3 Å²	103.3	53%	0.528	60%	0.598	S	S	.	*	H	α-helix	trans	-137.6	12.5	-170.2	-29.7	0	0	0	0	113.8	V574 T580	V574-T578 VanDerWaalsContact CG1-OG1 3.31Å; V574-T578 WeakPolarHBondContact CG1-OG1 3.42Å; V574-T578 CarbonylContact O-C 3.59Å; V574-T578 WeakPolarHBondContact O-CA 3.47Å; V574-T578 WeakPolarHBondContact O-CB 3.27Å; V574-T578 PolarHBondContact O-N 3.28Å; V574-T578 PolarHBondContact O-OG1 3.34Å; V574-T578 VanDerWaalsContact O-OG1 3.04Å; T578-T580 VanDerWaalsContact C-N 3.26Å; T578-T580 PolarHBondContact O-N 3.35Å
579	T	34.3	Very low	32.4	Very low	65 Å²	65	107.8 Å²	107.8	40%	0.399	62%	0.615	S	S	.	*	S	Bend	trans	-92.8	32.5	164.4	51.8	0	0	0	0	113.4	I575 W666	I575-T579 HydrophobicContact CB-CG2 4.41Å; I575-T579 HydrophobicContact CG2-CG2 3.96Å; I575-T579 PolarHBondContact O-OG1 3.03Å; T579-W666 VanDerWaalsContact OG1-CH2 3.32Å; T579-W666 WeakPolarHBondContact OG1-CH2 3.39Å
580	T	30.6	Very low	32	Very low	109 Å²	109	110.6 Å²	110.6	67%	0.669	62%	0.623	S	S	*	*			trans	-116	145.2	152.9	50.4	0	0	0	0	107.4	T578	T578-T580 VanDerWaalsContact C-N 3.26Å; T578-T580 PolarHBondContact O-N 3.35Å
581	I	31.5	Very low	31.6	Very low	129 Å²	129	113 Å²	113	66%	0.662	64%	0.639	S	S	*	*	S	Bend	trans	99.5	96.5	-179	-55.4	166.7	0	0	0	115.5	L659	I581-L659 HydrophobicContact CD1-CD2 4.39Å; I581-L659 HydrophobicContact CG1-CD2 4.39Å
582	T	30.4	Very low	31.2	Very low	122 Å²	122	119.3 Å²	119.3	75%	0.748	66%	0.658	S	S	*	*			trans	65	100.8	147.9	59.2	0	0	0	0	121
583	T	26.8	Very low	30.9	Very low	127 Å²	127	123.9 Å²	123.9	78%	0.779	67%	0.671	S	S	*	*				-46.8	139.9	129.7	45.8	0	0	0	0	112.2
584	T	28.2	Very low	30.4	Very low	118 Å²	118	130.8 Å²	130.8	72%	0.724	69%	0.688	S	S	*	*				161.8	141.2	126.4	40.4	0	0	0	0	111.9
585	N	27.4	Very low	30.2	Very low	142 Å²	142	134.5 Å²	134.5	76%	0.759	71%	0.705	S	S	*	*			trans	79.5	148.1	166.9	-58	-40.7	0	0	0	120
586	M	29.6	Very low	30.1	Very low	162 Å²	162	138 Å²	138	80%	0.798	72%	0.72	S	S	*	*			trans	78.5	65.4	167.5	-55.7	-55.5	120.9	0	0	119.9
587	K	28.6	Very low	29.9	Very low	195 Å²	195	139.7 Å²	139.7	85%	0.848	72%	0.723	S	S	*	*				18.4	127	128.5	-64.2	175.9	177.7	175.7	0	119.6
588	S	25.5	Very low	29.7	Very low	103 Å²	103	144 Å²	144	72%	0.72	73%	0.733	S	S	*	*			trans	73.8	105	136	-176.1	0	0	0	0	120.2
589	I	28.9	Very low	29.5	Very low	165 Å²	165	151.4 Å²	151.4	85%	0.846	75%	0.751	S	S	*	*				-163.9	148.6	110.8	-92.9	149.2	0	0	0	108.6
590	Q	28.1	Very low	29.3	Very low	140 Å²	140	156.2 Å²	156.2	65%	0.654	77%	0.769	S	S	*	*			trans	-109.7	134.6	-157.3	-67.7	-80.9	-9.9	0	0	114.1
591	P	27.1	Very low	29.4	Very low	119 Å²	119	158.9 Å²	158.9	77%	0.773	77%	0.774	S	S	*	*			trans	-98.4	9.6	152.3	33.8	-29.6	0	0	0	113.6	K593	P591-K593 VanDerWaalsContact C-N 3.33Å; P591-K593 PolarHBondContact O-N 3.29Å
592	Y	26.1	Very low	29.3	Very low	195 Å²	195	156.9 Å²	156.9	77%	0.765	77%	0.769	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.4	77.5	167.5	-73.8	-88.2	0	0	0	111.8
593	K	30.1	Very low	29.1	Very low	175 Å²	175	162.9 Å²	162.9	76%	0.761	78%	0.778	S	S	*	*	T	Hydrogen-bonded Turn	trans	-139.8	-8.1	165.7	-141.1	174.2	-175.2	179.6	0	115.1	P591	P591-K593 VanDerWaalsContact C-N 3.33Å; P591-K593 PolarHBondContact O-N 3.29Å
594	W	28.5	Very low	29.3	Very low	224 Å²	224	164.8 Å²	164.8	85%	0.848	78%	0.778	S	S	*	*	S	Bend	trans	-88.2	-32.4	-177.2	-176.8	50.5	0	0	0	114.3	Q596	W594-Q596 PolarHBondContact O-N 2.69Å
595	L	30.9	Very low	29.2	Very low	147 Å²	147	165.8 Å²	165.8	77%	0.77	78%	0.779	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.3	2.7	-174.9	-89.2	159	0	0	0	115.6
596	Q	34.1	Very low	29.2	Very low	169 Å²	169	166.4 Å²	166.4	79%	0.79	78%	0.781	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93	-5.6	173.6	-83.2	-178	-23.2	0	0	114.5	W594	W594-Q596 PolarHBondContact O-N 2.69Å
597	I	31.9	Very low	29.4	Very low	138 Å²	138	165.5 Å²	165.5	71%	0.708	78%	0.778	S	S	*	*	S	Bend	trans	-121.2	11	-167.9	-59.4	-177.9	0	0	0	114.1
598	K	31.9	Very low	29.6	Very low	194 Å²	194	162.8 Å²	162.8	84%	0.843	77%	0.773	S	S	*	*	S	Bend	trans	-129.9	34	168.2	-74.9	-159	173.9	-171.9	0	115.9
599	R	29.8	Very low	29.7	Very low	241 Å²	241	165 Å²	165	91%	0.909	78%	0.776	S	S	*	*			trans	-121.3	53	161.2	-71.2	-178.3	90	167	4.8	111.9
600	Q	30.2	Very low	29.9	Very low	166 Å²	166	164.3 Å²	164.3	78%	0.776	77%	0.774	S	S	*	*			trans	-150.8	130.5	165.6	-65.8	-173.1	14.3	0	0	105
601	Q	31.9	Very low	30	Very low	166 Å²	166	162.9 Å²	162.9	78%	0.776	78%	0.776	S	S	*	*			cis	-152.4	-172.3	-4.2	-73.1	-144.5	18	0	0	107.1
602	P	29.8	Very low	30.2	Very low	86 Å²	86	165.7 Å²	165.7	56%	0.558	78%	0.776	S	S	*	*			cis	-121.8	155.8	-42.8	28.8	-12.9	0	0	0	112.2	Q604	P602-Q604 HydrophobicContact CB-CG 4.35Å; P602-Q604 HydrophobicContact CG-CG 4.47Å; P602-Q604 PolarHBondContact O-N 3.48Å
603	R	25.2	Very low	30.4	Very low	248 Å²	248	161.3 Å²	161.3	94%	0.936	77%	0.769	S	S	*	*			trans	-77.6	115	151.3	-78.9	-174.1	174	-164	-1.7	108
604	Q	30.8	Very low	30.4	Very low	167 Å²	167	158.7 Å²	158.7	78%	0.78	77%	0.768	S	S	*	*			trans	-124.5	99.2	156.6	-67.1	-171.2	0.4	0	0	106.1	P602	P602-Q604 HydrophobicContact CB-CG 4.35Å; P602-Q604 HydrophobicContact CG-CG 4.47Å; P602-Q604 PolarHBondContact O-N 3.48Å
605	N	27.8	Very low	30.4	Very low	139 Å²	139	156.8 Å²	156.8	74%	0.743	77%	0.766	S	S	*	*				55.3	76.3	92.7	-79.7	9.9	0	0	0	112.6	I607	N605-I607 VanDerWaalsContact C-N 3.35Å; N605-I607 PolarHBondContact O-N 3.26Å
606	I	27.1	Very low	30.3	Very low	155 Å²	155	154 Å²	154	80%	0.795	76%	0.759	S	S	*	*			trans	-73.9	96.4	149	-59	172.4	0	0	0	106.1
607	I	32.2	Very low	30.2	Very low	143 Å²	143	153.1 Å²	153.1	73%	0.733	76%	0.759	S	S	*	*			trans	-110.2	124.2	155.7	-68.7	-179.8	0	0	0	105.7	N605	N605-I607 VanDerWaalsContact C-N 3.35Å; N605-I607 PolarHBondContact O-N 3.26Å
608	N	33.1	Very low	30.2	Very low	139 Å²	139	151.8 Å²	151.8	74%	0.743	76%	0.758	S	S	*	*			trans	-63.6	150.4	-175.4	-75.4	-25.1	0	0	0	112.2	N610	N608-N610 PolarHBondContact O-N 2.84Å
609	N	27.8	Very low	30.1	Very low	149 Å²	149	149.7 Å²	149.7	80%	0.797	75%	0.754	S	S	*	*			trans	-48.5	133.1	176.7	-62.5	-43.8	0	0	0	112.7
610	N	33.3	Very low	30.1	Very low	150 Å²	150	147 Å²	147	80%	0.802	75%	0.749	S	S	*	*			trans	-159.5	87.8	136.5	-94.3	-24.6	0	0	0	111	N608	N608-N610 PolarHBondContact O-N 2.84Å
611	T	30.2	Very low	30.2	Very low	111 Å²	111	148.1 Å²	148.1	68%	0.681	75%	0.752	S	S	*	*			trans	54.9	145.5	133.2	61.9	0	0	0	0	123.3
612	F	30.6	Very low	30.1	Very low	178 Å²	178	144.3 Å²	144.3	78%	0.781	74%	0.743	S	S	*	*			trans	87.3	80.4	158.7	-70.9	-72	0	0	0	121.3
613	T	32.4	Very low	30	Very low	102 Å²	102	147 Å²	147	63%	0.626	75%	0.753	S	S	*	*				57.9	109.4	117.3	61.3	0	0	0	0	122.4
614	T	28.2	Very low	30.1	Very low	120 Å²	120	140.1 Å²	140.1	74%	0.736	74%	0.743	S	S	*	*				72.5	136.5	124.1	64.4	0	0	0	0	123.4
615	K	29.8	Very low	29.9	Very low	185 Å²	185	136.7 Å²	136.7	80%	0.804	74%	0.737	S	S	*	*			trans	85.9	91.2	144.8	-78.4	169.6	-178.9	179	0	120
616	S	28.9	Very low	30	Very low	88 Å²	88	139.4 Å²	139.4	62%	0.615	74%	0.742	S	S	*	*				46.8	119.1	114.9	63.8	0	0	0	0	119.9
617	N	31.2	Very low	29.9	Very low	150 Å²	150	136.4 Å²	136.4	80%	0.802	74%	0.735	S	S	*	*				-176.7	152.3	97.9	-95.6	-30.8	0	0	0	115.8
618	T	31	Very low	29.7	Very low	110 Å²	110	136.5 Å²	136.5	68%	0.675	74%	0.736	S	S	*	*			trans	-37.1	157.6	166.7	55.8	0	0	0	0	119.3
619	I	31.4	Very low	29.4	Very low	151 Å²	151	136 Å²	136	77%	0.774	74%	0.738	S	S	*	*			trans	144.5	106.5	135.3	-76.2	155.9	0	0	0	108.9
620	K	30.3	Very low	29.5	Very low	183 Å²	183	134 Å²	134	80%	0.796	74%	0.735	S	S	*	*				79.8	138.7	76.2	-113.5	179.7	-174	174.6	0	114.7
621	K	31.7	Very low	29.5	Very low	191 Å²	191	131.2 Å²	131.2	83%	0.83	73%	0.727	S	S	*	*			trans	74.1	158.2	164.5	-67.3	178.1	177.2	-178.7	0	117.3
622	S	28.5	Very low	29.6	Very low	86 Å²	86	133.2 Å²	133.2	60%	0.601	73%	0.734	S	S	*	*			cis	177.1	152.4	-39	53.7	0	0	0	0	108.9
623	N	28.7	Very low	29.8	Very low	143 Å²	143	128.8 Å²	128.8	77%	0.765	73%	0.725	S	S	*	*			trans	72.1	111.3	152.3	-64.4	-1.4	0	0	0	120.7
624	S	26.7	Very low	30	Very low	102 Å²	102	130 Å²	130	71%	0.713	73%	0.728	S	S	*	*				97.6	140.5	112.2	79.2	0	0	0	0	122
625	S	27.9	Very low	30.5	Very low	96 Å²	96	130.7 Å²	130.7	67%	0.671	73%	0.727	S	S	*	*			trans	84.1	122.8	144	-57.6	0	0	0	0	120.3
626	K	28.7	Very low	30.6	Very low	195 Å²	195	129.7 Å²	129.7	85%	0.848	72%	0.723	S	S	*	*				44.3	129.9	125.6	-60.8	176.5	178.6	177.9	0	116.6
627	S	25.4	Very low	30.7	Very low	93 Å²	93	131.2 Å²	131.2	65%	0.65	72%	0.724	S	S	*	*			cis	156.6	-170.9	27.2	45.5	0	0	0	0	105.9
628	I	27.5	Very low	30.9	Very low	145 Å²	145	130.6 Å²	130.6	74%	0.744	72%	0.72	S	S	*	*			trans	79.3	99.3	161.7	-61.2	158.9	0	0	0	113
629	V	28.1	Very low	31	Very low	128 Å²	128	129.9 Å²	129.9	78%	0.776	72%	0.715	S	S	*	*				72.1	115.6	98.9	173.2	0	0	0	0	110.7
630	S	29.1	Very low	31.1	Very low	107 Å²	107	129.7 Å²	129.7	75%	0.748	72%	0.716	S	S	*	*				160.6	167.1	77.4	27.5	0	0	0	0	106.2
631	S	33.2	Very low	31.1	Very low	91 Å²	91	128.4 Å²	128.4	64%	0.636	72%	0.718	S	S	*	*			cis	-176.8	159.9	-17.5	51.9	0	0	0	0	107.5
632	N	31.9	Very low	31.3	Very low	153 Å²	153	125.9 Å²	125.9	82%	0.818	72%	0.718	S	S	*	*			trans	70.8	144.5	160.4	-67.8	-2.2	0	0	0	118.1
633	S	35.7	Very low	31.5	Very low	86 Å²	86	129.2 Å²	129.2	60%	0.601	72%	0.721	S	S	*	*			cis	-171.5	158.4	-6.4	45.3	0	0	0	0	113.9
634	N	37.4	Very low	31.4	Very low	128 Å²	128	129.9 Å²	129.9	68%	0.684	72%	0.718	S	S	*	*			trans	95.6	105	149.1	-60.2	-26.4	0	0	0	121.9
635	N	37	Very low	31.6	Very low	134 Å²	134	131.7 Å²	131.7	72%	0.717	72%	0.715	S	S	*	*				74.6	138.7	125.9	-58.2	-15.2	0	0	0	119.4
636	F	31.7	Very low	31.6	Very low	163 Å²	163	132.7 Å²	132.7	72%	0.715	71%	0.713	S	S	*	*			cis	-155.6	124.4	10.8	-148.7	-112	0	0	0	108	L638	F636-L638 HydrophobicContact CE1-CD1 4.41Å
637	L	32.6	Very low	31.6	Very low	121 Å²	121	130.5 Å²	130.5	63%	0.634	71%	0.71	S	S	*	*				53.2	137.3	95.5	-74.2	167.8	0	0	0	115.4	T639	L637-T639 HydrophobicContact CD2-CG2 4.31Å
638	L	35	Very low	31.8	Very low	137 Å²	137	130.8 Å²	130.8	72%	0.717	71%	0.712	S	S	*	*			cis	-141.8	139.8	19	-81.3	98.1	0	0	0	109.7	F636	F636-L638 HydrophobicContact CE1-CD1 4.41Å
639	T	32.4	Very low	32.1	Very low	94 Å²	94	132.1 Å²	132.1	58%	0.577	72%	0.715	S	S	*	*				81	118	56.1	66.5	0	0	0	0	118	L637	L637-T639 HydrophobicContact CD2-CG2 4.31Å
640	N	35	Very low	32	Very low	147 Å²	147	133.1 Å²	133.1	79%	0.786	71%	0.713	S	S	*	*			trans	148.5	108.4	132.8	-73.5	-23.2	0	0	0	111.3
641	N	30.2	Very low	32	Very low	157 Å²	157	134.5 Å²	134.5	84%	0.84	71%	0.712	S	S	*	*				76.4	140.5	56.8	-88	-20.7	0	0	0	117.6
642	V	35.4	Very low	32.1	Very low	137 Å²	137	139.6 Å²	139.6	83%	0.83	72%	0.723	S	S	*	*			trans	111.8	140.5	160.9	175.7	0	0	0	0	115.6
643	K	31.9	Very low	31.9	Very low	156 Å²	156	140 Å²	140	68%	0.678	72%	0.723	S	S	*	*			cis	-179.9	147.6	-42.8	-132.4	174.6	171.1	-173.2	0	109.8
644	F	27.5	Very low	31.6	Very low	158 Å²	158	140.8 Å²	140.8	69%	0.693	73%	0.729	S	S	*	*			trans	64.1	160.5	154.3	-67	-47.3	0	0	0	119.4
645	Q	30.1	Very low	31.2	Very low	139 Å²	139	138.8 Å²	138.8	65%	0.65	73%	0.73	S	S	*	*			cis	-150.8	167.2	-5.4	-163.1	66.4	61.1	0	0	109.8
646	D	28.3	Very low	30.8	Very low	117 Å²	117	139.7 Å²	139.7	63%	0.626	73%	0.734	S	S	*	*			trans	-64.8	158.3	173.2	-38.4	-92.5	0	0	0	116.3
647	N	29.4	Very low	30.6	Very low	149 Å²	149	136.9 Å²	136.9	80%	0.797	73%	0.734	S	S	*	*				172.3	152.8	110.9	-88.3	-40.5	0	0	0	116.1
648	S	28.5	Very low	30.4	Very low	99 Å²	99	135.5 Å²	135.5	69%	0.692	74%	0.735	S	S	*	*			trans	-17.1	156.5	159.8	60.7	0	0	0	0	120.3
649	E	33.6	Very low	30.1	Very low	173 Å²	173	135.7 Å²	135.7	81%	0.808	74%	0.736	S	S	*	*			cis	-164.1	153.1	49.5	-75.5	-172.3	125.6	0	0	115.7
650	M	27.2	Very low	29.9	Very low	149 Å²	149	140.2 Å²	140.2	73%	0.734	75%	0.75	S	S	*	*			trans	50.3	112.3	134.6	-64	-89.7	-91.2	0	0	124.1
651	N	28.9	Very low	29.6	Very low	136 Å²	136	139.1 Å²	139.1	73%	0.727	75%	0.749	S	S	*	*				47.8	113.1	123.1	-69	-28.8	0	0	0	121.9
652	K	35.2	Very low	29.7	Very low	199 Å²	199	138.4 Å²	138.4	87%	0.865	75%	0.745	S	S	*	*				-169	114.9	121.4	-103.8	154.8	-173.8	174	0	114.2
653	I	28	Very low	29.4	Very low	160 Å²	160	138 Å²	138	82%	0.821	75%	0.749	S	S	*	*			trans	12.1	117.3	136.7	-32.6	177.3	0	0	0	114.2
654	S	28.2	Very low	29.3	Very low	103 Å²	103	135.6 Å²	135.6	72%	0.72	75%	0.752	S	S	*	*				-174.3	147.6	75.8	-55	0	0	0	0	113.7
655	A	29.5	Very low	29.9	Very low	86 Å²	86	132.4 Å²	132.4	71%	0.711	75%	0.745	S	S	*	*			trans	65.6	116	141.3	0	0	0	0	0	122.8
656	I	28.9	Very low	30.3	Very low	154 Å²	154	133.2 Å²	133.2	79%	0.79	74%	0.742	S	S	*	*			trans	84.6	107.9	133.6	-61.8	166	0	0	0	119.4
657	S	27.9	Very low	30.4	Very low	103 Å²	103	134.7 Å²	134.7	72%	0.72	75%	0.747	S	S	*	*			trans	51.2	144.3	146.5	70.8	0	0	0	0	121.2
658	S	28.5	Very low	30.8	Very low	93 Å²	93	131.7 Å²	131.7	65%	0.65	74%	0.738	S	S	*	*			cis	-177.2	143.2	-9.1	45.4	0	0	0	0	109.7
659	L	28.6	Very low	31.2	Very low	141 Å²	141	133.7 Å²	133.7	74%	0.738	74%	0.736	S	S	*	*			trans	51.9	109.4	161.4	-78.6	78.7	0	0	0	118.7	I581	I581-L659 HydrophobicContact CD1-CD2 4.39Å; I581-L659 HydrophobicContact CG1-CD2 4.39Å
660	E	27.6	Very low	31.4	Very low	188 Å²	188	130.3 Å²	130.3	88%	0.879	72%	0.723	S	S	*	*			trans	-156.3	165.1	142.3	-121.1	173.4	-143.2	0	0	110.7
661	T	29.2	Very low	32	Very low	124 Å²	124	126.8 Å²	126.8	76%	0.761	71%	0.713	S	S	*	*			trans	88.2	108.1	-178.6	70.9	0	0	0	0	118.7
662	N	31.2	Very low	32.5	Very low	143 Å²	143	125.8 Å²	125.8	77%	0.765	71%	0.707	S	S	*	*				173.2	89.5	121.7	-86.8	-31.7	0	0	0	110.6
663	S	29.3	Very low	32.5	Very low	128 Å²	128	122.1 Å²	122.1	90%	0.895	69%	0.693	S	S	*	*			trans	-118.4	15.4	-174.8	-171.4	0	0	0	0	114
664	S	30.9	Very low	33	Very low	106 Å²	106	120.3 Å²	120.3	74%	0.741	68%	0.683	S	S	*	*	S	Bend	trans	-127	6.4	-164.4	54.4	0	0	0	0	116.6
665	V	39.4	Very low	33.5	Very low	90 Å²	90	119.2 Å²	119.2	55%	0.545	67%	0.666	S	S	.	*	S	Bend	trans	-106	-24.4	-176.4	-176.5	0	0	0	0	113.1	M667	V665-M667 PolarHBondContact O-N 3.13Å
666	W	37.4	Very low	34	Very low	157 Å²	157	118.2 Å²	118.2	60%	0.595	65%	0.654	S	S	*	*	H	α-helix	trans	-78.6	-12.8	-165	-75.3	34.1	0	0	0	115.6	T579	T579-W666 VanDerWaalsContact OG1-CH2 3.32Å; T579-W666 WeakPolarHBondContact OG1-CH2 3.39Å
667	M	31.8	Very low	34.3	Very low	148 Å²	148	114.7 Å²	114.7	73%	0.729	64%	0.637	S	S	*	*	H	α-helix	trans	-74.9	-21.7	-178.8	-71.9	-75.9	-89.4	0	0	113.4	V665	V665-M667 PolarHBondContact O-N 3.13Å
668	S	36.8	Very low	34.9	Very low	86 Å²	86	115.1 Å²	115.1	60%	0.601	63%	0.627	S	S	*	*	H	α-helix	trans	-81.1	-45.1	-178.8	-59.6	0	0	0	0	112.9	L670 S671 D672	S668-L670 VanDerWaalsContact C-N 3.35Å; S668-L670 PolarHBondContact O-N 3.48Å; S668-S671 WeakPolarHBondContact O-CB 3.48Å; S668-S671 PolarHBondContact O-N 2.97Å; S668-D672 PolarHBondContact O-N 3.43Å
669	E	37	Very low	35.4	Very low	140 Å²	140	118.7 Å²	118.7	65%	0.654	63%	0.627	S	S	*	*	H	α-helix	trans	-75.1	-22.8	-175.9	-70.6	174	126.5	0	0	113.3	H673	E669-H673 PolarHBondContact O-N 2.83Å
670	L	37.7	Very low	35.8	Very low	103 Å²	103	118.8 Å²	118.8	54%	0.539	63%	0.625	S	S	.	*	H	α-helix	trans	-70.8	-31.6	170.3	-84.7	164.7	0	0	0	112.7	S668 H673 M674	S668-L670 VanDerWaalsContact C-N 3.35Å; S668-L670 PolarHBondContact O-N 3.48Å; L670-H673 PolarHBondContact O-N 3.36Å; L670-M674 WeakPolarHBondContact O-CG 3.25Å; L670-M674 PolarHBondContact O-N 3.37Å; L670-M674 VanDerWaalsContact O-N 3.13Å
671	S	40.1	Very low	36.2	Very low	74 Å²	74	118.3 Å²	118.3	52%	0.517	62%	0.62	S	S	.	*	H	α-helix	trans	-66.8	-47.8	177.4	-162	0	0	0	0	111.2	S668 H673 M674 E675	S668-S671 WeakPolarHBondContact O-CB 3.48Å; S668-S671 PolarHBondContact O-N 2.97Å; S671-H673 VanDerWaalsContact C-N 3.28Å; S671-H673 PolarHBondContact O-N 2.04Å; S671-M674 PolarHBondContact O-N 3.44Å; S671-E675 PolarHBondContact O-N 2.99Å; S671-E675 VanDerWaalsContact O-N 3.08Å
672	D	39	Very low	36.6	Very low	115 Å²	115	117.5 Å²	117.5	62%	0.615	61%	0.611	S	S	*	*	H	α-helix	trans	-63.9	-32.6	178.2	-72.5	-19.5	0	0	0	112.6	S668 S676	S668-D672 PolarHBondContact O-N 3.43Å; D672-S676 WeakPolarHBondContact O-CB 3.47Å; D672-S676 PolarHBondContact O-N 3.47Å
673	H	36.8	Very low	36.8	Very low	123 Å²	123	114.2 Å²	114.2	57%	0.569	60%	0.604	S	S	*	*	H	α-helix	trans	-78.2	-32.2	-179.6	-159.2	42.8	0	0	0	113.3	E669 L670 S671 N677	E669-H673 PolarHBondContact O-N 2.83Å; L670-H673 PolarHBondContact O-N 3.36Å; S671-H673 VanDerWaalsContact C-N 3.28Å; S671-H673 PolarHBondContact O-N 2.04Å; H673-N677 PolarHBondContact O-N 2.74Å; H673-N677 PolarHBondContact O-ND2 3.35Å
674	M	37.7	Very low	37.1	Very low	122 Å²	122	115.5 Å²	115.5	60%	0.601	60%	0.601	S	S	*	*	H	α-helix	trans	-70.4	-36.9	169.8	-66.5	-166	89.3	0	0	111.6	L670 S671 N677 Q678	L670-M674 WeakPolarHBondContact O-CG 3.25Å; L670-M674 PolarHBondContact O-N 3.37Å; L670-M674 VanDerWaalsContact O-N 3.13Å; S671-M674 PolarHBondContact O-N 3.44Å; M674-N677 PolarHBondContact O-N 3.47Å; M674-Q678 PolarHBondContact O-N 2.77Å; M674-Q678 VanDerWaalsContact O-N 3.11Å
675	E	39.2	Very low	37.2	Very low	79 Å²	79	120.8 Å²	120.8	37%	0.369	61%	0.605	S	S	.	*	H	α-helix	trans	-70	-34.6	178.7	-153.7	-178.7	135.5	0	0	112.8	S671 N677 Q678 R679	S671-E675 PolarHBondContact O-N 2.99Å; S671-E675 VanDerWaalsContact O-N 3.08Å; E675-N677 PolarHBondContact O-N 2.92Å; E675-Q678 PolarHBondContact O-N 3.47Å; E675-R679 VanDerWaalsContact O-CG 3.28Å; E675-R679 WeakPolarHBondContact O-CG 3.22Å; E675-R679 PolarHBondContact O-N 2.98Å; E675-R679 IonicContact OE1-CZ 3.95Å; E675-R679 IonicContact OE1-NE 3.39Å; E675-R679 PolarHBondContact OE1-NE 3.43Å; E675-R679 IonicContact OE1-NH2 3.12Å; E675-R679 PolarHBondContact OE1-NH2 2.76Å
676	S	39	Very low	36.9	Very low	65 Å²	65	122.6 Å²	122.6	46%	0.455	61%	0.611	S	S	.	*	H	α-helix	trans	-63.4	-39.4	173.1	-167.6	0	0	0	0	112.7	D672 R679 M680	D672-S676 WeakPolarHBondContact O-CB 3.47Å; D672-S676 PolarHBondContact O-N 3.47Å; S676-R679 PolarHBondContact O-N 3.1Å; S676-M680 PolarHBondContact O-N 3.16Å
677	N	36.3	Very low	36.8	Very low	80 Å²	80	126.1 Å²	126.1	43%	0.428	63%	0.626	S	S	.	*	H	α-helix	trans	-70.1	-34.4	176.3	-77.7	-64.2	0	0	0	112.7	H673 M674 E675 R679 M680 F681	H673-N677 PolarHBondContact O-N 2.74Å; H673-N677 PolarHBondContact O-ND2 3.35Å; M674-N677 PolarHBondContact O-N 3.47Å; E675-N677 PolarHBondContact O-N 2.92Å; N677-R679 VanDerWaalsContact C-N 3.33Å; N677-M680 PolarHBondContact O-N 3.47Å; N677-F681 PolarHBondContact O-N 3.05Å
678	Q	39.8	Very low	37.1	Very low	112 Å²	112	125.6 Å²	125.6	52%	0.523	63%	0.626	S	S	.	*	H	α-helix	trans	-66.1	-34.1	169.8	-71.9	179.4	-4.8	0	0	112.4	M674 E675 N682	M674-Q678 PolarHBondContact O-N 2.77Å; M674-Q678 VanDerWaalsContact O-N 3.11Å; E675-Q678 PolarHBondContact O-N 3.47Å; Q678-N682 WeakPolarHBondContact O-CB 3.47Å; Q678-N682 PolarHBondContact O-N 2.84Å; Q678-N682 PolarHBondContact O-ND2 3.24Å
679	R	38.4	Very low	37.2	Very low	169 Å²	169	126.3 Å²	126.3	64%	0.638	63%	0.629	S	S	*	*	H	α-helix	trans	-69.9	-34.8	175.1	-70.6	166.4	-177.5	-132.5	5.6	112.6	E675 S676 N677 A683	E675-R679 VanDerWaalsContact O-CG 3.28Å; E675-R679 WeakPolarHBondContact O-CG 3.22Å; E675-R679 PolarHBondContact O-N 2.98Å; E675-R679 IonicContact OE1-CZ 3.95Å; E675-R679 IonicContact OE1-NE 3.39Å; E675-R679 PolarHBondContact OE1-NE 3.43Å; E675-R679 IonicContact OE1-NH2 3.12Å; E675-R679 PolarHBondContact OE1-NH2 2.76Å; S676-R679 PolarHBondContact O-N 3.1Å; N677-R679 VanDerWaalsContact C-N 3.33Å; R679-A683 PolarHBondContact O-N 2.89Å
680	M	38.1	Very low	37.4	Very low	143 Å²	143	127.5 Å²	127.5	70%	0.704	64%	0.639	S	S	*	*	H	α-helix	trans	-67.9	-40.2	172	-96.4	-172.9	64.8	0	0	113.4	S676 N677 N682 A683	S676-M680 PolarHBondContact O-N 3.16Å; N677-M680 PolarHBondContact O-N 3.47Å; M680-N682 VanDerWaalsContact C-N 3.3Å; M680-N682 PolarHBondContact O-N 3.42Å; M680-A683 PolarHBondContact O-N 3.34Å
681	F	35.7	Very low	37.3	Very low	177 Å²	177	127.9 Å²	127.9	78%	0.776	65%	0.648	S	S	*	*	H	α-helix	trans	-73.1	-19.5	178.6	-94.1	-87.1	0	0	0	114.3	N677	N677-F681 PolarHBondContact O-N 3.05Å
682	N	36.6	Very low	36.7	Very low	107 Å²	107	130.4 Å²	130.4	57%	0.572	66%	0.664	S	S	*	*	H	α-helix	trans	-91.9	-9.6	176.4	-75.5	-30.2	0	0	0	114.4	Q678 M680 N684	Q678-N682 WeakPolarHBondContact O-CB 3.47Å; Q678-N682 PolarHBondContact O-N 2.84Å; Q678-N682 PolarHBondContact O-ND2 3.24Å; M680-N682 VanDerWaalsContact C-N 3.3Å; M680-N682 PolarHBondContact O-N 3.42Å; N682-N684 VanDerWaalsContact C-N 3.31Å; N682-N684 PolarHBondContact O-N 3.43Å
683	A	36.3	Very low	36.4	Very low	75 Å²	75	130.3 Å²	130.3	62%	0.62	67%	0.667	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.2	-11.5	-176.6	0	0	0	0	0	115.2	R679 M680	R679-A683 PolarHBondContact O-N 2.89Å; M680-A683 PolarHBondContact O-N 3.34Å
684	N	35.9	Very low	36.1	Very low	155 Å²	155	130.4 Å²	130.4	83%	0.829	68%	0.677	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102	31	-177.1	-85.6	-17.8	0	0	0	114	N682	N682-N684 VanDerWaalsContact C-N 3.31Å; N682-N684 PolarHBondContact O-N 3.43Å
685	R	33.4	Very low	36	Very low	216 Å²	216	132.1 Å²	132.1	82%	0.815	69%	0.687	S	S	*	*	S	Bend	trans	-125.1	-2.7	178.1	-72.6	-159.6	-173	-153	7.8	116.9
686	N	31.7	Very low	35.6	Very low	129 Å²	129	135.4 Å²	135.4	69%	0.69	71%	0.707	S	S	*	*			trans	-111.3	84.7	179.7	-70.7	11.4	0	0	0	111.5
687	Y	35.8	Very low	35.1	Very low	231 Å²	231	139.5 Å²	139.5	91%	0.906	72%	0.724	S	S	*	*			trans	-104.3	90.6	151.7	-87.9	-81.7	0	0	0	107.3
688	D	37.9	Very low	35.3	Very low	136 Å²	136	140.6 Å²	140.6	73%	0.727	74%	0.738	S	S	*	*	P	Polyproline II helix	trans	-68.7	131.8	173.6	-69.2	-51.6	0	0	0	110
689	P	39.2	Very low	35.2	Very low	102 Å²	102	142.5 Å²	142.5	66%	0.662	75%	0.75	S	S	*	*	P	Polyproline II helix	trans	-74.5	130.7	173.3	30	-32.2	0	0	0	110.5
690	L	41.1	Very low	34.9	Very low	165 Å²	165	141.2 Å²	141.2	86%	0.864	76%	0.756	S	S	*	*	P	Polyproline II helix	trans	-62.5	142.4	175	-81.4	153.1	0	0	0	111.4
691	P	35.9	Very low	34.7	Very low	111 Å²	111	141.6 Å²	141.6	72%	0.721	76%	0.761	S	S	*	*	P	Polyproline II helix	trans	-79.8	125.8	-175.5	31.4	-33.8	0	0	0	111.8
692	C	27.9	Very low	34.8	Very low	126 Å²	126	141.3 Å²	141.3	85%	0.851	77%	0.766	S	S	*	*			trans	-97.7	101.5	167	52	0	0	0	0	110.2
693	T	31	Very low	34.7	Very low	113 Å²	113	144.4 Å²	144.4	69%	0.693	78%	0.777	S	S	*	*			trans	-134.6	136.6	172.5	50.4	0	0	0	0	111.5
694	T	31.8	Very low	34.5	Very low	125 Å²	125	150.3 Å²	150.3	77%	0.767	78%	0.783	S	S	*	*			trans	55.6	102.5	160.2	50.3	0	0	0	0	118.1
695	I	34.3	Very low	34.6	Very low	158 Å²	158	147.9 Å²	147.9	81%	0.81	77%	0.77	S	S	*	*				-147.7	99.9	107.1	-81.4	132.7	0	0	0	106.6
696	N	30.9	Very low	34.6	Very low	149 Å²	149	145.2 Å²	145.2	80%	0.797	77%	0.767	S	S	*	*			trans	-82.4	168.2	141.7	-88.7	-12.1	0	0	0	106.7
697	D	30	Very low	34.7	Very low	150 Å²	150	144.2 Å²	144.2	80%	0.802	77%	0.766	S	S	*	*			trans	80.4	70.2	177	-49.4	-24.9	0	0	0	115.7
698	S	40.4	Very low	34.7	Very low	104 Å²	104	139.1 Å²	139.1	73%	0.727	76%	0.759	S	S	*	*			trans	-149.9	81.3	140.7	-81.6	0	0	0	0	111.3
699	I	36.4	Very low	34.7	Very low	152 Å²	152	140 Å²	140	78%	0.779	76%	0.763	S	S	*	*				68	109.9	123.8	-64.5	158.5	0	0	0	117.5
700	N	32.4	Very low	34.4	Very low	141 Å²	141	140.5 Å²	140.5	75%	0.754	76%	0.76	S	S	*	*			trans	-30.6	133.5	154.1	-51.1	-62.1	0	0	0	113.9
701	N	34.8	Very low	34.2	Very low	151 Å²	151	143.9 Å²	143.9	81%	0.807	76%	0.763	S	S	*	*				169	166.8	120.1	-85	-39.6	0	0	0	111.5
702	L	37.6	Very low	34.2	Very low	172 Å²	172	144 Å²	144	90%	0.901	76%	0.757	S	S	*	*			trans	82.2	64.6	173.2	-58.3	165.5	0	0	0	116.4
703	H	33.6	Very low	34.7	Very low	171 Å²	171	144.8 Å²	144.8	79%	0.792	75%	0.753	S	S	*	*			trans	-47.1	169.5	140.1	-162.8	64.8	0	0	0	113.5
704	R	32.8	Very low	34.8	Very low	199 Å²	199	147.2 Å²	147.2	75%	0.751	76%	0.756	S	S	*	*			trans	82.2	139.4	170.4	-68.2	-166.1	169.2	-131.7	-0.9	117.4
705	D	37.1	Very low	35.2	Very low	104 Å²	104	152.2 Å²	152.2	56%	0.556	76%	0.761	S	S	*	*			cis	-144.3	147.6	5.3	-90.9	-35.2	0	0	0	111.5
706	E	34.5	Very low	35.3	Very low	161 Å²	161	150.1 Å²	150.1	75%	0.752	76%	0.761	S	S	*	*				35.1	151.6	126.5	-58.2	-169.3	167.7	0	0	122
707	T	34.2	Very low	35.9	Very low	107 Å²	107	151.4 Å²	151.4	66%	0.656	77%	0.766	S	S	*	*			cis	-168.3	159	3.4	14.8	0	0	0	0	112.3
708	T	35.4	Very low	36.2	Very low	124 Å²	124	149.9 Å²	149.9	76%	0.761	76%	0.758	S	S	*	*			trans	65.4	150.5	153.2	61.4	0	0	0	0	119.5
709	L	36.8	Very low	36.1	Very low	155 Å²	155	151.4 Å²	151.4	81%	0.812	77%	0.767	S	S	*	*			cis	-135.9	126.8	7.3	-62.6	161	0	0	0	107.3
710	N	34.5	Very low	36.3	Very low	112 Å²	112	149.7 Å²	149.7	60%	0.599	76%	0.764	S	S	*	*				50	110.5	74.4	-162.3	15.1	0	0	0	117.6	N712	N710-N712 PolarHBondContact OD1-ND2 3.24Å; N710-N712 PolarHBondContact OD1-OD1 3.43Å
711	Y	36.2	Very low	36.8	Very low	236 Å²	236	152.3 Å²	152.3	93%	0.925	77%	0.771	S	S	*	*			trans	-150.3	126.8	137.3	-120.9	-82	0	0	0	110.3
712	N	35.8	Very low	36.6	Very low	114 Å²	114	149.6 Å²	149.6	61%	0.61	76%	0.763	S	S	*	*			trans	-98.2	167.2	-169.4	-68.1	-40.4	0	0	0	113.9	N710	N710-N712 PolarHBondContact OD1-ND2 3.24Å; N710-N712 PolarHBondContact OD1-OD1 3.43Å
713	N	38.1	Very low	36.6	Very low	143 Å²	143	148.5 Å²	148.5	77%	0.765	76%	0.758	S	S	*	*			trans	133.3	140	137.4	-67.5	-11.3	0	0	0	113.1
714	E	34.2	Very low	36.5	Very low	163 Å²	163	146.9 Å²	146.9	76%	0.762	76%	0.755	S	S	*	*			cis	-172	169.9	-31.2	-131.9	-175.9	-160.6	0	0	108.2
715	R	39	Very low	37	Very low	230 Å²	230	146.1 Å²	146.1	87%	0.868	76%	0.76	S	S	*	*			trans	74.4	100.3	-179.6	-45.3	177.5	-159.3	-167.6	5.5	113.8
716	S	37.5	Very low	37.2	Very low	114 Å²	114	145 Å²	145	80%	0.797	76%	0.76	S	S	*	*			cis	65.3	108.9	43.4	-166.3	0	0	0	0	114.7
717	I	42.3	Very low	37.4	Very low	176 Å²	176	146.4 Å²	146.4	90%	0.903	76%	0.764	S	S	*	*			trans	-146.9	146.4	134.4	-94.5	154.2	0	0	0	106.8
718	D	36.7	Very low	37.5	Very low	118 Å²	118	151.1 Å²	151.1	63%	0.631	77%	0.771	S	S	*	*			trans	-83.1	155.1	-158.1	-145.2	-33	0	0	0	115.1	T720	D718-T720 WeakPolarHBondContact OD1-CB 3.31Å; D718-T720 PolarHBondContact OD1-N 3.05Å; D718-T720 PolarHBondContact OD1-OG1 3.28Å
719	C	38.8	Very low	37.6	Very low	137 Å²	137	151.8 Å²	151.8	93%	0.926	77%	0.77	S	S	*	*			trans	-161.1	51.6	154.3	-107.4	0	0	0	0	109.8	E721	C719-E721 PolarHBondContact O-N 3.01Å
720	T	41.1	Very low	37.9	Very low	116 Å²	116	151.2 Å²	151.2	71%	0.712	77%	0.767	S	S	*	*			trans	-91.1	95.8	178.3	-38.2	0	0	0	0	110.9	D718	D718-T720 WeakPolarHBondContact OD1-CB 3.31Å; D718-T720 PolarHBondContact OD1-N 3.05Å; D718-T720 PolarHBondContact OD1-OG1 3.28Å
721	E	42.9	Very low	38.2	Very low	196 Å²	196	152.7 Å²	152.7	92%	0.916	77%	0.773	S	S	*	*			trans	-130.3	103.6	153.4	-164.3	161	-147.2	0	0	110.3	C719	C719-E721 PolarHBondContact O-N 3.01Å
722	C	30.7	Very low	38.3	Very low	94 Å²	94	148.2 Å²	148.2	64%	0.635	77%	0.765	S	S	*	*			trans	-91.1	143.5	178.3	53	0	0	0	0	110.7
723	N	36.5	Very low	38.2	Very low	149 Å²	149	148.3 Å²	148.3	80%	0.797	77%	0.765	S	S	*	*				-154.2	153.1	123.9	-123.8	-36.9	0	0	0	114.8
724	N	32.5	Very low	38.1	Very low	137 Å²	137	149.7 Å²	149.7	73%	0.733	77%	0.773	S	S	*	*			trans	-90.3	125.1	-172.1	-65.8	-81.1	0	0	0	111.9
725	Q	41.7	Very low	38.4	Very low	183 Å²	183	145.7 Å²	145.7	86%	0.855	76%	0.763	S	S	*	*			trans	-141.7	141.8	153.2	-110.7	94.6	41.7	0	0	112.1
726	S	41.1	Very low	38.7	Very low	79 Å²	79	142.2 Å²	142.2	55%	0.552	76%	0.761	S	S	*	*			trans	44.2	71.2	173.7	68.9	0	0	0	0	120.7	Y728 D729	S726-Y728 PolarHBondContact O-N 3.48Å; S726-Y728 VanDerWaalsContact O-N 3.08Å; S726-D729 WeakPolarHBondContact CB-OD2 3.26Å; S726-D729 PolarHBondContact OG-OD2 2.91Å
727	K	39.2	Very low	39	Very low	191 Å²	191	142 Å²	142	83%	0.83	76%	0.759	S	S	*	*	S	Bend	trans	-73.8	29.3	146.3	-159.6	-177.9	174.3	178.4	0	112.4
728	Y	35.7	Very low	39.3	Very low	207 Å²	207	136.5 Å²	136.5	81%	0.812	75%	0.746	S	S	*	*			trans	-149.7	50.7	-171.8	-68	-70.9	0	0	0	112.8	S726	S726-Y728 PolarHBondContact O-N 3.48Å; S726-Y728 VanDerWaalsContact O-N 3.08Å
729	D	38.3	Very low	41.2	Very low	137 Å²	137	141.2 Å²	141.2	73%	0.733	76%	0.755	S	S	*	*			trans	-118.6	23.5	159.7	-75.5	-60.2	0	0	0	111.3	S726	S726-D729 WeakPolarHBondContact CB-OD2 3.26Å; S726-D729 PolarHBondContact OG-OD2 2.91Å
730	I	43.2	Very low	43	Very low	144 Å²	144	138.3 Å²	138.3	74%	0.738	73%	0.733	S	S	*	*			trans	-89.4	138.4	165.3	-54.8	173.5	0	0	0	106.1
731	I	40.8	Very low	45.4	Very low	142 Å²	142	139.7 Å²	139.7	73%	0.728	74%	0.736	S	S	*	*			trans	86.7	72.6	-168.7	-45.5	156.7	0	0	0	112.9
732	N	38.4	Very low	47.9	Very low	142 Å²	142	132.8 Å²	132.8	76%	0.759	70%	0.703	S	S	*	*			trans	-134.4	98.7	144.5	-145.1	-11.8	0	0	0	108.7	N734 S735	N732-N734 PolarHBondContact O-N 2.75Å; N732-S735 PolarHBondContact O-OG 2.93Å
733	N	33.3	Very low	51	Low	116 Å²	116	132 Å²	132	62%	0.62	70%	0.695	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.6	81.7	-161.9	-74.5	-39.7	0	0	0	112.8
734	N	37.3	Very low	53.9	Low	172 Å²	172	130.5 Å²	130.5	92%	0.92	69%	0.692	S	S	*	*	T	Hydrogen-bonded Turn	trans	-162.3	8.4	151.8	-101.3	-29.9	0	0	0	113.4	N732	N732-N734 PolarHBondContact O-N 2.75Å
735	S	39.1	Very low	56.9	Low	79 Å²	79	131 Å²	131	55%	0.552	68%	0.683	S	S	*	*			trans	-111.7	12.2	-167.4	56.7	0	0	0	0	115.3	N732 S737 G738	N732-S735 PolarHBondContact O-OG 2.93Å; S735-S737 CarbonylContact O-C 3.57Å; S735-S737 PolarHBondContact O-N 2.94Å; S735-G738 PolarHBondContact O-N 2.75Å
736	L	46	Very low	59.6	Low	157 Å²	157	123.5 Å²	123.5	82%	0.822	65%	0.648	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.7	-4.6	-179.4	-77.6	158.4	0	0	0	114.8
737	S	43.3	Very low	62.2	Low	109 Å²	109	123.2 Å²	123.2	76%	0.762	64%	0.64	S	S	*	*	T	Hydrogen-bonded Turn	trans	-133.7	72	160.7	-173.6	0	0	0	0	108.9	S735 R739	S735-S737 CarbonylContact O-C 3.57Å; S735-S737 PolarHBondContact O-N 2.94Å; S737-R739 PolarHBondContact O-N 2.9Å
738	G	49.7	Very low	65	Low	61 Å²	61	117.8 Å²	117.8	63%	0.629	62%	0.623	S	S	*	*			trans	-65.8	72.4	-176.3	0	0	0	0	0	113.4	S735 T740	S735-G738 PolarHBondContact O-N 2.75Å; G738-T740 PolarHBondContact O-N 3.34Å
739	R	74.7	Confident	67.9	Low	217 Å²	217	110.8 Å²	110.8	82%	0.819	60%	0.598	S	S	*	*			trans	-65.9	100.6	176.2	-172.9	-177.6	-173	-164.4	1.6	109.4	S737 N741	S737-R739 PolarHBondContact O-N 2.9Å; R739-N741 PolarHBondContact O-N 3.16Å; R739-N741 VanDerWaalsContact O-N 3.15Å
740	T	78.4	Confident	70.8	Confident	76 Å²	76	104.2 Å²	104.2	47%	0.466	56%	0.563	S	S	.	*	P	Polyproline II helix	trans	-59.9	116.8	176.2	57.8	0	0	0	0	110.2	G738 Q778	G738-T740 PolarHBondContact O-N 3.34Å; T740-Q778 PolarHBondContact OG1-NE2 3.3Å
741	N	90.3	Very high	73.4	Confident	145 Å²	145	99.9 Å²	99.9	78%	0.775	54%	0.54	S	S	*	.	P	Polyproline II helix	trans	-78.7	129.2	171.1	-69	-40.4	0	0	0	109	R739	R739-N741 PolarHBondContact O-N 3.16Å; R739-N741 VanDerWaalsContact O-N 3.15Å
742	F	95.6	Very high	76.1	Confident	52 Å²	52	98.6 Å²	98.6	23%	0.228	53%	0.528	C	S	.	.	P	Polyproline II helix	trans	-78.6	140.5	174.1	-59	-66.9	0	0	0	110.1	Q746 L747 L774 Q778 W782	F742-Q746 HydrophobicContact CB-CB 4.19Å; F742-L747 HydrophobicContact CB-CD2 3.77Å; F742-L747 HydrophobicContact CB-CG 3.82Å; F742-L747 HydrophobicContact CD2-CD2 4.17Å; F742-L747 HydrophobicContact CG-CD2 4.32Å; F742-L774 HydrophobicContact CD1-CD1 3.8Å; F742-L774 HydrophobicContact CD1-CD2 3.82Å; F742-L774 HydrophobicContact CD1-CG 4.48Å; F742-L774 HydrophobicContact CE1-CD1 3.71Å; F742-L774 HydrophobicContact CE1-CD2 3.75Å; F742-L774 HydrophobicContact CE1-CG 4.37Å; F742-Q778 HydrophobicContact CE1-CB 4.17Å; F742-Q778 HydrophobicContact CZ-CB 4.22Å; F742-W782 AromaticContact CD2-CD1 3.83Å; F742-W782 HydrophobicContact CE2-CB 4.48Å; F742-W782 AromaticContact CE2-CD1 3.63Å; F742-W782 HydrophobicContact CE2-CG 4.44Å; F742-W782 HydrophobicContact CZ-CB 4.49Å
743	T	96.3	Very high	78.9	Confident	77 Å²	77	92.6 Å²	92.6	47%	0.472	50%	0.496	S	S	.	.	P	Polyproline II helix	trans	-68.8	160.3	173.7	69.6	0	0	0	0	111	R745 Q746 L747	T743-R745 VanDerWaalsContact C-N 3.26Å; T743-R745 PolarHBondContact O-N 3.48Å; T743-Q746 WeakPolarHBondContact O-CB 3.32Å; T743-Q746 PolarHBondContact O-N 2.85Å; T743-Q746 VanDerWaalsContact O-N 3.08Å; T743-Q746 WeakPolarHBondContact OG1-CG 3.02Å; T743-Q746 PolarHBondContact OG1-N 2.92Å; T743-L747 WeakPolarHBondContact O-CG 3.47Å; T743-L747 PolarHBondContact O-N 3.1Å
744	T	96.2	Very high	81.9	Confident	117 Å²	117	87.2 Å²	87.2	72%	0.718	47%	0.467	S	S	*	.	H	α-helix	trans	-55.3	-41.7	176.7	-47.5	0	0	0	0	111.9	L747 T748	T744-L747 PolarHBondContact O-N 2.63Å; T744-T748 WeakPolarHBondContact O-CG2 3.18Å; T744-T748 PolarHBondContact O-N 3.42Å; T744-T748 PolarHBondContact O-OG1 2.87Å
745	R	96.3	Very high	84.7	Confident	148 Å²	148	85.6 Å²	85.6	56%	0.558	45%	0.454	S	S	*	.	H	α-helix	trans	-60.9	-44	175.1	-179.2	-175.6	176.9	-92.5	-3.7	112.4	T743 L747 T748 E749 D771	T743-R745 VanDerWaalsContact C-N 3.26Å; T743-R745 PolarHBondContact O-N 3.48Å; R745-L747 VanDerWaalsContact C-N 3.33Å; R745-T748 WeakPolarHBondContact CA-OG1 3.28Å; R745-T748 PolarHBondContact O-N 3.44Å; R745-T748 PolarHBondContact O-OG1 3.13Å; R745-E749 PolarHBondContact O-N 2.97Å; R745-D771 PolarHBondContact NH1-O 2.82Å
746	Q	97.5	Very high	87.4	Confident	26 Å²	26	86.2 Å²	86.2	12%	0.121	45%	0.447	C	S	.	.	H	α-helix	trans	-63.1	-42.7	177	-72.6	169.9	-25.6	0	0	110.7	F742 T743 L750 L772 L774	F742-Q746 HydrophobicContact CB-CB 4.19Å; T743-Q746 WeakPolarHBondContact O-CB 3.32Å; T743-Q746 PolarHBondContact O-N 2.85Å; T743-Q746 VanDerWaalsContact O-N 3.08Å; T743-Q746 WeakPolarHBondContact OG1-CG 3.02Å; T743-Q746 PolarHBondContact OG1-N 2.92Å; Q746-L750 VanDerWaalsContact O-CB 3.29Å; Q746-L750 WeakPolarHBondContact O-CB 3.43Å; Q746-L750 WeakPolarHBondContact O-CD1 3.21Å; Q746-L750 WeakPolarHBondContact O-CG 3.26Å; Q746-L750 PolarHBondContact O-N 3.23Å; Q746-L772 HydrophobicContact CG-CB 4.27Å; Q746-L772 PolarHBondContact NE2-O 3.06Å; Q746-L774 HydrophobicContact CG-CD1 4.49Å
747	L	97.2	Very high	89.7	Confident	73 Å²	73	80.8 Å²	80.8	38%	0.382	42%	0.418	S	S	.	.	H	α-helix	trans	-65.1	-40.5	177.7	-69.1	173.6	0	0	0	112.8	F742 T743 T744 R745 E751	F742-L747 HydrophobicContact CB-CD2 3.77Å; F742-L747 HydrophobicContact CB-CG 3.82Å; F742-L747 HydrophobicContact CD2-CD2 4.17Å; F742-L747 HydrophobicContact CG-CD2 4.32Å; T743-L747 WeakPolarHBondContact O-CG 3.47Å; T743-L747 PolarHBondContact O-N 3.1Å; T744-L747 PolarHBondContact O-N 2.63Å; R745-L747 VanDerWaalsContact C-N 3.33Å; L747-E751 VanDerWaalsContact O-CB 3.27Å; L747-E751 WeakPolarHBondContact O-CB 3.21Å; L747-E751 PolarHBondContact O-N 3.37Å
748	T	97	Very high	92.2	Very high	77 Å²	77	80.2 Å²	80.2	47%	0.472	40%	0.4	S	S	.	.	H	α-helix	trans	-66.2	-43.1	179.4	49.3	0	0	0	0	112.3	T744 R745 E751 K752	T744-T748 WeakPolarHBondContact O-CG2 3.18Å; T744-T748 PolarHBondContact O-N 3.42Å; T744-T748 PolarHBondContact O-OG1 2.87Å; R745-T748 WeakPolarHBondContact CA-OG1 3.28Å; R745-T748 PolarHBondContact O-N 3.44Å; R745-T748 PolarHBondContact O-OG1 3.13Å; T748-E751 PolarHBondContact O-N 2.97Å; T748-K752 VanDerWaalsContact O-CB 3.28Å; T748-K752 WeakPolarHBondContact O-CB 3.12Å; T748-K752 PolarHBondContact O-N 3.04Å
749	E	97.6	Very high	94.5	Very high	59 Å²	59	83 Å²	83	28%	0.276	39%	0.392	S	S	.	.	H	α-helix	trans	-71.5	-40.1	178	-67.4	-59	126.7	0	0	111.9	R745 E751 K752 E753 L772	R745-E749 PolarHBondContact O-N 2.97Å; E749-E751 VanDerWaalsContact C-N 3.32Å; E749-E751 PolarHBondContact O-N 3.33Å; E749-K752 PolarHBondContact O-N 3.18Å; E749-K752 IonicContact OE1-NZ 3.86Å; E749-K752 PolarHBondContact OE1-NZ 3.09Å; E749-K752 IonicContact OE2-NZ 3.79Å; E749-K752 PolarHBondContact OE2-NZ 2.65Å; E749-E753 WeakPolarHBondContact O-CG 3.4Å; E749-E753 PolarHBondContact O-N 2.78Å; E749-L772 HydrophobicContact CB-CD1 4.11Å; E749-L772 HydrophobicContact CB-CD2 3.63Å; E749-L772 HydrophobicContact CB-CG 4.47Å; E749-L772 HydrophobicContact CG-CD2 3.99Å
750	L	98.2	Very high	95.5	Very high	0 Å²	0	73.7 Å²	73.7	0%	0	36%	0.358	C	S	.	.	H	α-helix	trans	-60.3	-40.2	172.9	-73.6	167.4	0	0	0	112.3	Q746 F754 I768 L772 L774 V779 W782 F783	Q746-L750 VanDerWaalsContact O-CB 3.29Å; Q746-L750 WeakPolarHBondContact O-CB 3.43Å; Q746-L750 WeakPolarHBondContact O-CD1 3.21Å; Q746-L750 WeakPolarHBondContact O-CG 3.26Å; Q746-L750 PolarHBondContact O-N 3.23Å; L750-F754 WeakPolarHBondContact O-CB 3.36Å; L750-F754 PolarHBondContact O-N 2.85Å; L750-I768 HydrophobicContact CD2-CG2 3.88Å; L750-L772 HydrophobicContact CD1-CD1 4.46Å; L750-L772 HydrophobicContact CD2-CD1 3.91Å; L750-L772 HydrophobicContact CG-CD1 3.68Å; L750-L774 HydrophobicContact CD1-CD1 4Å; L750-V779 HydrophobicContact CD2-CG1 4.17Å; L750-V779 HydrophobicContact CD2-CG2 4.47Å; L750-W782 HydrophobicContact CB-CD2 3.88Å; L750-W782 HydrophobicContact CB-CE3 3.9Å; L750-W782 HydrophobicContact CB-CH2 3.75Å; L750-W782 HydrophobicContact CB-CZ2 3.66Å; L750-W782 HydrophobicContact CB-CZ3 3.85Å; L750-W782 HydrophobicContact CD1-CD2 3.93Å; L750-W782 HydrophobicContact CD1-CG 3.85Å; L750-W782 HydrophobicContact CD2-CD2 4.35Å; L750-W782 HydrophobicContact CD2-CE3 4.2Å; L750-W782 HydrophobicContact CG-CD2 4.27Å; L750-W782 HydrophobicContact CG-CE3 4.44Å; L750-W782 VanDerWaalsContact O-CH2 3.26Å; L750-W782 WeakPolarHBondContact O-CH2 3.5Å; L750-W782 VanDerWaalsContact O-CZ3 3.31Å; L750-W782 WeakPolarHBondContact O-CZ3 3.15Å; L750-F783 HydrophobicContact CD2-CE2 4.07Å
751	E	97.6	Very high	96.4	Very high	53 Å²	53	73.2 Å²	73.2	25%	0.248	36%	0.358	C	S	.	.	H	α-helix	trans	-68.9	-42.3	177.3	-166.1	71.7	-173.8	0	0	111.6	L747 T748 E749 F754 H755 W782 R786	L747-E751 VanDerWaalsContact O-CB 3.27Å; L747-E751 WeakPolarHBondContact O-CB 3.21Å; L747-E751 PolarHBondContact O-N 3.37Å; T748-E751 PolarHBondContact O-N 2.97Å; E749-E751 VanDerWaalsContact C-N 3.32Å; E749-E751 PolarHBondContact O-N 3.33Å; E751-F754 WeakPolarHBondContact O-CB 3.43Å; E751-F754 PolarHBondContact O-N 3.48Å; E751-H755 PolarHBondContact O-CD2 3.33Å; E751-H755 PolarHBondContact O-N 2.66Å; E751-H755 IonicContact OE1-NE2 3.85Å; E751-W782 HydrophobicContact CB-CH2 4.47Å; E751-W782 WeakPolarHBondContact OE2-CH2 3.24Å; E751-R786 IonicContact OE1-CZ 2.71Å; E751-R786 IonicContact OE1-NE 2.8Å; E751-R786 PolarHBondContact OE1-NE 2.65Å; E751-R786 IonicContact OE1-NH2 3.37Å; E751-R786 PolarHBondContact OE1-NH2 3.18Å; E751-R786 VanDerWaalsContact OE2-CD 3.28Å; E751-R786 WeakPolarHBondContact OE2-CD 3Å; E751-R786 IonicContact OE2-CZ 3.64Å; E751-R786 IonicContact OE2-NE 3.75Å; E751-R786 PolarHBondContact OE2-NE 2.81Å; E751-R786 IonicContact OE2-NH2 3.78Å
752	K	97.1	Very high	96.7	Very high	114 Å²	114	72.8 Å²	72.8	50%	0.496	35%	0.346	S	S	.	.	H	α-helix	trans	-58.2	-46.6	173.5	171.1	-178.3	158.3	-156.2	0	112	T748 E749 F754 H755 F756	T748-K752 VanDerWaalsContact O-CB 3.28Å; T748-K752 WeakPolarHBondContact O-CB 3.12Å; T748-K752 PolarHBondContact O-N 3.04Å; E749-K752 PolarHBondContact O-N 3.18Å; E749-K752 IonicContact OE1-NZ 3.86Å; E749-K752 PolarHBondContact OE1-NZ 3.09Å; E749-K752 IonicContact OE2-NZ 3.79Å; E749-K752 PolarHBondContact OE2-NZ 2.65Å; K752-F754 PolarHBondContact O-N 3.13Å; K752-H755 PolarHBondContact O-N 2.8Å; K752-F756 PolarHBondContact O-N 3.03Å
753	E	97.2	Very high	96.7	Very high	17 Å²	17	72.9 Å²	72.9	8%	0.079	36%	0.356	C	S	.	.	H	α-helix	trans	-64.7	-38.1	174.6	-70.8	-63.3	129.6	0	0	112.2	E749 H755 F756 N757 R764 I768 F783	E749-E753 WeakPolarHBondContact O-CG 3.4Å; E749-E753 PolarHBondContact O-N 2.78Å; E753-H755 VanDerWaalsContact C-N 3.29Å; E753-H755 PolarHBondContact O-N 3.17Å; E753-F756 PolarHBondContact O-N 3.47Å; E753-N757 PolarHBondContact O-N 3.39Å; E753-R764 IonicContact OE1-CZ 3.4Å; E753-R764 IonicContact OE1-NE 3.53Å; E753-R764 IonicContact OE1-NH2 3.11Å; E753-R764 PolarHBondContact OE1-NH2 3.36Å; E753-R764 IonicContact OE2-CZ 3.65Å; E753-R764 IonicContact OE2-NE 3.37Å; E753-R764 PolarHBondContact OE2-NE 2.91Å; E753-R764 IonicContact OE2-NH2 2.62Å; E753-R764 PolarHBondContact OE2-NH2 3.43Å; E753-R764 VanDerWaalsContact OE2-NH2 3.12Å; E753-I768 HydrophobicContact CB-CD1 3.87Å; E753-I768 HydrophobicContact CG-CD1 3.63Å; E753-I768 HydrophobicContact CG-CG1 3.98Å; E753-F783 HydrophobicContact CB-CZ 3.97Å
754	F	97.6	Very high	96.8	Very high	3 Å²	3	72.9 Å²	72.9	1%	0.013	35%	0.347	C	S	.	.	H	α-helix	trans	-64.4	-33.2	174.7	-172.4	-90.2	0	0	0	113.5	L750 E751 K752 N757 R758 W782 F783 R786 R787 Q790	L750-F754 WeakPolarHBondContact O-CB 3.36Å; L750-F754 PolarHBondContact O-N 2.85Å; E751-F754 WeakPolarHBondContact O-CB 3.43Å; E751-F754 PolarHBondContact O-N 3.48Å; K752-F754 PolarHBondContact O-N 3.13Å; F754-N757 CarbonylContact O-C 3.31Å; F754-R758 HydrophobicContact CE1-CG 4.24Å; F754-R758 HydrophobicContact CE2-CB 4.44Å; F754-R758 HydrophobicContact CZ-CB 4.37Å; F754-R758 HydrophobicContact CZ-CG 4.14Å; F754-W782 HydrophobicContact CB-CH2 3.96Å; F754-W782 HydrophobicContact CB-CZ3 3.87Å; F754-W782 HydrophobicContact CD2-CZ3 4.14Å; F754-W782 HydrophobicContact CG-CH2 4.43Å; F754-W782 HydrophobicContact CG-CZ3 4.27Å; F754-F783 HydrophobicContact CB-CE1 4.06Å; F754-F783 HydrophobicContact CB-CZ 4.19Å; F754-F783 AromaticContact CD2-CD1 3.73Å; F754-F783 HydrophobicContact CD2-CD1 3.73Å; F754-F783 AromaticContact CD2-CE1 3.77Å; F754-F783 HydrophobicContact CD2-CE1 3.77Å; F754-F783 HydrophobicContact CE2-CD1 4.38Å; F754-F783 HydrophobicContact CG-CE1 4.4Å; F754-R786 HydrophobicContact CB-CG 4.33Å; F754-R786 HydrophobicContact CD1-CG 3.72Å; F754-R786 HydrophobicContact CD2-CB 3.93Å; F754-R786 HydrophobicContact CD2-CG 3.42Å; F754-R786 VanDerWaalsContact CD2-CG 3.42Å; F754-R786 HydrophobicContact CE1-CG 3.86Å; F754-R786 HydrophobicContact CE2-CB 3.91Å; F754-R786 HydrophobicContact CE2-CG 3.56Å; F754-R786 HydrophobicContact CG-CB 4.48Å; F754-R786 HydrophobicContact CG-CG 3.52Å; F754-R786 HydrophobicContact CZ-CB 4.45Å; F754-R786 HydrophobicContact CZ-CG 3.78Å; F754-R787 HydrophobicContact CE2-CG 3.67Å; F754-R787 HydrophobicContact CZ-CG 3.99Å; F754-Q790 VanDerWaalsContact CE1-OE1 3.22Å; F754-Q790 VanDerWaalsContact CZ-OE1 3.3Å
755	H	95.1	Very high	96.9	Very high	138 Å²	138	69.9 Å²	69.9	64%	0.639	32%	0.323	S	S	*	.	H	α-helix	trans	-70.7	-36.9	173.1	-82.4	-72.2	0	0	0	112.2	E751 K752 E753	E751-H755 PolarHBondContact O-CD2 3.33Å; E751-H755 PolarHBondContact O-N 2.66Å; E751-H755 IonicContact OE1-NE2 3.85Å; K752-H755 PolarHBondContact O-N 2.8Å; E753-H755 VanDerWaalsContact C-N 3.29Å; E753-H755 PolarHBondContact O-N 3.17Å
756	F	95.7	Very high	96.9	Very high	92 Å²	92	66.8 Å²	66.8	40%	0.404	32%	0.316	S	S	.	.	H	α-helix	trans	-70.4	-48	174.9	178.6	-119.5	0	0	0	112.3	K752 E753 L847 K851	K752-F756 PolarHBondContact O-N 3.03Å; E753-F756 PolarHBondContact O-N 3.47Å; F756-L847 HydrophobicContact CD2-CD2 4.14Å; F756-L847 HydrophobicContact CE2-CD2 4.01Å; F756-K851 HydrophobicContact CE2-CD 4.33Å
757	N	95.6	Very high	96.9	Very high	43 Å²	43	69.7 Å²	69.7	23%	0.23	33%	0.33	C	S	.	.			trans	-145.1	121.6	177.9	-172.4	-10.1	0	0	0	111.8	E753 F754 Y759 F783 Q844	E753-N757 PolarHBondContact O-N 3.39Å; F754-N757 CarbonylContact O-C 3.31Å; N757-Y759 VanDerWaalsContact CG-O 3.29Å; N757-Y759 PolarHBondContact ND2-O 3.43Å; N757-Y759 VanDerWaalsContact ND2-O 3.13Å; N757-Y759 PolarHBondContact O-N 3.43Å; N757-Y759 PolarHBondContact OD1-N 3.21Å; N757-Y759 PolarHBondContact OD1-O 3.41Å; N757-Y759 VanDerWaalsContact OD1-O 3.1Å; N757-F783 WeakPolarHBondContact O-CE1 3.37Å; N757-Q844 PolarHBondContact OD1-NE2 2.59Å
758	R	95.6	Very high	96.9	Very high	97 Å²	97	66.4 Å²	66.4	37%	0.366	31%	0.313	S	S	.	.	S	Bend	trans	-71.7	-11.6	-179.7	-61.6	177.8	-173.6	153.2	6	113.6	F754 R787	F754-R758 HydrophobicContact CE1-CG 4.24Å; F754-R758 HydrophobicContact CE2-CB 4.44Å; F754-R758 HydrophobicContact CZ-CB 4.37Å; F754-R758 HydrophobicContact CZ-CG 4.14Å; R758-R787 WeakPolarHBondContact O-CD 3.05Å; R758-R787 PolarHBondContact O-NH1 3.22Å
759	Y	97.5	Very high	97	Very high	119 Å²	119	63.2 Å²	63.2	47%	0.467	29%	0.294	S	S	.	.	S	Bend	trans	-135.7	105	-177.9	-63.9	-84.4	0	0	0	111.5	N757 R787	N757-Y759 VanDerWaalsContact CG-O 3.29Å; N757-Y759 PolarHBondContact ND2-O 3.43Å; N757-Y759 VanDerWaalsContact ND2-O 3.13Å; N757-Y759 PolarHBondContact O-N 3.43Å; N757-Y759 PolarHBondContact OD1-N 3.21Å; N757-Y759 PolarHBondContact OD1-O 3.41Å; N757-Y759 VanDerWaalsContact OD1-O 3.1Å; Y759-R787 VanDerWaalsContact CE1-CD 3.49Å
760	L	95.2	Very high	97	Very high	21 Å²	21	63.5 Å²	63.5	11%	0.11	31%	0.306	C	S	.	.			trans	-72.4	130.1	178.4	-64.3	-178.2	0	0	0	113.6	R764 R765 I768 V779 F783	L760-R764 HydrophobicContact CD2-CB 4.48Å; L760-R764 HydrophobicContact CD2-CG 3.96Å; L760-R765 HydrophobicContact CB-CB 4.49Å; L760-R765 HydrophobicContact CD1-CB 4.4Å; L760-R765 HydrophobicContact CD1-CG 4.45Å; L760-I768 HydrophobicContact CD1-CD1 3.77Å; L760-I768 HydrophobicContact CD2-CD1 3.56Å; L760-I768 HydrophobicContact CG-CD1 4.32Å; L760-V779 HydrophobicContact CD1-CG1 3.49Å; L760-V779 VanDerWaalsContact CD1-CG1 3.49Å; L760-F783 HydrophobicContact CD1-CD1 4.25Å; L760-F783 HydrophobicContact CD1-CD2 3.57Å; L760-F783 HydrophobicContact CD1-CE1 4.11Å; L760-F783 HydrophobicContact CD1-CE2 3.44Å; L760-F783 VanDerWaalsContact CD1-CE2 3.44Å; L760-F783 HydrophobicContact CD1-CG 4.01Å; L760-F783 HydrophobicContact CD1-CZ 3.72Å; L760-F783 HydrophobicContact CD2-CE1 3.84Å; L760-F783 HydrophobicContact CD2-CE2 4.32Å; L760-F783 HydrophobicContact CD2-CZ 3.72Å; L760-F783 HydrophobicContact CG-CD1 3.84Å; L760-F783 HydrophobicContact CG-CD2 4.09Å; L760-F783 HydrophobicContact CG-CE1 3.6Å; L760-F783 HydrophobicContact CG-CE2 3.91Å; L760-F783 HydrophobicContact CG-CG 4.08Å; L760-F783 HydrophobicContact CG-CZ 3.65Å
761	S	96.8	Very high	96.9	Very high	66 Å²	66	68.1 Å²	68.1	46%	0.462	33%	0.331	S	S	.	.			trans	-64.2	170.2	165.1	69.9	0	0	0	0	112.2	R764 R765	S761-R764 WeakPolarHBondContact OG-CB 3.04Å; S761-R764 PolarHBondContact OG-N 3.36Å; S761-R765 WeakPolarHBondContact O-CB 3.38Å; S761-R765 PolarHBondContact O-N 2.98Å
762	R	96.7	Very high	96.9	Very high	137 Å²	137	65.9 Å²	65.9	52%	0.517	32%	0.321	S	S	.	.	H	α-helix	trans	-60.5	-45.9	176.7	179	74.7	-165.3	91.5	-14.8	111.6	E776	R762-E776 IonicContact CZ-OE1 3.57Å; R762-E776 IonicContact CZ-OE2 2.79Å; R762-E776 IonicContact NH1-OE1 3.78Å; R762-E776 PolarHBondContact NH1-OE1 3.02Å; R762-E776 VanDerWaalsContact NH1-OE1 3.11Å; R762-E776 IonicContact NH1-OE2 3.69Å; R762-E776 PolarHBondContact NH1-OE2 2.96Å; R762-E776 IonicContact NH2-OE1 2.64Å; R762-E776 PolarHBondContact NH2-OE1 3.45Å; R762-E776 IonicContact NH2-OE2 3.49Å
763	A	97.3	Very high	96.9	Very high	54 Å²	54	67.2 Å²	67.2	45%	0.446	33%	0.333	S	S	.	.	H	α-helix	trans	-68.1	-54	-177.8	0	0	0	0	0	111.9	R765 I766 E767	A763-R765 PolarHBondContact O-N 2.92Å; A763-R765 VanDerWaalsContact O-N 3.07Å; A763-I766 WeakPolarHBondContact O-CB 3.06Å; A763-I766 PolarHBondContact O-N 2.9Å; A763-E767 PolarHBondContact O-N 3.4Å
764	R	97.4	Very high	96.8	Very high	76 Å²	76	67.3 Å²	67.3	29%	0.287	34%	0.335	S	S	.	.	H	α-helix	trans	-60.2	-27.6	-178.1	-170.3	55.7	179.1	165.4	3.3	112.9	E753 L760 S761 E767 I768	E753-R764 IonicContact OE1-CZ 3.4Å; E753-R764 IonicContact OE1-NE 3.53Å; E753-R764 IonicContact OE1-NH2 3.11Å; E753-R764 PolarHBondContact OE1-NH2 3.36Å; E753-R764 IonicContact OE2-CZ 3.65Å; E753-R764 IonicContact OE2-NE 3.37Å; E753-R764 PolarHBondContact OE2-NE 2.91Å; E753-R764 IonicContact OE2-NH2 2.62Å; E753-R764 PolarHBondContact OE2-NH2 3.43Å; E753-R764 VanDerWaalsContact OE2-NH2 3.12Å; L760-R764 HydrophobicContact CD2-CB 4.48Å; L760-R764 HydrophobicContact CD2-CG 3.96Å; S761-R764 WeakPolarHBondContact OG-CB 3.04Å; S761-R764 PolarHBondContact OG-N 3.36Å; R764-E767 WeakPolarHBondContact CD-OE2 3.35Å; R764-E767 IonicContact CZ-OE2 3.15Å; R764-E767 IonicContact NE-OE2 2.65Å; R764-E767 IonicContact NH1-OE2 3.97Å; R764-E767 PolarHBondContact NH1-OE2 2.7Å; R764-I768 HydrophobicContact CG-CD1 3.86Å; R764-I768 HydrophobicContact CG-CG1 4.41Å; R764-I768 WeakPolarHBondContact O-CD1 3.39Å; R764-I768 VanDerWaalsContact O-CG1 3.24Å; R764-I768 WeakPolarHBondContact O-CG1 3.47Å; R764-I768 PolarHBondContact O-N 2.87Å; R764-I768 VanDerWaalsContact O-N 3.09Å
765	R	97.9	Very high	96.8	Very high	54 Å²	54	70.8 Å²	70.8	20%	0.204	36%	0.356	C	S	.	.	H	α-helix	trans	-66.8	-36.6	172.9	-167.4	-171.3	-51.9	146	10.2	113.2	L760 S761 A763 A769 E776 V779	L760-R765 HydrophobicContact CB-CB 4.49Å; L760-R765 HydrophobicContact CD1-CB 4.4Å; L760-R765 HydrophobicContact CD1-CG 4.45Å; S761-R765 WeakPolarHBondContact O-CB 3.38Å; S761-R765 PolarHBondContact O-N 2.98Å; A763-R765 PolarHBondContact O-N 2.92Å; A763-R765 VanDerWaalsContact O-N 3.07Å; R765-A769 WeakPolarHBondContact O-CB 3.45Å; R765-A769 PolarHBondContact O-N 2.83Å; R765-E776 WeakPolarHBondContact CD-OE2 3.31Å; R765-E776 HydrophobicContact CG-CB 4.41Å; R765-V779 HydrophobicContact CG-CB 4.3Å; R765-V779 HydrophobicContact CG-CG1 4.16Å
766	I	97.8	Very high	96.9	Very high	83 Å²	83	66.9 Å²	66.9	43%	0.426	34%	0.338	S	S	.	.	H	α-helix	trans	-67.3	-47.4	176.7	-59.3	168.1	0	0	0	109.3	A763 A769 A770	A763-I766 WeakPolarHBondContact O-CB 3.06Å; A763-I766 PolarHBondContact O-N 2.9Å; I766-A769 WeakPolarHBondContact O-CB 3.37Å; I766-A769 PolarHBondContact O-N 3.21Å; I766-A770 PolarHBondContact O-N 3.49Å
767	E	97.8	Very high	97	Very high	88 Å²	88	66.7 Å²	66.7	41%	0.411	35%	0.345	S	S	.	.	H	α-helix	trans	-55.9	-54.6	178.5	-65.5	162.3	-156.9	0	0	111.2	A763 R764 A769 A770 D771	A763-E767 PolarHBondContact O-N 3.4Å; R764-E767 WeakPolarHBondContact CD-OE2 3.35Å; R764-E767 IonicContact CZ-OE2 3.15Å; R764-E767 IonicContact NE-OE2 2.65Å; R764-E767 IonicContact NH1-OE2 3.97Å; R764-E767 PolarHBondContact NH1-OE2 2.7Å; E767-A769 VanDerWaalsContact C-N 3.28Å; E767-A769 PolarHBondContact O-N 3.46Å; E767-A770 PolarHBondContact O-N 3.25Å; E767-A770 VanDerWaalsContact O-N 3.15Å; E767-D771 WeakPolarHBondContact O-CB 3.4Å; E767-D771 VanDerWaalsContact O-CG 3.3Å; E767-D771 PolarHBondContact O-N 2.97Å
768	I	97.2	Very high	97	Very high	4 Å²	4	66.6 Å²	66.6	2%	0.021	34%	0.343	C	S	.	.	H	α-helix	trans	-61.9	-35.7	178.5	-64.4	166.3	0	0	0	111.9	L750 E753 L760 R764 L772 V779	L750-I768 HydrophobicContact CD2-CG2 3.88Å; E753-I768 HydrophobicContact CB-CD1 3.87Å; E753-I768 HydrophobicContact CG-CD1 3.63Å; E753-I768 HydrophobicContact CG-CG1 3.98Å; L760-I768 HydrophobicContact CD1-CD1 3.77Å; L760-I768 HydrophobicContact CD2-CD1 3.56Å; L760-I768 HydrophobicContact CG-CD1 4.32Å; R764-I768 HydrophobicContact CG-CD1 3.86Å; R764-I768 HydrophobicContact CG-CG1 4.41Å; R764-I768 WeakPolarHBondContact O-CD1 3.39Å; R764-I768 VanDerWaalsContact O-CG1 3.24Å; R764-I768 WeakPolarHBondContact O-CG1 3.47Å; R764-I768 PolarHBondContact O-N 2.87Å; R764-I768 VanDerWaalsContact O-N 3.09Å; I768-L772 HydrophobicContact CG2-CD1 3.73Å; I768-L772 HydrophobicContact CG2-CG 4.33Å; I768-L772 VanDerWaalsContact O-CB 3.3Å; I768-L772 WeakPolarHBondContact O-CB 3.36Å; I768-L772 VanDerWaalsContact O-CG 3.31Å; I768-L772 WeakPolarHBondContact O-CG 3.45Å; I768-L772 PolarHBondContact O-N 3.27Å; I768-V779 HydrophobicContact CB-CG1 4.44Å; I768-V779 HydrophobicContact CG2-CG1 3.93Å; I768-V779 HydrophobicContact CG2-CG2 4.17Å
769	A	97.7	Very high	97.1	Very high	9 Å²	9	62 Å²	62	7%	0.074	33%	0.325	C	S	.	.	H	α-helix	trans	-64.3	-44.1	176.3	0	0	0	0	0	111.4	R765 I766 E767 N773 L774 E776 V779	R765-A769 WeakPolarHBondContact O-CB 3.45Å; R765-A769 PolarHBondContact O-N 2.83Å; I766-A769 WeakPolarHBondContact O-CB 3.37Å; I766-A769 PolarHBondContact O-N 3.21Å; E767-A769 VanDerWaalsContact C-N 3.28Å; E767-A769 PolarHBondContact O-N 3.46Å; A769-N773 PolarHBondContact O-N 2.6Å; A769-L774 CarbonylContact C-O 3.59Å; A769-L774 WeakPolarHBondContact CA-O 3.48Å; A769-L774 VanDerWaalsContact CB-O 3.27Å; A769-L774 WeakPolarHBondContact CB-O 3.18Å; A769-L774 PolarHBondContact O-N 3.45Å; A769-E776 HydrophobicContact CB-CG 4.1Å; A769-V779 HydrophobicContact CB-CG2 4.21Å
770	A	97.4	Very high	97.1	Very high	65 Å²	65	62 Å²	62	54%	0.537	33%	0.328	S	S	.	.	H	α-helix	trans	-65.4	-52.9	176	0	0	0	0	0	112.2	I766 E767 L772 N773	I766-A770 PolarHBondContact O-N 3.49Å; E767-A770 PolarHBondContact O-N 3.25Å; E767-A770 VanDerWaalsContact O-N 3.15Å; A770-L772 PolarHBondContact O-N 3.24Å; A770-L772 VanDerWaalsContact O-N 3.14Å; A770-N773 PolarHBondContact O-N 3.37Å; A770-N773 VanDerWaalsContact O-N 3.14Å
771	D	97	Very high	97.1	Very high	98 Å²	98	64.8 Å²	64.8	52%	0.524	34%	0.342	S	S	.	.	H	α-helix	trans	-60.8	-26.1	-175.4	-70.8	-14.8	0	0	0	114.2	R745 E767	R745-D771 PolarHBondContact NH1-O 2.82Å; E767-D771 WeakPolarHBondContact O-CB 3.4Å; E767-D771 VanDerWaalsContact O-CG 3.3Å; E767-D771 PolarHBondContact O-N 2.97Å
772	L	96.8	Very high	97.2	Very high	6 Å²	6	62.9 Å²	62.9	3%	0.031	33%	0.325	C	S	.	.	T	Hydrogen-bonded Turn	trans	-107.8	-0.3	-177.1	-57.7	-172.7	0	0	0	113.7	Q746 E749 L750 I768 A770 L774	Q746-L772 HydrophobicContact CG-CB 4.27Å; Q746-L772 PolarHBondContact NE2-O 3.06Å; E749-L772 HydrophobicContact CB-CD1 4.11Å; E749-L772 HydrophobicContact CB-CD2 3.63Å; E749-L772 HydrophobicContact CB-CG 4.47Å; E749-L772 HydrophobicContact CG-CD2 3.99Å; L750-L772 HydrophobicContact CD1-CD1 4.46Å; L750-L772 HydrophobicContact CD2-CD1 3.91Å; L750-L772 HydrophobicContact CG-CD1 3.68Å; I768-L772 HydrophobicContact CG2-CD1 3.73Å; I768-L772 HydrophobicContact CG2-CG 4.33Å; I768-L772 VanDerWaalsContact O-CB 3.3Å; I768-L772 WeakPolarHBondContact O-CB 3.36Å; I768-L772 VanDerWaalsContact O-CG 3.31Å; I768-L772 WeakPolarHBondContact O-CG 3.45Å; I768-L772 PolarHBondContact O-N 3.27Å; A770-L772 PolarHBondContact O-N 3.24Å; A770-L772 VanDerWaalsContact O-N 3.14Å; L772-L774 VanDerWaalsContact C-N 3.29Å; L772-L774 HydrophobicContact CB-CD1 4.1Å; L772-L774 HydrophobicContact CB-CG 4.07Å; L772-L774 HydrophobicContact CD1-CD1 4.48Å; L772-L774 PolarHBondContact O-N 3.28Å
773	N	97	Very high	97.2	Very high	141 Å²	141	56.6 Å²	56.6	75%	0.754	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.9	46.9	-173.2	-53	102.4	0	0	0	112.3	A769 A770	A769-N773 PolarHBondContact O-N 2.6Å; A770-N773 PolarHBondContact O-N 3.37Å; A770-N773 VanDerWaalsContact O-N 3.14Å
774	L	96.4	Very high	97.2	Very high	20 Å²	20	59 Å²	59	11%	0.105	30%	0.303	C	S	.	.			trans	-118	155.7	178.1	-66.7	-179.2	0	0	0	110.5	F742 Q746 L750 A769 L772 V779	F742-L774 HydrophobicContact CD1-CD1 3.8Å; F742-L774 HydrophobicContact CD1-CD2 3.82Å; F742-L774 HydrophobicContact CD1-CG 4.48Å; F742-L774 HydrophobicContact CE1-CD1 3.71Å; F742-L774 HydrophobicContact CE1-CD2 3.75Å; F742-L774 HydrophobicContact CE1-CG 4.37Å; Q746-L774 HydrophobicContact CG-CD1 4.49Å; L750-L774 HydrophobicContact CD1-CD1 4Å; A769-L774 CarbonylContact C-O 3.59Å; A769-L774 WeakPolarHBondContact CA-O 3.48Å; A769-L774 VanDerWaalsContact CB-O 3.27Å; A769-L774 WeakPolarHBondContact CB-O 3.18Å; A769-L774 PolarHBondContact O-N 3.45Å; L772-L774 VanDerWaalsContact C-N 3.29Å; L772-L774 HydrophobicContact CB-CD1 4.1Å; L772-L774 HydrophobicContact CB-CG 4.07Å; L772-L774 HydrophobicContact CD1-CD1 4.48Å; L772-L774 PolarHBondContact O-N 3.28Å; L774-V779 HydrophobicContact CB-CG2 4.08Å; L774-V779 HydrophobicContact CD1-CG2 4.4Å
775	T	97.1	Very high	97.2	Very high	75 Å²	75	60.1 Å²	60.1	46%	0.46	32%	0.315	S	S	.	.			trans	-72.9	148.1	167.9	62.8	0	0	0	0	110.7	T777 Q778 V779	T775-T777 PolarHBondContact O-N 3.47Å; T775-T777 VanDerWaalsContact O-N 3.12Å; T775-Q778 WeakPolarHBondContact O-CB 3.28Å; T775-Q778 PolarHBondContact O-N 2.87Å; T775-Q778 WeakPolarHBondContact OG1-CB 3.49Å; T775-Q778 VanDerWaalsContact OG1-CG 3.29Å; T775-Q778 WeakPolarHBondContact OG1-CG 3.18Å; T775-Q778 PolarHBondContact OG1-N 3.38Å; T775-Q778 VanDerWaalsContact OG1-N 3.15Å; T775-Q778 PolarHBondContact OG1-OE1 2.91Å; T775-V779 PolarHBondContact O-N 3.47Å; T775-V779 VanDerWaalsContact O-N 3.08Å
776	E	97.7	Very high	97.2	Very high	56 Å²	56	58.8 Å²	58.8	26%	0.262	31%	0.31	S	S	.	.	H	α-helix	trans	-50.6	-36.7	171	-69.7	-152	-121.6	0	0	113.4	R762 R765 A769 V779 K780	R762-E776 IonicContact CZ-OE1 3.57Å; R762-E776 IonicContact CZ-OE2 2.79Å; R762-E776 IonicContact NH1-OE1 3.78Å; R762-E776 PolarHBondContact NH1-OE1 3.02Å; R762-E776 VanDerWaalsContact NH1-OE1 3.11Å; R762-E776 IonicContact NH1-OE2 3.69Å; R762-E776 PolarHBondContact NH1-OE2 2.96Å; R762-E776 IonicContact NH2-OE1 2.64Å; R762-E776 PolarHBondContact NH2-OE1 3.45Å; R762-E776 IonicContact NH2-OE2 3.49Å; R765-E776 WeakPolarHBondContact CD-OE2 3.31Å; R765-E776 HydrophobicContact CG-CB 4.41Å; A769-E776 HydrophobicContact CB-CG 4.1Å; E776-V779 PolarHBondContact O-N 3.35Å; E776-K780 VanDerWaalsContact O-CB 3.29Å; E776-K780 WeakPolarHBondContact O-CB 3.41Å; E776-K780 PolarHBondContact O-N 2.96Å
777	T	96.6	Very high	97.2	Very high	89 Å²	89	58.3 Å²	58.3	55%	0.546	30%	0.303	S	S	.	.	H	α-helix	trans	-66	-42.6	177.7	-59.2	0	0	0	0	111.4	T775 K780 I781	T775-T777 PolarHBondContact O-N 3.47Å; T775-T777 VanDerWaalsContact O-N 3.12Å; T777-K780 PolarHBondContact O-N 3.48Å; T777-I781 HydrophobicContact CG2-CD1 3.77Å; T777-I781 HydrophobicContact CG2-CG1 4.46Å; T777-I781 WeakPolarHBondContact O-CB 3.35Å; T777-I781 VanDerWaalsContact O-CG1 3.23Å; T777-I781 WeakPolarHBondContact O-CG1 3.48Å; T777-I781 PolarHBondContact O-N 3.44Å
778	Q	96.4	Very high	97.1	Very high	41 Å²	41	59 Å²	59	19%	0.192	31%	0.307	C	S	.	.	H	α-helix	trans	-62.1	-44.7	173.5	-77.5	161.3	-51.5	0	0	111.6	T740 F742 T775 I781 W782	T740-Q778 PolarHBondContact OG1-NE2 3.3Å; F742-Q778 HydrophobicContact CE1-CB 4.17Å; F742-Q778 HydrophobicContact CZ-CB 4.22Å; T775-Q778 WeakPolarHBondContact O-CB 3.28Å; T775-Q778 PolarHBondContact O-N 2.87Å; T775-Q778 WeakPolarHBondContact OG1-CB 3.49Å; T775-Q778 VanDerWaalsContact OG1-CG 3.29Å; T775-Q778 WeakPolarHBondContact OG1-CG 3.18Å; T775-Q778 PolarHBondContact OG1-N 3.38Å; T775-Q778 VanDerWaalsContact OG1-N 3.15Å; T775-Q778 PolarHBondContact OG1-OE1 2.91Å; Q778-I781 PolarHBondContact O-N 2.9Å; Q778-W782 VanDerWaalsContact O-CB 3.3Å; Q778-W782 WeakPolarHBondContact O-CB 3.26Å; Q778-W782 PolarHBondContact O-N 2.7Å
779	V	97.5	Very high	96.9	Very high	0 Å²	0	64.8 Å²	64.8	0%	0	33%	0.332	C	S	.	.	H	α-helix	trans	-61.2	-47.2	176.3	-179.3	0	0	0	0	110.6	L750 L760 R765 I768 A769 L774 T775 E776 I781 W782 F783	L750-V779 HydrophobicContact CD2-CG1 4.17Å; L750-V779 HydrophobicContact CD2-CG2 4.47Å; L760-V779 HydrophobicContact CD1-CG1 3.49Å; L760-V779 VanDerWaalsContact CD1-CG1 3.49Å; R765-V779 HydrophobicContact CG-CB 4.3Å; R765-V779 HydrophobicContact CG-CG1 4.16Å; I768-V779 HydrophobicContact CB-CG1 4.44Å; I768-V779 HydrophobicContact CG2-CG1 3.93Å; I768-V779 HydrophobicContact CG2-CG2 4.17Å; A769-V779 HydrophobicContact CB-CG2 4.21Å; L774-V779 HydrophobicContact CB-CG2 4.08Å; L774-V779 HydrophobicContact CD1-CG2 4.4Å; T775-V779 PolarHBondContact O-N 3.47Å; T775-V779 VanDerWaalsContact O-N 3.08Å; E776-V779 PolarHBondContact O-N 3.35Å; V779-I781 PolarHBondContact O-N 3.38Å; V779-W782 PolarHBondContact O-N 3.19Å; V779-F783 HydrophobicContact CG1-CD2 4.03Å; V779-F783 HydrophobicContact CG1-CE2 4.18Å; V779-F783 WeakPolarHBondContact O-CD2 3.45Å; V779-F783 PolarHBondContact O-N 3.37Å
780	K	97.1	Very high	96.8	Very high	118 Å²	118	66.3 Å²	66.3	51%	0.513	34%	0.338	S	S	.	.	H	α-helix	trans	-57.7	-47.2	176.7	-177.4	-177.4	176.9	-175.1	0	112.3	E776 T777 F783 Q784	E776-K780 VanDerWaalsContact O-CB 3.29Å; E776-K780 WeakPolarHBondContact O-CB 3.41Å; E776-K780 PolarHBondContact O-N 2.96Å; T777-K780 PolarHBondContact O-N 3.48Å; K780-F783 PolarHBondContact O-N 3.36Å; K780-Q784 PolarHBondContact O-N 2.93Å; K780-Q784 VanDerWaalsContact O-N 3.07Å
781	I	96.3	Very high	96.5	Very high	81 Å²	81	67.9 Å²	67.9	42%	0.415	33%	0.333	S	S	.	.	H	α-helix	trans	-66	-42.2	178.4	-71.2	169	0	0	0	110.9	T777 Q778 V779 Q784 N785	T777-I781 HydrophobicContact CG2-CD1 3.77Å; T777-I781 HydrophobicContact CG2-CG1 4.46Å; T777-I781 WeakPolarHBondContact O-CB 3.35Å; T777-I781 VanDerWaalsContact O-CG1 3.23Å; T777-I781 WeakPolarHBondContact O-CG1 3.48Å; T777-I781 PolarHBondContact O-N 3.44Å; Q778-I781 PolarHBondContact O-N 2.9Å; V779-I781 PolarHBondContact O-N 3.38Å; I781-Q784 PolarHBondContact O-N 2.96Å; I781-N785 WeakPolarHBondContact CG2-ND2 3.5Å; I781-N785 WeakPolarHBondContact O-CB 3.5Å; I781-N785 VanDerWaalsContact O-CG 3.31Å; I781-N785 PolarHBondContact O-N 2.8Å; I781-N785 PolarHBondContact O-ND2 3.47Å
782	W	97.6	Very high	96.3	Very high	26 Å²	26	68.8 Å²	68.8	10%	0.098	33%	0.332	C	S	.	.	H	α-helix	trans	-61.1	-46.4	177.5	-174.8	103.6	0	0	0	110.9	F742 L750 E751 F754 Q778 V779 Q784 N785 R786	F742-W782 AromaticContact CD2-CD1 3.83Å; F742-W782 HydrophobicContact CE2-CB 4.48Å; F742-W782 AromaticContact CE2-CD1 3.63Å; F742-W782 HydrophobicContact CE2-CG 4.44Å; F742-W782 HydrophobicContact CZ-CB 4.49Å; L750-W782 HydrophobicContact CB-CD2 3.88Å; L750-W782 HydrophobicContact CB-CE3 3.9Å; L750-W782 HydrophobicContact CB-CH2 3.75Å; L750-W782 HydrophobicContact CB-CZ2 3.66Å; L750-W782 HydrophobicContact CB-CZ3 3.85Å; L750-W782 HydrophobicContact CD1-CD2 3.93Å; L750-W782 HydrophobicContact CD1-CG 3.85Å; L750-W782 HydrophobicContact CD2-CD2 4.35Å; L750-W782 HydrophobicContact CD2-CE3 4.2Å; L750-W782 HydrophobicContact CG-CD2 4.27Å; L750-W782 HydrophobicContact CG-CE3 4.44Å; L750-W782 VanDerWaalsContact O-CH2 3.26Å; L750-W782 WeakPolarHBondContact O-CH2 3.5Å; L750-W782 VanDerWaalsContact O-CZ3 3.31Å; L750-W782 WeakPolarHBondContact O-CZ3 3.15Å; E751-W782 HydrophobicContact CB-CH2 4.47Å; E751-W782 WeakPolarHBondContact OE2-CH2 3.24Å; F754-W782 HydrophobicContact CB-CH2 3.96Å; F754-W782 HydrophobicContact CB-CZ3 3.87Å; F754-W782 HydrophobicContact CD2-CZ3 4.14Å; F754-W782 HydrophobicContact CG-CH2 4.43Å; F754-W782 HydrophobicContact CG-CZ3 4.27Å; Q778-W782 VanDerWaalsContact O-CB 3.3Å; Q778-W782 WeakPolarHBondContact O-CB 3.26Å; Q778-W782 PolarHBondContact O-N 2.7Å; V779-W782 PolarHBondContact O-N 3.19Å; W782-Q784 PolarHBondContact O-N 3.1Å; W782-N785 PolarHBondContact O-N 2.74Å; W782-R786 HydrophobicContact CD2-CB 4.43Å; W782-R786 HydrophobicContact CE3-CB 4.03Å; W782-R786 HydrophobicContact CH2-CB 3.88Å; W782-R786 HydrophobicContact CH2-CG 3.54Å; W782-R786 HydrophobicContact CZ2-CB 4.33Å; W782-R786 HydrophobicContact CZ2-CG 4.18Å; W782-R786 HydrophobicContact CZ3-CB 3.73Å; W782-R786 HydrophobicContact CZ3-CG 3.78Å; W782-R786 VanDerWaalsContact O-CB 3.27Å; W782-R786 WeakPolarHBondContact O-CB 3.36Å; W782-R786 PolarHBondContact O-N 2.94Å
783	F	98.1	Very high	95.9	Very high	4 Å²	4	73.7 Å²	73.7	2%	0.018	35%	0.35	C	S	.	.	H	α-helix	trans	-61.8	-40.8	176.8	-93.3	-101.4	0	0	0	112.5	L750 E753 F754 N757 L760 V779 K780 R786 R787	L750-F783 HydrophobicContact CD2-CE2 4.07Å; E753-F783 HydrophobicContact CB-CZ 3.97Å; F754-F783 HydrophobicContact CB-CE1 4.06Å; F754-F783 HydrophobicContact CB-CZ 4.19Å; F754-F783 AromaticContact CD2-CD1 3.73Å; F754-F783 HydrophobicContact CD2-CD1 3.73Å; F754-F783 AromaticContact CD2-CE1 3.77Å; F754-F783 HydrophobicContact CD2-CE1 3.77Å; F754-F783 HydrophobicContact CE2-CD1 4.38Å; F754-F783 HydrophobicContact CG-CE1 4.4Å; N757-F783 WeakPolarHBondContact O-CE1 3.37Å; L760-F783 HydrophobicContact CD1-CD1 4.25Å; L760-F783 HydrophobicContact CD1-CD2 3.57Å; L760-F783 HydrophobicContact CD1-CE1 4.11Å; L760-F783 HydrophobicContact CD1-CE2 3.44Å; L760-F783 VanDerWaalsContact CD1-CE2 3.44Å; L760-F783 HydrophobicContact CD1-CG 4.01Å; L760-F783 HydrophobicContact CD1-CZ 3.72Å; L760-F783 HydrophobicContact CD2-CE1 3.84Å; L760-F783 HydrophobicContact CD2-CE2 4.32Å; L760-F783 HydrophobicContact CD2-CZ 3.72Å; L760-F783 HydrophobicContact CG-CD1 3.84Å; L760-F783 HydrophobicContact CG-CD2 4.09Å; L760-F783 HydrophobicContact CG-CE1 3.6Å; L760-F783 HydrophobicContact CG-CE2 3.91Å; L760-F783 HydrophobicContact CG-CG 4.08Å; L760-F783 HydrophobicContact CG-CZ 3.65Å; V779-F783 HydrophobicContact CG1-CD2 4.03Å; V779-F783 HydrophobicContact CG1-CE2 4.18Å; V779-F783 WeakPolarHBondContact O-CD2 3.45Å; V779-F783 PolarHBondContact O-N 3.37Å; K780-F783 PolarHBondContact O-N 3.36Å; F783-R786 PolarHBondContact O-N 3.12Å; F783-R787 WeakPolarHBondContact O-CG 3.37Å; F783-R787 PolarHBondContact O-N 3.36Å
784	Q	96.9	Very high	95.4	Very high	106 Å²	106	69.1 Å²	69.1	50%	0.495	33%	0.325	S	S	.	.	H	α-helix	trans	-61.7	-48.7	174.8	-175.3	174.1	4.2	0	0	111.6	K780 I781 W782 R786 R787 M788	K780-Q784 PolarHBondContact O-N 2.93Å; K780-Q784 VanDerWaalsContact O-N 3.07Å; I781-Q784 PolarHBondContact O-N 2.96Å; W782-Q784 PolarHBondContact O-N 3.1Å; Q784-R786 VanDerWaalsContact C-N 3.32Å; Q784-R786 PolarHBondContact O-N 3.06Å; Q784-R787 PolarHBondContact O-N 3.42Å; Q784-M788 WeakPolarHBondContact O-CG 3.38Å; Q784-M788 PolarHBondContact O-N 2.98Å
785	N	97.3	Very high	94.7	Very high	99 Å²	99	73.7 Å²	73.7	53%	0.529	34%	0.341	S	S	.	.	H	α-helix	trans	-62.2	-38.6	176.4	-73	-28.2	0	0	0	112	I781 W782 M788 K789	I781-N785 WeakPolarHBondContact CG2-ND2 3.5Å; I781-N785 WeakPolarHBondContact O-CB 3.5Å; I781-N785 VanDerWaalsContact O-CG 3.31Å; I781-N785 PolarHBondContact O-N 2.8Å; I781-N785 PolarHBondContact O-ND2 3.47Å; W782-N785 PolarHBondContact O-N 2.74Å; N785-M788 PolarHBondContact O-N 3.25Å; N785-K789 PolarHBondContact O-N 3.3Å
786	R	97.4	Very high	94	Very high	25 Å²	25	73.9 Å²	73.9	9%	0.094	34%	0.339	C	S	.	.	H	α-helix	trans	-68.8	-37.4	179.4	-175.9	60.5	-171.8	64.7	8.3	112.6	E751 F754 W782 F783 Q784 K789 Q790	E751-R786 IonicContact OE1-CZ 2.71Å; E751-R786 IonicContact OE1-NE 2.8Å; E751-R786 PolarHBondContact OE1-NE 2.65Å; E751-R786 IonicContact OE1-NH2 3.37Å; E751-R786 PolarHBondContact OE1-NH2 3.18Å; E751-R786 VanDerWaalsContact OE2-CD 3.28Å; E751-R786 WeakPolarHBondContact OE2-CD 3Å; E751-R786 IonicContact OE2-CZ 3.64Å; E751-R786 IonicContact OE2-NE 3.75Å; E751-R786 PolarHBondContact OE2-NE 2.81Å; E751-R786 IonicContact OE2-NH2 3.78Å; F754-R786 HydrophobicContact CB-CG 4.33Å; F754-R786 HydrophobicContact CD1-CG 3.72Å; F754-R786 HydrophobicContact CD2-CB 3.93Å; F754-R786 HydrophobicContact CD2-CG 3.42Å; F754-R786 VanDerWaalsContact CD2-CG 3.42Å; F754-R786 HydrophobicContact CE1-CG 3.86Å; F754-R786 HydrophobicContact CE2-CB 3.91Å; F754-R786 HydrophobicContact CE2-CG 3.56Å; F754-R786 HydrophobicContact CG-CB 4.48Å; F754-R786 HydrophobicContact CG-CG 3.52Å; F754-R786 HydrophobicContact CZ-CB 4.45Å; F754-R786 HydrophobicContact CZ-CG 3.78Å; W782-R786 HydrophobicContact CD2-CB 4.43Å; W782-R786 HydrophobicContact CE3-CB 4.03Å; W782-R786 HydrophobicContact CH2-CB 3.88Å; W782-R786 HydrophobicContact CH2-CG 3.54Å; W782-R786 HydrophobicContact CZ2-CB 4.33Å; W782-R786 HydrophobicContact CZ2-CG 4.18Å; W782-R786 HydrophobicContact CZ3-CB 3.73Å; W782-R786 HydrophobicContact CZ3-CG 3.78Å; W782-R786 VanDerWaalsContact O-CB 3.27Å; W782-R786 WeakPolarHBondContact O-CB 3.36Å; W782-R786 PolarHBondContact O-N 2.94Å; F783-R786 PolarHBondContact O-N 3.12Å; Q784-R786 VanDerWaalsContact C-N 3.32Å; Q784-R786 PolarHBondContact O-N 3.06Å; R786-K789 PolarHBondContact O-N 2.87Å; R786-Q790 PolarHBondContact O-N 3.41Å; R786-Q790 VanDerWaalsContact O-N 3.1Å
787	R	97.5	Very high	93.1	Very high	74 Å²	74	79 Å²	79	28%	0.279	36%	0.36	S	S	.	.	H	α-helix	trans	-63	-44.4	168.4	-72.5	-165	-68.4	-94.9	3.2	111.6	F754 R758 Y759 F783 Q784 K789 Q790 K791	F754-R787 HydrophobicContact CE2-CG 3.67Å; F754-R787 HydrophobicContact CZ-CG 3.99Å; R758-R787 WeakPolarHBondContact O-CD 3.05Å; R758-R787 PolarHBondContact O-NH1 3.22Å; Y759-R787 VanDerWaalsContact CE1-CD 3.49Å; F783-R787 WeakPolarHBondContact O-CG 3.37Å; F783-R787 PolarHBondContact O-N 3.36Å; Q784-R787 PolarHBondContact O-N 3.42Å; R787-K789 VanDerWaalsContact C-N 3.35Å; R787-K789 PolarHBondContact O-N 3.42Å; R787-Q790 WeakPolarHBondContact O-CB 3.22Å; R787-Q790 PolarHBondContact O-N 3.36Å; R787-K791 PolarHBondContact O-N 3.49Å
788	M	95.6	Very high	92	Very high	103 Å²	103	77 Å²	77	51%	0.507	35%	0.346	S	S	.	.	H	α-helix	trans	-63.1	-39.1	177.7	-69	-61.1	-75.2	0	0	112.4	Q784 N785 K791 K792	Q784-M788 WeakPolarHBondContact O-CG 3.38Å; Q784-M788 PolarHBondContact O-N 2.98Å; N785-M788 PolarHBondContact O-N 3.25Å; M788-K791 PolarHBondContact O-N 3.03Å; M788-K792 PolarHBondContact O-N 3.26Å
789	K	94.3	Very high	90.9	Very high	124 Å²	124	80.1 Å²	80.1	54%	0.539	36%	0.363	S	S	.	.	H	α-helix	trans	-63.4	-39.4	173.4	-165.5	175.3	-175.4	178.8	0	112	N785 R786 R787 K792 R793	N785-K789 PolarHBondContact O-N 3.3Å; R786-K789 PolarHBondContact O-N 2.87Å; R787-K789 VanDerWaalsContact C-N 3.35Å; R787-K789 PolarHBondContact O-N 3.42Å; K789-K792 PolarHBondContact O-N 2.99Å; K789-R793 WeakPolarHBondContact O-CG 3.38Å; K789-R793 PolarHBondContact O-N 3.35Å; K789-R793 VanDerWaalsContact O-N 3.09Å
790	Q	94.1	Very high	89.1	Confident	42 Å²	42	81.8 Å²	81.8	20%	0.196	38%	0.381	C	S	.	.	H	α-helix	trans	-63.4	-47.8	172.6	-177.4	173.9	-10.7	0	0	112	F754 R786 R787 K792 R793 I794	F754-Q790 VanDerWaalsContact CE1-OE1 3.22Å; F754-Q790 VanDerWaalsContact CZ-OE1 3.3Å; R786-Q790 PolarHBondContact O-N 3.41Å; R786-Q790 VanDerWaalsContact O-N 3.1Å; R787-Q790 WeakPolarHBondContact O-CB 3.22Å; R787-Q790 PolarHBondContact O-N 3.36Å; Q790-K792 PolarHBondContact O-N 3.33Å; Q790-R793 PolarHBondContact O-N 3.11Å; Q790-I794 HydrophobicContact CG-CD1 3.95Å; Q790-I794 WeakPolarHBondContact O-CG1 3.49Å; Q790-I794 PolarHBondContact O-N 3.39Å
791	K	92.8	Very high	87.2	Confident	98 Å²	98	79.4 Å²	79.4	43%	0.426	38%	0.379	S	S	.	.	H	α-helix	trans	-61.9	-26	176.8	-168.7	172.6	75	170.1	0	112.9	R787 M788 R795 W833	R787-K791 PolarHBondContact O-N 3.49Å; M788-K791 PolarHBondContact O-N 3.03Å; K791-R795 PolarHBondContact O-NE 3.4Å; K791-W833 HydrophobicContact CG-CH2 4.11Å; K791-W833 HydrophobicContact CG-CZ3 4.33Å
792	K	91.2	Very high	85.1	Confident	116 Å²	116	77.6 Å²	77.6	50%	0.504	37%	0.372	S	S	.	.	H	α-helix	trans	-71	-56.5	169.8	-160.8	-165.7	167.9	-177.9	0	111.1	M788 K789 Q790 I794 R795 D796	M788-K792 PolarHBondContact O-N 3.26Å; K789-K792 PolarHBondContact O-N 2.99Å; Q790-K792 PolarHBondContact O-N 3.33Å; K792-I794 PolarHBondContact O-N 2.92Å; K792-I794 VanDerWaalsContact O-N 3.1Å; K792-R795 PolarHBondContact O-N 3.46Å; K792-D796 WeakPolarHBondContact CE-OD2 3.42Å; K792-D796 WeakPolarHBondContact CG-OD2 3.14Å; K792-D796 VanDerWaalsContact O-CG 3.25Å; K792-D796 PolarHBondContact O-N 3.22Å
793	R	88.8	Confident	83	Confident	110 Å²	110	83.6 Å²	83.6	42%	0.415	40%	0.395	S	S	.	.	H	α-helix	trans	-54	-34.6	-179.9	-67.6	-177.2	-171.9	126	-19.9	113.9	K789 Q790 K797	K789-R793 WeakPolarHBondContact O-CG 3.38Å; K789-R793 PolarHBondContact O-N 3.35Å; K789-R793 VanDerWaalsContact O-N 3.09Å; Q790-R793 PolarHBondContact O-N 3.11Å; R793-K797 WeakPolarHBondContact O-CG 3.27Å; R793-K797 PolarHBondContact O-N 2.9Å
794	I	86.5	Confident	80.7	Confident	44 Å²	44	90.5 Å²	90.5	23%	0.226	43%	0.427	C	S	.	.	H	α-helix	trans	-66.5	-45.1	176.4	-67.5	167.7	0	0	0	111	Q790 K792 K797 I798 I836	Q790-I794 HydrophobicContact CG-CD1 3.95Å; Q790-I794 WeakPolarHBondContact O-CG1 3.49Å; Q790-I794 PolarHBondContact O-N 3.39Å; K792-I794 PolarHBondContact O-N 2.92Å; K792-I794 VanDerWaalsContact O-N 3.1Å; I794-K797 PolarHBondContact O-N 2.88Å; I794-I798 HydrophobicContact CG2-CD1 4.06Å; I794-I798 WeakPolarHBondContact O-CG1 3.38Å; I794-I798 PolarHBondContact O-N 3.29Å; I794-I798 VanDerWaalsContact O-N 3.12Å; I794-I836 HydrophobicContact CG2-CD1 4.07Å
795	R	82.9	Confident	78.3	Confident	117 Å²	117	92.9 Å²	92.9	44%	0.442	44%	0.438	S	S	.	.	H	α-helix	trans	-65.4	-42.6	175.6	-73.3	177.8	-68.5	140.2	-2.4	112.1	K791 K792 K797 I798 L799 W833	K791-R795 PolarHBondContact O-NE 3.4Å; K792-R795 PolarHBondContact O-N 3.46Å; R795-K797 PolarHBondContact O-N 3.45Å; R795-I798 PolarHBondContact O-N 3.46Å; R795-L799 WeakPolarHBondContact O-CB 3.32Å; R795-L799 PolarHBondContact O-N 3.43Å; R795-W833 HydrophobicContact CG-CH2 3.94Å; R795-W833 HydrophobicContact CG-CZ2 3.81Å
796	D	81.8	Confident	76.1	Confident	78 Å²	78	94 Å²	94	42%	0.417	44%	0.442	S	S	.	.	H	α-helix	trans	-62.2	-34.2	178.7	-56.5	-18.3	0	0	0	110.9	K792 G800	K792-D796 WeakPolarHBondContact CE-OD2 3.42Å; K792-D796 WeakPolarHBondContact CG-OD2 3.14Å; K792-D796 VanDerWaalsContact O-CG 3.25Å; K792-D796 PolarHBondContact O-N 3.22Å; D796-G800 PolarHBondContact O-N 2.99Å
797	K	77.5	Confident	73.7	Confident	163 Å²	163	100.1 Å²	100.1	71%	0.709	47%	0.472	S	S	*	.	H	α-helix	trans	-69.2	-44	172.7	-78.7	-174.5	174.4	-159.7	0	113.6	R793 I794 R795 L799 G800 S801	R793-K797 WeakPolarHBondContact O-CG 3.27Å; R793-K797 PolarHBondContact O-N 2.9Å; I794-K797 PolarHBondContact O-N 2.88Å; R795-K797 PolarHBondContact O-N 3.45Å; K797-L799 VanDerWaalsContact C-N 3.29Å; K797-L799 PolarHBondContact O-N 3.49Å; K797-G800 PolarHBondContact O-N 3.24Å; K797-S801 PolarHBondContact O-N 3.28Å; K797-S801 PolarHBondContact O-OG 3.04Å
798	I	75.4	Confident	71.2	Confident	49 Å²	49	104.9 Å²	104.9	25%	0.251	50%	0.497	S	S	.	.	H	α-helix	trans	-62	-40	178	-67.8	164.4	0	0	0	110.6	I794 R795 S801 T802 I829	I794-I798 HydrophobicContact CG2-CD1 4.06Å; I794-I798 WeakPolarHBondContact O-CG1 3.38Å; I794-I798 PolarHBondContact O-N 3.29Å; I794-I798 VanDerWaalsContact O-N 3.12Å; R795-I798 PolarHBondContact O-N 3.46Å; I798-S801 PolarHBondContact O-OG 3.25Å; I798-T802 PolarHBondContact O-OG1 3.22Å; I798-I829 HydrophobicContact CG2-CD1 4.47Å; I798-I829 HydrophobicContact CG2-CG1 4.1Å
799	L	71.9	Confident	68.6	Low	105 Å²	105	106.7 Å²	106.7	55%	0.55	51%	0.509	S	S	.	.	H	α-helix	trans	-76.8	-35.6	178.3	-163.1	65.9	0	0	0	112	R795 K797 T802 Y803	R795-L799 WeakPolarHBondContact O-CB 3.32Å; R795-L799 PolarHBondContact O-N 3.43Å; K797-L799 VanDerWaalsContact C-N 3.29Å; K797-L799 PolarHBondContact O-N 3.49Å; L799-T802 PolarHBondContact O-OG1 2.7Å; L799-Y803 HydrophobicContact CD1-CE2 4.27Å; L799-Y803 HydrophobicContact CG-CE2 4.06Å; L799-Y803 WeakPolarHBondContact O-CD2 3.39Å
800	G	61.1	Low	66.2	Low	36 Å²	36	106.1 Å²	106.1	37%	0.371	52%	0.516	S	S	.	.	H	α-helix	trans	-67.5	-38.2	177.1	0	0	0	0	0	114	D796 K797 T802 Y803 H804	D796-G800 PolarHBondContact O-N 2.99Å; K797-G800 PolarHBondContact O-N 3.24Å; G800-T802 VanDerWaalsContact C-N 3.31Å; G800-T802 PolarHBondContact O-N 3.34Å; G800-Y803 PolarHBondContact O-N 3.4Å; G800-H804 PolarHBondContact O-N 3.35Å
801	S	55.7	Low	63.5	Low	68 Å²	68	110.4 Å²	110.4	48%	0.476	55%	0.545	S	S	.	.	H	α-helix	trans	-66.3	-33.1	178.1	63.6	0	0	0	0	112.5	K797 I798 Y803 H804 E805	K797-S801 PolarHBondContact O-N 3.28Å; K797-S801 PolarHBondContact O-OG 3.04Å; I798-S801 PolarHBondContact O-OG 3.25Å; S801-Y803 VanDerWaalsContact C-N 3.27Å; S801-Y803 PolarHBondContact O-N 3.46Å; S801-H804 PolarHBondContact O-N 2.98Å; S801-E805 PolarHBondContact O-N 2.89Å
802	T	52.5	Low	61	Low	43 Å²	43	110.7 Å²	110.7	26%	0.264	56%	0.559	S	S	.	*	H	α-helix	trans	-67.3	-23.1	176.4	39.8	0	0	0	0	114.1	I798 L799 G800 M806 L825	I798-T802 PolarHBondContact O-OG1 3.22Å; L799-T802 PolarHBondContact O-OG1 2.7Å; G800-T802 VanDerWaalsContact C-N 3.31Å; G800-T802 PolarHBondContact O-N 3.34Å; T802-M806 WeakPolarHBondContact O-CE 3.01Å; T802-L825 HydrophobicContact CG2-CD2 4Å
803	Y	53.1	Low	58.7	Low	152 Å²	152	112.9 Å²	112.9	60%	0.596	58%	0.575	S	S	*	*	H	α-helix	trans	-86.1	-31.7	176.6	-71.7	-68.1	0	0	0	113.1	L799 G800 S801 M806	L799-Y803 HydrophobicContact CD1-CE2 4.27Å; L799-Y803 HydrophobicContact CG-CE2 4.06Å; L799-Y803 WeakPolarHBondContact O-CD2 3.39Å; G800-Y803 PolarHBondContact O-N 3.4Å; S801-Y803 VanDerWaalsContact C-N 3.27Å; S801-Y803 PolarHBondContact O-N 3.46Å; Y803-M806 HydrophobicContact CD1-CE 4.21Å; Y803-M806 HydrophobicContact CE1-CE 4.46Å
804	H	50.8	Low	56.1	Low	149 Å²	149	113.3 Å²	113.3	69%	0.69	59%	0.59	S	S	*	*	H	α-helix	trans	-77.7	-19.9	179.4	-113.1	-66.7	0	0	0	114.7	G800 S801	G800-H804 PolarHBondContact O-N 3.35Å; S801-H804 PolarHBondContact O-N 2.98Å
805	E	47.2	Very low	53.8	Low	155 Å²	155	117.4 Å²	117.4	72%	0.724	62%	0.617	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83	-7.9	175.6	-96.9	-179	157.8	0	0	114.3	S801	S801-E805 PolarHBondContact O-N 2.89Å
806	M	49.7	Very low	52	Low	124 Å²	124	117.3 Å²	117.3	61%	0.611	64%	0.635	S	S	*	*	S	Bend	trans	-98.1	-8.3	-178.8	-71.3	-166.2	-81.4	0	0	114.5	T802 Y803	T802-M806 WeakPolarHBondContact O-CE 3.01Å; Y803-M806 HydrophobicContact CD1-CE 4.21Å; Y803-M806 HydrophobicContact CE1-CE 4.46Å
807	E	46.8	Very low	50.4	Low	152 Å²	152	119.2 Å²	119.2	71%	0.71	65%	0.651	S	S	*	*	S	Bend	trans	-106.2	-15.4	-169.6	-149.4	164.2	-150.8	0	0	114.3
808	E	45.8	Very low	48.8	Very low	174 Å²	174	116.4 Å²	116.4	81%	0.813	65%	0.65	S	S	*	*	S	Bend	trans	-100.2	-4.1	179.6	-99.3	-173.6	154.7	0	0	115.4
809	N	41.7	Very low	47.1	Very low	141 Å²	141	119.7 Å²	119.7	75%	0.754	68%	0.677	S	S	*	*	S	Bend	trans	-108.4	4.7	-177.5	-84.8	-32.7	0	0	0	114.9	T811	N809-T811 VanDerWaalsContact C-N 3.31Å; N809-T811 PolarHBondContact O-N 2.59Å; N809-T811 VanDerWaalsContact O-N 3.13Å
810	T	42.5	Very low	45.7	Very low	112 Å²	112	119.4 Å²	119.4	69%	0.687	68%	0.684	S	S	*	*			trans	-89.2	51.9	-176.4	54.8	0	0	0	0	113.7
811	T	38.7	Very low	45	Very low	133 Å²	133	122.9 Å²	122.9	82%	0.816	69%	0.693	S	S	*	*	S	Bend	trans	-139.9	26.6	177.7	-4.2	0	0	0	0	115	N809	N809-T811 VanDerWaalsContact C-N 3.31Å; N809-T811 PolarHBondContact O-N 2.59Å; N809-T811 VanDerWaalsContact O-N 3.13Å
812	S	39.7	Very low	44.5	Very low	103 Å²	103	123.4 Å²	123.4	72%	0.72	70%	0.697	S	S	*	*	S	Bend	trans	-167.2	157.3	153.7	51.7	0	0	0	0	113.5
813	I	42.3	Very low	44.1	Very low	162 Å²	162	127.1 Å²	127.1	83%	0.831	72%	0.715	S	S	*	*			trans	77	102.1	170.5	-50.2	177.5	0	0	0	115.9
814	T	35.2	Very low	43.8	Very low	119 Å²	119	125 Å²	125	73%	0.73	71%	0.714	S	S	*	*			trans	-80.5	165.1	166.4	42.8	0	0	0	0	112.4
815	T	37.3	Very low	43.5	Very low	131 Å²	131	121.6 Å²	121.6	80%	0.804	70%	0.7	S	S	*	*			trans	86.4	134.1	168.3	74.8	0	0	0	0	118.4
816	S	45.8	Very low	43.3	Very low	115 Å²	115	118.9 Å²	118.9	80%	0.804	69%	0.691	S	S	*	*			trans	77.8	132.6	-179.1	76.1	0	0	0	0	117.9
817	P	47.2	Very low	43.3	Very low	118 Å²	118	117.5 Å²	117.5	77%	0.766	69%	0.686	S	S	*	*			trans	-94	132.9	-178.5	34.9	-32.3	0	0	0	113.2	S819	P817-S819 PolarHBondContact O-N 3.28Å
818	P	45	Very low	43.6	Very low	104 Å²	104	116.9 Å²	116.9	68%	0.675	68%	0.68	S	S	*	*			trans	-92.5	86	178.3	34.3	-32.7	0	0	0	112.9	S820	P818-S820 PolarHBondContact O-N 3.07Å
819	S	39.6	Very low	43.9	Very low	117 Å²	117	111 Å²	111	82%	0.818	65%	0.654	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86	73.6	176	52.3	0	0	0	0	113.2	P817	P817-S819 PolarHBondContact O-N 3.28Å
820	S	42.1	Very low	44	Very low	100 Å²	100	109.1 Å²	109.1	70%	0.699	64%	0.644	S	S	*	*	T	Hydrogen-bonded Turn	trans	-162	4.2	176.3	50.4	0	0	0	0	118.5	P818	P818-S820 PolarHBondContact O-N 3.07Å
821	I	46.1	Very low	44.2	Very low	108 Å²	108	109.7 Å²	109.7	55%	0.554	64%	0.639	S	S	*	*			trans	-86.3	-20.7	-165.8	-61.9	175.2	0	0	0	114.9	N823 N824 L825	I821-N823 PolarHBondContact O-N 2.72Å; I821-N824 PolarHBondContact O-N 3.11Å; I821-L825 HydrophobicContact CG2-CD1 4.48Å
822	S	45	Very low	44.7	Very low	80 Å²	80	104.9 Å²	104.9	56%	0.559	61%	0.611	S	S	*	*	H	α-helix	trans	-61	-35.1	-171.2	58.4	0	0	0	0	115.3	N824	S822-N824 PolarHBondContact O-N 2.63Å
823	N	45.3	Very low	44.8	Very low	121 Å²	121	103.9 Å²	103.9	65%	0.647	59%	0.591	S	S	*	*	H	α-helix	trans	-83.2	-15.5	-169.3	-64.6	1.1	0	0	0	113	I821	I821-N823 PolarHBondContact O-N 2.72Å
824	N	45.5	Very low	44.8	Very low	107 Å²	107	101.9 Å²	101.9	57%	0.572	57%	0.574	S	S	*	*	H	α-helix	trans	-83.4	-30.7	179.2	-146.2	-40.6	0	0	0	111.9	I821 S822 N827 K828	I821-N824 PolarHBondContact O-N 3.11Å; S822-N824 PolarHBondContact O-N 2.63Å; N824-N827 PolarHBondContact O-N 2.58Å; N824-K828 PolarHBondContact O-N 2.86Å
825	L	44.3	Very low	45.5	Very low	77 Å²	77	100.9 Å²	100.9	40%	0.403	56%	0.564	S	S	.	*	H	α-helix	trans	-63.9	-46.5	176.8	-80.1	159	0	0	0	112.4	T802 I821 N827 K828 I829	T802-L825 HydrophobicContact CG2-CD2 4Å; I821-L825 HydrophobicContact CG2-CD1 4.48Å; L825-N827 VanDerWaalsContact C-N 3.32Å; L825-N827 PolarHBondContact O-N 3.33Å; L825-K828 PolarHBondContact O-N 3.5Å; L825-I829 WeakPolarHBondContact O-CB 3.07Å; L825-I829 VanDerWaalsContact O-CG1 3.26Å; L825-I829 WeakPolarHBondContact O-CG1 2.98Å; L825-I829 PolarHBondContact O-N 3.04Å
826	N	44	Very low	46.1	Very low	99 Å²	99	97 Å²	97	53%	0.529	54%	0.538	S	S	.	.	H	α-helix	trans	-62.3	-38	178.7	-75.5	-23.6	0	0	0	112.4	I829 N830	N826-I829 PolarHBondContact O-N 3.08Å; N826-N830 WeakPolarHBondContact O-CB 3.38Å; N826-N830 VanDerWaalsContact O-CG 3.29Å; N826-N830 PolarHBondContact O-N 3.13Å; N826-N830 PolarHBondContact O-ND2 3.31Å
827	N	48.8	Very low	46	Very low	94 Å²	94	94.6 Å²	94.6	50%	0.503	52%	0.521	S	S	.	.	H	α-helix	trans	-69.7	-41.4	176.1	-76.1	-13.6	0	0	0	112.5	N824 L825 I829 N830 Q831	N824-N827 PolarHBondContact O-N 2.58Å; L825-N827 VanDerWaalsContact C-N 3.32Å; L825-N827 PolarHBondContact O-N 3.33Å; N827-I829 VanDerWaalsContact C-N 3.34Å; N827-I829 PolarHBondContact O-N 3.37Å; N827-N830 PolarHBondContact O-N 3.34Å; N827-Q831 WeakPolarHBondContact O-CB 3.11Å; N827-Q831 VanDerWaalsContact O-CG 3.28Å; N827-Q831 WeakPolarHBondContact O-CG 3.33Å; N827-Q831 PolarHBondContact O-N 2.65Å
828	K	52.9	Low	45.9	Very low	139 Å²	139	89.6 Å²	89.6	60%	0.604	49%	0.489	S	S	*	.	H	α-helix	trans	-61	-41.3	172.1	-79.1	-173.9	174.8	-175.2	0	112.3	N824 L825 S832	N824-K828 PolarHBondContact O-N 2.86Å; L825-K828 PolarHBondContact O-N 3.5Å; K828-S832 WeakPolarHBondContact O-CB 3.44Å; K828-S832 PolarHBondContact O-N 2.98Å
829	I	51.8	Low	45.8	Very low	52 Å²	52	90.1 Å²	90.1	27%	0.267	48%	0.482	S	S	.	.	H	α-helix	trans	-61.4	-50	175.9	-70.4	165.8	0	0	0	110	I798 L825 N826 N827 Q831 S832 W833	I798-I829 HydrophobicContact CG2-CD1 4.47Å; I798-I829 HydrophobicContact CG2-CG1 4.1Å; L825-I829 WeakPolarHBondContact O-CB 3.07Å; L825-I829 VanDerWaalsContact O-CG1 3.26Å; L825-I829 WeakPolarHBondContact O-CG1 2.98Å; L825-I829 PolarHBondContact O-N 3.04Å; N826-I829 PolarHBondContact O-N 3.08Å; N827-I829 VanDerWaalsContact C-N 3.34Å; N827-I829 PolarHBondContact O-N 3.37Å; I829-Q831 PolarHBondContact O-N 3.39Å; I829-S832 PolarHBondContact O-N 3.18Å; I829-S832 PolarHBondContact O-OG 3.1Å; I829-W833 PolarHBondContact O-N 3.44Å
830	N	45.5	Very low	46	Very low	101 Å²	101	86.4 Å²	86.4	54%	0.54	46%	0.455	S	S	.	.	H	α-helix	trans	-63.1	-41.5	179.7	-71.5	-17.6	0	0	0	113	N826 N827 S832 W833 Y834	N826-N830 WeakPolarHBondContact O-CB 3.38Å; N826-N830 VanDerWaalsContact O-CG 3.29Å; N826-N830 PolarHBondContact O-N 3.13Å; N826-N830 PolarHBondContact O-ND2 3.31Å; N827-N830 PolarHBondContact O-N 3.34Å; N830-S832 VanDerWaalsContact C-N 3.34Å; N830-S832 PolarHBondContact O-N 3.49Å; N830-W833 PolarHBondContact O-N 3.36Å; N830-Y834 PolarHBondContact O-N 3.06Å
831	Q	46.2	Very low	45.8	Very low	124 Å²	124	86.2 Å²	86.2	58%	0.579	44%	0.441	S	S	*	.	H	α-helix	trans	-62.6	-40.5	173.6	-71.6	170.4	6.4	0	0	111.7	N827 I829 W833 Y834 L835	N827-Q831 WeakPolarHBondContact O-CB 3.11Å; N827-Q831 VanDerWaalsContact O-CG 3.28Å; N827-Q831 WeakPolarHBondContact O-CG 3.33Å; N827-Q831 PolarHBondContact O-N 2.65Å; I829-Q831 PolarHBondContact O-N 3.39Å; Q831-W833 PolarHBondContact O-N 2.98Å; Q831-Y834 PolarHBondContact O-N 3.38Å; Q831-L835 PolarHBondContact O-N 3.45Å
832	S	48.5	Very low	45.4	Very low	31 Å²	31	85.5 Å²	85.5	22%	0.217	44%	0.439	C	S	.	.	H	α-helix	trans	-64.1	-37.3	175.8	79.7	0	0	0	0	112.7	K828 I829 N830 Y834 L835 I836	K828-S832 WeakPolarHBondContact O-CB 3.44Å; K828-S832 PolarHBondContact O-N 2.98Å; I829-S832 PolarHBondContact O-N 3.18Å; I829-S832 PolarHBondContact O-OG 3.1Å; N830-S832 VanDerWaalsContact C-N 3.34Å; N830-S832 PolarHBondContact O-N 3.49Å; S832-Y834 VanDerWaalsContact C-N 3.32Å; S832-Y834 PolarHBondContact O-N 3.42Å; S832-L835 PolarHBondContact O-N 3.35Å; S832-I836 VanDerWaalsContact O-CB 3.3Å; S832-I836 WeakPolarHBondContact O-CB 3.47Å; S832-I836 WeakPolarHBondContact O-CD1 3.21Å; S832-I836 WeakPolarHBondContact O-CG1 3.28Å; S832-I836 PolarHBondContact O-N 3.39Å
833	W	43.3	Very low	45.3	Very low	83 Å²	83	86.2 Å²	86.2	31%	0.314	44%	0.436	S	S	.	.	H	α-helix	trans	-62.9	-38.2	175.6	-76	114.5	0	0	0	112.3	K791 R795 I829 N830 Q831 S837	K791-W833 HydrophobicContact CG-CH2 4.11Å; K791-W833 HydrophobicContact CG-CZ3 4.33Å; R795-W833 HydrophobicContact CG-CH2 3.94Å; R795-W833 HydrophobicContact CG-CZ2 3.81Å; I829-W833 PolarHBondContact O-N 3.44Å; N830-W833 PolarHBondContact O-N 3.36Å; Q831-W833 PolarHBondContact O-N 2.98Å; W833-S837 WeakPolarHBondContact O-CB 3.46Å; W833-S837 PolarHBondContact O-N 2.99Å; W833-S837 PolarHBondContact O-OG 2.76Å
834	Y	41.9	Very low	45.2	Very low	119 Å²	119	83.6 Å²	83.6	47%	0.467	42%	0.42	S	S	.	.	H	α-helix	trans	-70.1	-45.9	178.5	-139.8	-113	0	0	0	111.6	I75 N830 Q831 S832 S837 S838	I75-Y834 HydrophobicContact CB-CD1 4.12Å; I75-Y834 HydrophobicContact CB-CE1 3.67Å; I75-Y834 HydrophobicContact CD1-CD1 3.57Å; I75-Y834 HydrophobicContact CD1-CE1 4.05Å; I75-Y834 HydrophobicContact CG1-CD1 4.41Å; I75-Y834 HydrophobicContact CG1-CE1 4.44Å; I75-Y834 HydrophobicContact CG2-CD1 3.73Å; I75-Y834 HydrophobicContact CG2-CE1 3.28Å; N830-Y834 PolarHBondContact O-N 3.06Å; Q831-Y834 PolarHBondContact O-N 3.38Å; S832-Y834 VanDerWaalsContact C-N 3.32Å; S832-Y834 PolarHBondContact O-N 3.42Å; Y834-S837 PolarHBondContact O-N 3.41Å; Y834-S838 WeakPolarHBondContact O-CB 3.11Å; Y834-S838 PolarHBondContact O-N 2.59Å; Y834-S838 VanDerWaalsContact O-N 3.08Å; Y834-S838 PolarHBondContact O-OG 2.63Å
835	L	50.1	Low	44.8	Very low	99 Å²	99	84.3 Å²	84.3	52%	0.518	42%	0.423	S	S	.	.	H	α-helix	trans	-61.4	-45.7	175.4	-72.4	168.5	0	0	0	112.3	Q831 S832 S837 S838 Q839	Q831-L835 PolarHBondContact O-N 3.45Å; S832-L835 PolarHBondContact O-N 3.35Å; L835-S837 PolarHBondContact O-N 3.25Å; L835-S838 PolarHBondContact O-N 2.88Å; L835-Q839 WeakPolarHBondContact O-CB 3.31Å; L835-Q839 WeakPolarHBondContact O-CG 3.44Å; L835-Q839 PolarHBondContact O-N 2.76Å
836	I	49.8	Very low	44.6	Very low	49 Å²	49	83.2 Å²	83.2	25%	0.251	42%	0.422	S	S	.	.	H	α-helix	trans	-62.4	-43.4	177.9	-70.4	165.9	0	0	0	110.8	I794 S832 S838 Q839 T840	I794-I836 HydrophobicContact CG2-CD1 4.07Å; S832-I836 VanDerWaalsContact O-CB 3.3Å; S832-I836 WeakPolarHBondContact O-CB 3.47Å; S832-I836 WeakPolarHBondContact O-CD1 3.21Å; S832-I836 WeakPolarHBondContact O-CG1 3.28Å; S832-I836 PolarHBondContact O-N 3.39Å; I836-S838 VanDerWaalsContact C-N 3.3Å; I836-S838 PolarHBondContact O-N 3.11Å; I836-Q839 PolarHBondContact O-N 3.09Å; I836-T840 WeakPolarHBondContact O-CG2 3.31Å; I836-T840 PolarHBondContact O-N 3.5Å
837	S	42.7	Very low	44.5	Very low	65 Å²	65	81.9 Å²	81.9	46%	0.455	41%	0.414	S	S	.	.	H	α-helix	trans	-61	-42.2	178.9	-58.8	0	0	0	0	111.2	W833 Y834 L835 T840 F841	W833-S837 WeakPolarHBondContact O-CB 3.46Å; W833-S837 PolarHBondContact O-N 2.99Å; W833-S837 PolarHBondContact O-OG 2.76Å; Y834-S837 PolarHBondContact O-N 3.41Å; L835-S837 PolarHBondContact O-N 3.25Å; S837-T840 PolarHBondContact O-N 2.88Å; S837-T840 VanDerWaalsContact O-N 3.12Å; S837-T840 PolarHBondContact O-OG1 3.37Å; S837-F841 PolarHBondContact O-N 2.77Å
838	S	44.7	Very low	44.1	Very low	13 Å²	13	84.2 Å²	84.2	9%	0.091	42%	0.422	C	S	.	.	H	α-helix	trans	-70	-42.8	-179.3	-49.5	0	0	0	0	112.6	I75 Y834 L835 I836 T840 F841 N842	I75-S838 WeakPolarHBondContact CD1-OG 3.46Å; I75-S838 WeakPolarHBondContact CG1-OG 3.37Å; I75-S838 WeakPolarHBondContact CG2-OG 3.24Å; Y834-S838 WeakPolarHBondContact O-CB 3.11Å; Y834-S838 PolarHBondContact O-N 2.59Å; Y834-S838 VanDerWaalsContact O-N 3.08Å; Y834-S838 PolarHBondContact O-OG 2.63Å; L835-S838 PolarHBondContact O-N 2.88Å; I836-S838 VanDerWaalsContact C-N 3.3Å; I836-S838 PolarHBondContact O-N 3.11Å; S838-T840 PolarHBondContact O-N 3.23Å; S838-F841 PolarHBondContact O-N 3.45Å; S838-N842 PolarHBondContact O-N 3.04Å
839	Q	43.2	Very low	43.4	Very low	114 Å²	114	83.8 Å²	83.8	53%	0.533	42%	0.422	S	S	.	.	H	α-helix	trans	-64.2	-20.8	171	-71.7	172.9	-14.2	0	0	112.5	L835 I836 N843	L835-Q839 WeakPolarHBondContact O-CB 3.31Å; L835-Q839 WeakPolarHBondContact O-CG 3.44Å; L835-Q839 PolarHBondContact O-N 2.76Å; I836-Q839 PolarHBondContact O-N 3.09Å; Q839-N843 WeakPolarHBondContact O-CB 2.99Å; Q839-N843 PolarHBondContact O-ND2 3.48Å
840	T	44.2	Very low	42.7	Very low	40 Å²	40	85.8 Å²	85.8	25%	0.245	43%	0.434	C	S	.	.	H	α-helix	trans	-79.6	-25.8	170.8	68.9	0	0	0	0	114	I836 S837 S838	I836-T840 WeakPolarHBondContact O-CG2 3.31Å; I836-T840 PolarHBondContact O-N 3.5Å; S837-T840 PolarHBondContact O-N 2.88Å; S837-T840 VanDerWaalsContact O-N 3.12Å; S837-T840 PolarHBondContact O-OG1 3.37Å; S838-T840 PolarHBondContact O-N 3.23Å
841	F	38.3	Very low	42.5	Very low	96 Å²	96	87.3 Å²	87.3	42%	0.421	44%	0.435	S	S	.	.	H	α-helix	trans	-85.1	-48	-179.6	-153.5	-101.4	0	0	0	111.2	S837 S838 N843 Q844 L845	S837-F841 PolarHBondContact O-N 2.77Å; S838-F841 PolarHBondContact O-N 3.45Å; F841-N843 VanDerWaalsContact C-N 3.28Å; F841-N843 PolarHBondContact O-N 3.03Å; F841-Q844 PolarHBondContact O-N 3.2Å; F841-L845 PolarHBondContact O-N 3.36Å
842	N	37.9	Very low	42.1	Very low	92 Å²	92	88.7 Å²	88.7	49%	0.492	44%	0.442	S	S	.	.	H	α-helix	trans	-65.4	-29.7	-178.9	-65.5	-6.8	0	0	0	112.9	S838 Q844 S846	S838-N842 PolarHBondContact O-N 3.04Å; N842-Q844 VanDerWaalsContact C-N 3.29Å; N842-Q844 PolarHBondContact O-N 2.75Å; N842-S846 VanDerWaalsContact O-CB 3.29Å; N842-S846 WeakPolarHBondContact O-CB 3.15Å; N842-S846 PolarHBondContact O-N 2.78Å
843	N	41.3	Very low	41.3	Very low	95 Å²	95	91.2 Å²	91.2	51%	0.508	45%	0.453	S	S	.	.	H	α-helix	trans	-75.9	-9.4	173.9	-80.5	-51.9	0	0	0	114.1	Q839 F841 L847	Q839-N843 WeakPolarHBondContact O-CB 2.99Å; Q839-N843 PolarHBondContact O-ND2 3.48Å; F841-N843 VanDerWaalsContact C-N 3.28Å; F841-N843 PolarHBondContact O-N 3.03Å; N843-L847 WeakPolarHBondContact O-CD1 3.16Å
844	Q	43.4	Very low	40.7	Very low	67 Å²	67	91.3 Å²	91.3	31%	0.313	47%	0.466	S	S	.	.	H	α-helix	trans	-86.1	-41.9	169.4	-72.3	-174.3	-65.6	0	0	111	N757 F841 N842 L847	N757-Q844 PolarHBondContact OD1-NE2 2.59Å; F841-Q844 PolarHBondContact O-N 3.2Å; N842-Q844 VanDerWaalsContact C-N 3.29Å; N842-Q844 PolarHBondContact O-N 2.75Å; Q844-L847 PolarHBondContact O-N 3.33Å
845	L	38.8	Very low	40.3	Very low	122 Å²	122	94.2 Å²	94.2	64%	0.639	48%	0.483	S	S	*	.	H	α-helix	trans	-65	-43.3	175.9	-136.6	70.3	0	0	0	111.9	F841 L847 E848	F841-L845 PolarHBondContact O-N 3.36Å; L845-L847 VanDerWaalsContact C-N 3.28Å; L845-L847 PolarHBondContact O-N 3.29Å; L845-E848 PolarHBondContact O-N 3.49Å
846	S	39.3	Very low	39.7	Very low	53 Å²	53	95.7 Å²	95.7	37%	0.371	49%	0.491	S	S	.	.	H	α-helix	trans	-70.1	-15.8	-178.2	-169.4	0	0	0	0	114.6	N842 N850	N842-S846 VanDerWaalsContact O-CB 3.29Å; N842-S846 WeakPolarHBondContact O-CB 3.15Å; N842-S846 PolarHBondContact O-N 2.78Å; S846-N850 WeakPolarHBondContact O-CB 3.28Å; S846-N850 PolarHBondContact O-ND2 2.83Å; S846-N850 PolarHBondContact OG-ND2 3.36Å
847	L	42.6	Very low	38.8	Very low	71 Å²	71	98.9 Å²	98.9	37%	0.372	51%	0.508	S	S	.	.	H	α-helix	trans	-92.1	-14.1	178.5	-103.1	85.7	0	0	0	114.8	F756 N843 Q844 L845	F756-L847 HydrophobicContact CD2-CD2 4.14Å; F756-L847 HydrophobicContact CE2-CD2 4.01Å; N843-L847 WeakPolarHBondContact O-CD1 3.16Å; Q844-L847 PolarHBondContact O-N 3.33Å; L845-L847 VanDerWaalsContact C-N 3.28Å; L845-L847 PolarHBondContact O-N 3.29Å
848	E	39.6	Very low	38.3	Very low	143 Å²	143	103.6 Å²	103.6	67%	0.668	53%	0.528	S	S	*	.	H	α-helix	trans	-93.4	-31.6	176.7	-77.8	177.3	148.9	0	0	112.3	L845	L845-E848 PolarHBondContact O-N 3.49Å
849	E	38.3	Very low	37.8	Very low	130 Å²	130	109.7 Å²	109.7	61%	0.607	56%	0.56	S	S	*	*	H	α-helix	trans	-73.9	-42.3	171	-65.1	-176.1	143.7	0	0	111.9	K851 Q852 L853	E849-K851 PolarHBondContact O-N 3.2Å; E849-K851 VanDerWaalsContact O-N 3.13Å; E849-Q852 PolarHBondContact O-N 3.13Å; E849-Q852 VanDerWaalsContact O-N 3.09Å; E849-L853 WeakPolarHBondContact O-CD1 3.32Å; E849-L853 PolarHBondContact O-N 3.23Å
850	N	37.5	Very low	37.3	Very low	95 Å²	95	112.1 Å²	112.1	51%	0.508	58%	0.575	S	S	.	*	T	Hydrogen-bonded Turn	trans	-75.8	2.3	-179.5	-70.7	-57.4	0	0	0	115.1	S846	S846-N850 WeakPolarHBondContact O-CB 3.28Å; S846-N850 PolarHBondContact O-ND2 2.83Å; S846-N850 PolarHBondContact OG-ND2 3.36Å
851	K	41.1	Very low	36.7	Very low	132 Å²	132	117.7 Å²	117.7	57%	0.574	60%	0.601	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.5	-8	166.9	-82	-172.1	170.8	-170.5	0	114.2	F756 E849	F756-K851 HydrophobicContact CE2-CD 4.33Å; E849-K851 PolarHBondContact O-N 3.2Å; E849-K851 VanDerWaalsContact O-N 3.13Å
852	Q	36.9	Very low	36.3	Very low	153 Å²	153	118.6 Å²	118.6	72%	0.715	62%	0.615	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.9	-21.8	167.7	-60.7	-158.4	19.3	0	0	112.5	E849	E849-Q852 PolarHBondContact O-N 3.13Å; E849-Q852 VanDerWaalsContact O-N 3.09Å
853	L	31.7	Very low	36	Very low	85 Å²	85	121.5 Å²	121.5	45%	0.445	63%	0.63	S	S	.	*	G	3₁₀ helix	trans	-83	-6.4	175.8	-90.3	77.4	0	0	0	115.5	E849 H855	E849-L853 WeakPolarHBondContact O-CD1 3.32Å; E849-L853 PolarHBondContact O-N 3.23Å; L853-H855 VanDerWaalsContact C-N 3.26Å; L853-H855 PolarHBondContact O-N 3.24Å
854	S	30.8	Very low	35.4	Very low	85 Å²	85	123.3 Å²	123.3	59%	0.594	64%	0.639	S	S	*	*	G	3₁₀ helix	trans	-84.2	10.3	176.1	74.6	0	0	0	0	114.7
855	H	34.4	Very low	34.8	Very low	179 Å²	179	126.1 Å²	126.1	83%	0.829	66%	0.656	S	S	*	*	G	3₁₀ helix	trans	-134.2	9.7	174.5	-86.5	-57.3	0	0	0	114.1	L853	L853-H855 VanDerWaalsContact C-N 3.26Å; L853-H855 PolarHBondContact O-N 3.24Å
856	I	36.7	Very low	34.4	Very low	131 Å²	131	126.7 Å²	126.7	67%	0.672	66%	0.66	S	S	*	*	T	Hydrogen-bonded Turn	trans	-129	-9.8	-175.2	-64.5	-177.7	0	0	0	113.7
857	N	30.3	Very low	33.8	Very low	115 Å²	115	130.5 Å²	130.5	62%	0.615	68%	0.676	S	S	*	*			trans	-101.8	22.2	-171.4	-89.6	5.7	0	0	0	117.3	N859	N857-N859 VanDerWaalsContact C-N 3.31Å
858	D	33.1	Very low	33.2	Very low	164 Å²	164	133.3 Å²	133.3	88%	0.877	69%	0.692	S	S	*	*	S	Bend	trans	-89.3	15.2	170.8	-87.1	-24.4	0	0	0	113.7
859	N	34.2	Very low	32.7	Very low	142 Å²	142	132.8 Å²	132.8	76%	0.759	69%	0.693	S	S	*	*	S	Bend	trans	-141.9	149.7	170.8	-81.9	-66.7	0	0	0	112	N857	N857-N859 VanDerWaalsContact C-N 3.31Å
860	I	31.8	Very low	32.2	Very low	165 Å²	165	134.5 Å²	134.5	85%	0.846	70%	0.702	S	S	*	*			trans	77.2	65.6	178.1	-40.7	177.3	0	0	0	114.8
861	I	32.4	Very low	31.5	Very low	156 Å²	156	134.6 Å²	134.6	80%	0.8	71%	0.709	S	S	*	*			trans	-95.8	145.8	136.4	-55.8	-179.9	0	0	0	107.3
862	T	31.1	Very low	30.9	Very low	115 Å²	115	135 Å²	135	71%	0.706	72%	0.723	S	S	*	*			trans	86.6	138.4	160.9	-1.1	0	0	0	0	120.2
863	L	31.5	Very low	30.4	Very low	154 Å²	154	137.6 Å²	137.6	81%	0.806	73%	0.728	S	S	*	*			trans	77.4	98.6	165.4	-51.3	176.1	0	0	0	115.4
864	N	28.5	Very low	30.3	Very low	133 Å²	133	144.5 Å²	144.5	71%	0.711	75%	0.75	S	S	*	*			cis	78.4	123.4	49.9	-160.8	21.1	0	0	0	114.2
865	N	29.2	Very low	30.1	Very low	125 Å²	125	147.6 Å²	147.6	67%	0.668	75%	0.754	S	S	*	*			trans	72.9	120.9	169.1	-68.5	-34.5	0	0	0	121.4
866	N	30.4	Very low	30	Very low	134 Å²	134	147 Å²	147	72%	0.717	76%	0.757	S	S	*	*			trans	78.7	107.5	140.8	-63	-17.4	0	0	0	121.6
867	N	28.3	Very low	29.9	Very low	134 Å²	134	149.3 Å²	149.3	72%	0.717	76%	0.763	S	S	*	*				69.8	120.1	128.9	-66.7	-9.8	0	0	0	121.4
868	N	28.5	Very low	30	Very low	130 Å²	130	149.4 Å²	149.4	70%	0.695	77%	0.769	S	S	*	*			trans	84.9	118.5	136.8	-64.1	-8.3	0	0	0	120.2
869	N	29.2	Very low	30	Very low	131 Å²	131	149.9 Å²	149.9	70%	0.701	76%	0.764	S	S	*	*			trans	90.4	112.2	138.8	-62.4	-11.1	0	0	0	120.4
870	Q	27.9	Very low	30	Very low	167 Å²	167	148.9 Å²	148.9	78%	0.78	76%	0.756	S	S	*	*				77.1	100.4	128.2	-70.1	179.9	-18.9	0	0	119.6
871	S	23.7	Very low	30	Very low	96 Å²	96	145.5 Å²	145.5	67%	0.671	74%	0.74	S	S	*	*				47.6	128.3	123.9	63.3	0	0	0	0	120.6
872	T	29.3	Very low	30	Very low	141 Å²	141	146.5 Å²	146.5	87%	0.865	74%	0.735	S	S	*	*				-172.4	162.6	102.2	23.4	0	0	0	0	113.1
873	Y	25	Very low	30	Very low	208 Å²	208	147.3 Å²	147.3	82%	0.816	74%	0.735	S	S	*	*			trans	-75.2	160.4	-178.4	-81	-112.2	0	0	0	113.8
874	Y	29.9	Very low	29.9	Very low	229 Å²	229	144.7 Å²	144.7	90%	0.898	73%	0.725	S	S	*	*				-178.1	100	126.8	-88.5	-65.1	0	0	0	107.3
875	H	27.3	Very low	30	Very low	150 Å²	150	147.3 Å²	147.3	69%	0.694	73%	0.733	S	S	*	*				68.1	113.5	69.8	-154.7	37.2	0	0	0	114.5
876	N	30.9	Very low	30.1	Very low	166 Å²	166	144.9 Å²	144.9	89%	0.888	74%	0.738	S	S	*	*			trans	-164	128.7	145.1	-96.3	-32.5	0	0	0	112.1
877	K	34.7	Very low	30.3	Very low	181 Å²	181	147.2 Å²	147.2	79%	0.787	75%	0.749	S	S	*	*			trans	-132.8	156.3	169	-111.3	-165.9	179.3	-170.7	0	107.2
878	P	33.8	Very low	30.3	Very low	116 Å²	116	151.4 Å²	151.4	75%	0.753	76%	0.755	S	S	*	*				-128.8	137.1	128.4	0.5	22	0	0	0	111.6
879	F	31.6	Very low	30.6	Very low	174 Å²	174	152.1 Å²	152.1	76%	0.763	76%	0.759	S	S	*	*				75.8	139.7	81.9	-83.9	-148.5	0	0	0	113
880	M	34.5	Very low	30.7	Very low	122 Å²	122	156.2 Å²	156.2	60%	0.601	77%	0.765	S	S	*	*			cis	-163.2	177.8	3.4	-102	-14.4	-149.3	0	0	108.7
881	D	31.5	Very low	30.8	Very low	94 Å²	94	155.1 Å²	155.1	50%	0.503	76%	0.763	S	S	.	*			cis	-179.8	176.1	-29.8	-167.1	7.4	0	0	0	109.5
882	Y	32.7	Very low	31.1	Very low	177 Å²	177	155.6 Å²	155.6	69%	0.694	76%	0.762	S	S	*	*			trans	75.3	118.8	169.1	-57.3	-69.1	0	0	0	119.3
883	N	31.4	Very low	31.1	Very low	131 Å²	131	157.9 Å²	157.9	70%	0.701	76%	0.761	S	S	*	*				91.7	141.4	55.9	-96.3	0.1	0	0	0	113.7
884	T	30.6	Very low	31.3	Very low	99 Å²	99	155.7 Å²	155.7	61%	0.607	76%	0.757	S	S	*	*			cis	-170.2	163.7	-16.1	3.3	0	0	0	0	112.1
885	Q	30.6	Very low	31.3	Very low	188 Å²	188	150 Å²	150	88%	0.879	75%	0.749	S	S	*	*			trans	79.3	130.7	143.9	-76.5	171.3	43.6	0	0	124.5
886	G	31.4	Very low	31.3	Very low	74 Å²	74	148.2 Å²	148.2	76%	0.763	75%	0.753	S	S	*	*			trans	93	141	146.1	0	0	0	0	0	117.5
887	L	33.8	Very low	31.4	Very low	184 Å²	184	146.9 Å²	146.9	96%	0.963	75%	0.751	S	S	*	*			cis	-151.8	167.3	-5.2	-100.8	168.7	0	0	0	110
888	R	29	Very low	31.1	Very low	222 Å²	222	144.1 Å²	144.1	84%	0.838	75%	0.749	S	S	*	*			trans	-85.4	171.5	-171.5	-65.5	176.7	170.4	169.8	-3	115.2
889	N	34.5	Very low	30.9	Very low	145 Å²	145	148.4 Å²	148.4	78%	0.775	75%	0.752	S	S	*	*			trans	106.4	142.6	149.7	-62.3	-27	0	0	0	115.9
890	R	30.7	Very low	30.8	Very low	217 Å²	217	145 Å²	145	82%	0.819	75%	0.745	S	S	*	*			cis	-172.2	173.6	-15.8	-162.3	176.9	-165.3	-148.6	6.4	108.2
891	L	31	Very low	30.6	Very low	143 Å²	143	146.2 Å²	146.2	75%	0.749	76%	0.76	S	S	*	*			trans	84.5	114.4	170.7	-49.9	162.5	0	0	0	114.3
892	T	28.4	Very low	30.5	Very low	106 Å²	106	147.7 Å²	147.7	65%	0.65	77%	0.772	S	S	*	*				68.9	114.5	54.9	68.3	0	0	0	0	115.5
893	F	29.2	Very low	30.4	Very low	190 Å²	190	146 Å²	146	83%	0.833	78%	0.781	S	S	*	*				177.2	137.2	116.5	-101.3	-72.6	0	0	0	114.9
894	H	30.4	Very low	30.3	Very low	161 Å²	161	145.8 Å²	145.8	75%	0.745	78%	0.784	S	S	*	*			trans	43.1	136.9	149.6	-110.4	-92.2	0	0	0	125.1
895	P	29.6	Very low	30.4	Very low	110 Å²	110	149.4 Å²	149.4	71%	0.714	80%	0.798	S	S	*	*			trans	-96.6	139.4	161.4	36.4	-30	0	0	0	112.7
896	S	28.1	Very low	30.3	Very low	112 Å²	112	144.1 Å²	144.1	78%	0.783	79%	0.787	S	S	*	*			trans	176.7	119.5	154.5	-82.3	0	0	0	0	112.1
897	T	31.4	Very low	30.4	Very low	138 Å²	138	145.7 Å²	145.7	85%	0.847	79%	0.786	S	S	*	*			trans	-163	128.3	146.3	13.7	0	0	0	0	111.2
898	V	29	Very low	30.4	Very low	124 Å²	124	143 Å²	143	75%	0.752	77%	0.773	S	S	*	*			trans	-119.1	126.3	169.1	169.8	0	0	0	0	106.9
899	Y	29.6	Very low	30.4	Very low	206 Å²	206	140 Å²	140	81%	0.808	77%	0.77	S	S	*	*			trans	-152.4	96.2	160.8	-81.3	-68	0	0	0	108
900	T	29.1	Very low	30.4	Very low	102 Å²	102	140.1 Å²	140.1	63%	0.626	77%	0.769	S	S	*	*				67.7	107.8	94.3	59.9	0	0	0	0	115.3
901	T	30.1	Very low	30.5	Very low	148 Å²	148	135 Å²	135	91%	0.908	76%	0.762	S	S	*	*			trans	-116.9	105.4	153.6	39.8	0	0	0	0	108.8
902	T	29.9	Very low	30.7	Very low	125 Å²	125	135.3 Å²	135.3	77%	0.767	76%	0.764	S	S	*	*			trans	-93.3	126.1	176.9	43.9	0	0	0	0	111
903	T	31.6	Very low	31	Very low	142 Å²	142	138 Å²	138	87%	0.871	78%	0.775	S	S	*	*			trans	-130.7	104.1	161.7	-44.9	0	0	0	0	109.1
904	T	29.1	Very low	31.3	Very low	125 Å²	125	133.4 Å²	133.4	77%	0.767	77%	0.772	S	S	*	*			trans	-78.2	154.2	174.7	25.3	0	0	0	0	112.1
905	I	31.4	Very low	31.4	Very low	175 Å²	175	133 Å²	133	90%	0.897	78%	0.775	S	S	*	*			trans	154	139	151.9	-83.6	153.4	0	0	0	107.7
906	A	29.7	Very low	31.6	Very low	78 Å²	78	133.3 Å²	133.3	65%	0.645	78%	0.775	S	S	*	*			cis	-170.8	168.6	-30.1	0	0	0	0	0	107.5
907	S	32.7	Very low	31.7	Very low	106 Å²	106	134.7 Å²	134.7	74%	0.741	77%	0.774	S	S	*	*			trans	78.8	137.4	168.7	-28.4	0	0	0	0	116.5
908	N	33.7	Very low	31.8	Very low	129 Å²	129	134 Å²	134	69%	0.69	77%	0.769	S	S	*	*			cis	-178.6	135.4	-24.1	-105.5	-5.9	0	0	0	104.9
909	M	29.9	Very low	32	Very low	159 Å²	159	133.5 Å²	133.5	78%	0.783	77%	0.767	S	S	*	*			trans	37.7	130.7	133.1	-46.6	178.3	-173.7	0	0	118.4
910	I	34.1	Very low	32.2	Very low	147 Å²	147	130.1 Å²	130.1	75%	0.754	76%	0.763	S	S	*	*				-169.5	116.5	75.2	-84.3	157.6	0	0	0	105
911	T	33.7	Very low	32.5	Very low	109 Å²	109	130.9 Å²	130.9	67%	0.669	76%	0.763	S	S	*	*				38.4	140.6	102.8	81.8	0	0	0	0	115.1
912	D	34.6	Very low	32.7	Very low	149 Å²	149	131.2 Å²	131.2	80%	0.797	75%	0.754	S	S	*	*			cis	-149.1	165.3	30.9	-88.5	-70.7	0	0	0	113.6
913	N	33.9	Very low	33.1	Very low	164 Å²	164	131.5 Å²	131.5	88%	0.877	76%	0.756	S	S	*	*			trans	-71.8	146.5	168.7	-76.3	-40.6	0	0	0	111.9
914	A	34.9	Very low	33	Very low	93 Å²	93	132.1 Å²	132.1	77%	0.769	75%	0.754	S	S	*	*				175	108.1	115.5	0	0	0	0	0	113.3
915	N	34	Very low	33.5	Very low	153 Å²	153	131.8 Å²	131.8	82%	0.818	75%	0.754	S	S	*	*				33.4	142.7	128.3	-76.6	-4.7	0	0	0	123.3
916	T	33.5	Very low	33.5	Very low	115 Å²	115	131.3 Å²	131.3	71%	0.706	75%	0.75	S	S	*	*			trans	89.8	101.4	152.4	56.2	0	0	0	0	120.8
917	N	30.6	Very low	33.8	Very low	142 Å²	142	134.1 Å²	134.1	76%	0.759	75%	0.754	S	S	*	*				80.5	161.1	123.6	-63.8	-10.8	0	0	0	120.8
918	T	32.4	Very low	33.9	Very low	122 Å²	122	140.6 Å²	140.6	75%	0.748	78%	0.778	S	S	*	*			trans	72.3	87.2	166.5	47.7	0	0	0	0	118.3
919	T	32.5	Very low	33.9	Very low	115 Å²	115	141.2 Å²	141.2	71%	0.706	78%	0.782	S	S	*	*				58.8	137.8	114.5	56.9	0	0	0	0	121.4
920	N	34.6	Very low	34.1	Very low	134 Å²	134	140.2 Å²	140.2	72%	0.717	78%	0.782	S	S	*	*			trans	91.8	117.8	150	-58.2	-18.4	0	0	0	118.4
921	N	35.5	Very low	34.1	Very low	119 Å²	119	139.8 Å²	139.8	64%	0.636	78%	0.784	S	S	*	*				73.9	121.2	127.4	-73.8	27.8	0	0	0	121.5
922	E	35.1	Very low	34.2	Very low	154 Å²	154	141.6 Å²	141.6	72%	0.72	79%	0.79	S	S	*	*				85.4	125.8	124.9	-69.7	169.5	146.3	0	0	120
923	T	37.8	Very low	34.1	Very low	131 Å²	131	141.2 Å²	141.2	80%	0.804	79%	0.79	S	S	*	*			trans	72.3	102.2	144.6	52.7	0	0	0	0	119.9
924	N	30.3	Very low	34.1	Very low	156 Å²	156	139.7 Å²	139.7	83%	0.834	78%	0.784	S	S	*	*			trans	-33.3	141.9	131.9	-86.9	-21.2	0	0	0	111.5
925	P	38.5	Very low	34.1	Very low	118 Å²	118	143 Å²	143	77%	0.766	79%	0.785	S	S	*	*				-147.1	154.5	81.8	37.6	-20.1	0	0	0	118.3
926	M	32.4	Very low	34.1	Very low	164 Å²	164	142.2 Å²	142.2	81%	0.808	78%	0.783	S	S	*	*			trans	6.4	153.3	140.3	-98.1	-176.1	-177	0	0	122.8
927	N	35.2	Very low	34.1	Very low	137 Å²	137	144.5 Å²	144.5	73%	0.733	79%	0.789	S	S	*	*			trans	84.1	104.3	152.7	-61.6	-14.2	0	0	0	118.7
928	I	34.8	Very low	34.5	Very low	242 Å²	242	144.7 Å²	144.7	100%	1.241	79%	0.792	S	S	*	*				-126.4	0	90.8	-61.8	-172.8	0	0	0	108.4

Retrieved 928 of 928 residues in 145.6 ms (Link to these results)

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